data_1du9_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 1du9 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.556 -0.218 . . . . 3.82 112.556 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.11 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.16 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.47 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.65 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.62 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.95 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 4.38 111.027 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.85 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.63 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 3.28 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.71 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.97 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.72 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.96 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.7 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.44 110.976 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.89 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.45 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.88 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.42 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.78 110.885 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.69 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.38 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 3.04 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.56 -0.216 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.401 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 52.1 m-70 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.486 -0.245 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.4 ' CG2' ' CB ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.4 ' CB ' ' CG2' ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.406 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.527 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.377 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.549 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.589 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.589 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.514 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.459 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.549 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.514 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.514 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.525 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.411 HG23 ' CD2' ' A' ' 9' ' ' HIS . 2.9 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.823 0.344 . . . . 6.69 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.74 173.49 31.72 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.805 -0.712 . . . . 3.82 112.556 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.11 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.16 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.47 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.65 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.62 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.95 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.411 ' CD2' HG23 ' A' ' 1' ' ' VAL . 1.8 m-70 -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 4.38 111.027 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.85 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.63 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 3.28 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.71 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.97 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.72 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.96 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.7 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.44 110.976 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.89 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.45 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.88 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.42 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.78 110.885 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.69 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.38 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 3.04 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.75 147.92 23.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.515 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -145.54 147.04 17.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.56 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.818 0.342 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.54 114.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.555 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.0 m . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.31 -90.68 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.578 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.808 0.337 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.2 152.12 18.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.499 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.42 HG13 ' CD2' ' A' ' 9' ' ' HIS . 3.9 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.839 0.352 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.67 173.04 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.509 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.42 ' CD2' HG13 ' A' ' 1' ' ' VAL . 52.1 m-70 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.792 0.329 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.6 162.72 40.92 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.507 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 26.5 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.835 0.35 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -117.74 -165.23 13.5 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.486 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.4 ' CG2' ' CB ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.4 ' CB ' ' CG2' ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.89 -152.52 5.67 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.477 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.94 118.8 9.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.496 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.413 HG13 ' CD2' ' A' ' 9' ' ' HIS . 29.0 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.869 0.366 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.61 -172.28 17.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.479 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.413 ' CD2' HG13 ' A' ' 1' ' ' VAL . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.839 0.352 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -120.15 158.77 15.29 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.509 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 152.18 169.26 17.4 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.539 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.527 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.781 0.324 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.59 -104.74 0.41 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.474 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.851 0.357 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.85 -123.08 1.26 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.5 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.876 0.37 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.05 -106.13 0.45 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.472 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.549 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.821 0.343 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.62 164.39 12.08 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.503 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.839 0.352 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.96 -132.39 6.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.493 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.589 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.589 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 2.9 t . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.87 -168.92 29.91 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.493 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.446 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.778 0.323 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.56 -155.16 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.483 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.539 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.846 0.355 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.97 -165.84 28.32 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.548 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.514 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.459 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.87 177.06 10.48 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.464 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.549 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.775 0.322 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.43 -178.98 17.23 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.5 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.514 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.514 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.419 ' CG1' ' CD2' ' A' ' 9' ' ' HIS . 2.9 t . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.8 172.32 32.89 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.537 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.525 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.435 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.556 -0.218 . . . . 3.76 112.556 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.11 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.16 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.47 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.65 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.28 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.52 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 3.47 111.027 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.85 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.18 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 2.69 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.34 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.47 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.4 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.62 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.35 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.868 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.03 110.976 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.46 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.45 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.47 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.42 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.868 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.23 110.885 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.69 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.2 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 2.65 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.851 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.851 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.56 -0.216 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.495 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.514 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.85 ' O ' HG22 ' A' ' 18' ' ' THR . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.545 ' OXT' HG22 ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.401 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.899 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.899 ' O ' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.576 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 7' ' ' PRO . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.593 ' O ' HG12 ' A' ' 28' ' ' VAL . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.486 -0.245 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.7 m170 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.89 ' O ' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.452 ' OXT' HG22 ' A' ' 28' ' ' VAL . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CD ' ' HD2' ' A' ' 17' ' ' PRO . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD2' ' CD ' ' A' ' 16' ' ' LYS . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.555 HG12 ' OXT' ' A' ' 28' ' ' VAL . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 25' ' ' ASN . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.816 ' O ' HG22 ' A' ' 18' ' ' THR . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.753 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.406 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.54 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.903 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.903 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 28' ' ' VAL . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.57 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.377 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 24' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.646 ' HG2' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB3' ' HG2' ' A' ' 11' ' ' LYS . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 20' ' ' ASP . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.614 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.563 ' C ' ' CD2' ' A' ' 9' ' ' HIS . 0.7 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.865 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.865 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.584 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 8' ' ' MET . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE2' ' HG2' ' A' ' 5' ' ' GLU . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.57 ' C ' ' CD2' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 28' ' ' VAL . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.0 m120 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.526 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.528 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.893 ' O ' HG22 ' A' ' 18' ' ' THR . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.586 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.439 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.823 0.344 . . . . 6.31 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -152.74 173.49 31.72 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.805 -0.712 . . . . 3.76 112.556 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.11 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.16 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.47 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.65 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.28 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.52 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 3.47 111.027 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.85 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.18 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 2.69 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.34 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.47 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.4 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.62 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.35 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.868 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.03 110.976 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.46 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.45 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.47 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.42 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.868 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.23 110.885 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.69 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.2 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 2.65 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.957 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.442 ' N ' HG12 ' A' ' 1' ' ' VAL . . . 97.75 147.92 23.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.515 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.3 m170 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.851 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.851 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -145.54 147.04 17.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.56 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.495 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.514 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.818 0.342 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.54 114.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.555 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.85 ' O ' HG22 ' A' ' 18' ' ' THR . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.545 ' OXT' HG22 ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.0 m . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.31 -90.68 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.578 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.808 0.337 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.2 152.12 18.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.499 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.899 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.899 ' O ' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 24' ' ' CYS . 3.9 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.839 0.352 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.67 173.04 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.509 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.637 ' HB3' HG23 ' A' ' 1' ' ' VAL . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.576 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.792 0.329 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.6 162.72 40.92 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.507 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 7' ' ' PRO . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.593 ' O ' HG12 ' A' ' 28' ' ' VAL . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 26.5 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.835 0.35 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -117.74 -165.23 13.5 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.486 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.89 ' O ' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.89 -152.52 5.67 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.477 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.452 ' OXT' HG22 ' A' ' 28' ' ' VAL . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.94 118.8 9.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.496 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CD ' ' HD2' ' A' ' 17' ' ' PRO . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD2' ' CD ' ' A' ' 16' ' ' LYS . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.555 HG12 ' OXT' ' A' ' 28' ' ' VAL . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.869 0.366 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.61 -172.28 17.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.479 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 25' ' ' ASN . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.816 ' O ' HG22 ' A' ' 18' ' ' THR . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.839 0.352 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.429 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -120.15 158.77 15.29 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.509 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.753 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.435 ' N ' HG12 ' A' ' 1' ' ' VAL . . . 152.18 169.26 17.4 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.539 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.54 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.903 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.903 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 28' ' ' VAL . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.781 0.324 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.59 -104.74 0.41 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.474 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.57 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.851 0.357 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.85 -123.08 1.26 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 24' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.876 0.37 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.05 -106.13 0.45 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.472 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.821 0.343 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.62 164.39 12.08 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.503 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.646 ' HG2' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB3' ' HG2' ' A' ' 11' ' ' LYS . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 20' ' ' ASP . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.839 0.352 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.96 -132.39 6.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.493 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.614 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.432 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -76.87 -168.92 29.91 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.493 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.563 ' C ' ' CD2' ' A' ' 9' ' ' HIS . 0.7 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.865 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.865 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.584 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 24.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.778 0.323 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.56 -155.16 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.483 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 8' ' ' MET . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE2' ' HG2' ' A' ' 5' ' ' GLU . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.57 ' C ' ' CD2' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 28' ' ' VAL . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.846 0.355 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.97 -165.84 28.32 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.548 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.0 m120 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.424 HG23 ' HB3' ' A' ' 24' ' ' CYS . 12.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.118 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.87 177.06 10.48 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.464 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' HB3' HG23 ' A' ' 1' ' ' VAL . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.775 0.322 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.43 -178.98 17.23 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.5 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.526 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.539 HG11 ' CD2' ' A' ' 9' ' ' HIS . 2.9 t . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.442 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -67.8 172.32 32.89 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.537 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.539 ' CD2' HG11 ' A' ' 1' ' ' VAL . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.893 ' O ' HG22 ' A' ' 18' ' ' THR . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.586 HG13 ' OXT' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 112.556 -0.218 . . . . 3.7599999999999998 112.556 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.1099999999999999 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.1600000000000001 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.4700000000000002 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.6499999999999999 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.2799999999999998 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.52 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 3.4700000000000002 111.027 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.8500000000000001 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.1799999999999997 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 2.6899999999999999 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.3399999999999999 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.4700000000000002 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.3999999999999999 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.6200000000000001 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.3500000000000001 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.868 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.0299999999999998 110.976 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.46 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.4500000000000002 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7000000000000002 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.47 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.4199999999999999 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.868 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.23 110.885 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.6899999999999999 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.2000000000000002 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 2.6499999999999999 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.851 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.851 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.56 -0.216 . . . . 0.0 112.56 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.495 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.514 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.85 ' O ' HG22 ' A' ' 18' ' ' THR . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.545 HG22 ' OXT' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.401 0 N-CA-C 112.578 -0.209 . . . . 0.0 112.578 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.899 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.899 ' O ' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 52.1 m-70 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.576 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 N-CA-C 112.507 -0.237 . . . . 0.0 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 7' ' ' PRO . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 28' ' ' VAL . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 112.486 -0.245 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.89 ' O ' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.452 HG22 ' OXT' ' A' ' 28' ' ' VAL . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CD ' ' HD2' ' A' ' 17' ' ' PRO . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD2' ' CD ' ' A' ' 16' ' ' LYS . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.555 HG12 ' OXT' ' A' ' 28' ' ' VAL . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 25' ' ' ASN . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.816 ' O ' HG22 ' A' ' 18' ' ' THR . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.753 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.406 0 N-CA-C 112.539 -0.224 . . . . 0.0 112.539 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.54 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.903 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.903 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 28' ' ' VAL . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.57 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.377 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 24' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.503 -0.239 . . . . 0.0 112.503 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.646 ' HG2' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB3' ' HG2' ' A' ' 11' ' ' LYS . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 20' ' ' ASP . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.614 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.614 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.575 ' HA ' ' HD2' ' A' ' 9' ' ' HIS . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.865 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.865 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.584 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 8' ' ' MET . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.563 ' HA ' ' HD2' ' A' ' 9' ' ' HIS . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE2' ' HG2' ' A' ' 5' ' ' GLU . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.563 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.579 HG12 ' O ' ' A' ' 28' ' ' VAL . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.548 -0.221 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.464 -0.254 . . . . 0.0 112.464 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.573 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.526 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.528 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.893 ' O ' HG22 ' A' ' 18' ' ' THR . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.586 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.502 HG13 ' HD2' ' A' ' 9' ' ' HIS . 2.9 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.823 0.344 . . . . 6.3099999999999996 110.984 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.439 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -152.74 173.49 31.72 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.805 -0.712 . . . . 3.7599999999999998 112.556 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.45 -28.91 65.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.781 0.324 . . . . 2.1099999999999999 110.953 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -97.9 3.54 49.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.266 -0.424 . . . . 5.1600000000000001 111.573 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -136.71 22.46 3.11 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.895 -0.593 . . . . 3.4700000000000002 111.223 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.483 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -80.35 -51.46 1.04 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.065 0.46 . . . . 1.6499999999999999 111.411 179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.483 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.0 Cg_exo -48.55 -37.03 33.16 Favored 'Trans proline' 0 N--CA 1.465 -0.154 0 C-N-CA 123.248 2.632 . . . . 2.2799999999999998 112.474 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 23.6 mtp -68.34 -50.91 50.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 3.52 111.11 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.502 ' HD2' HG13 ' A' ' 1' ' ' VAL . 1.8 m-70 -58.49 -77.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.292 -0.413 . . . . 3.4700000000000002 111.027 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 t -82.16 112.88 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.305 -0.407 . . . . 1.8500000000000001 110.924 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt -141.03 115.61 9.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 5.1799999999999997 110.89 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.48 -102.26 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.785 -0.721 . . . . 2.6899999999999999 112.507 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.6 tptp -157.18 -41.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.823 0.344 . . . . 5.3399999999999999 111.081 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -123.82 33.61 5.27 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 121.143 0.497 . . . . 3.4700000000000002 109.697 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.28 99.51 6.74 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.422 -0.808 . . . . 1.3999999999999999 111.131 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -90.87 131.5 37.27 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.358 -0.383 . . . . 4.6200000000000001 110.929 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -79.76 149.61 20.82 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.706 2.271 . . . . 2.3500000000000001 112.453 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.868 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.0 t -137.98 152.91 49.37 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.242 -0.435 . . . . 2.0299999999999998 110.976 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 m -116.18 118.22 32.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.252 -0.431 . . . . 1.46 111.051 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -128.94 104.91 7.87 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.055 -0.521 . . . . 2.4500000000000002 110.628 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 51.83 50.87 17.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.058 0.456 . . . . 2.7000000000000002 110.621 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.4 16.71 67.62 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.784 -0.644 . . . . 1.24 112.813 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 34.3 t -114.33 102.53 13.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.776 0.322 . . . . 1.47 110.884 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.02 142.1 49.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 1.4199999999999999 110.831 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.868 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.18 124.88 3.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.196 -0.457 . . . . 2.23 110.885 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 11.7 p -100.3 132.87 45.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.002 -0.545 . . . . 1.6899999999999999 110.822 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 70.0 m-20 -128.28 -84.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.221 -0.445 . . . . 2.2000000000000002 111.074 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.24 -0.886 . . . . 2.6499999999999999 111.121 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.442 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.957 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.442 ' N ' HG12 ' A' ' 1' ' ' VAL . . . 97.75 147.92 23.09 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.515 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.5 -26.7 34.96 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 0.0 111.002 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -86.02 3.08 43.88 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.573 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -125.17 28.15 6.45 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.994 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.76 -51.26 1.83 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.054 0.454 . . . . 0.0 111.47 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 70.9 Cg_exo -46.93 -27.76 6.25 Favored 'Trans proline' 0 N--CA 1.465 -0.184 0 C-N-CA 123.263 2.642 . . . . 0.0 112.476 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.9 ttp -92.05 -32.54 15.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.911 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.9 m-70 -99.94 67.12 1.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.962 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -177.5 123.88 0.13 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.182 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.2 tttp -93.2 152.21 19.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.428 179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 130.59 105.43 1.09 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.546 -0.835 . . . . 0.0 112.376 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -57.25 -22.61 42.5 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.711 179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -130.32 36.16 4.0 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.276 179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -119.38 100.86 7.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.984 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -84.84 130.68 51.79 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.76 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.68 145.2 28.94 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.616 2.21 . . . . 0.0 112.678 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.851 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.4 t -136.4 153.22 51.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.776 179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.5 m -106.0 123.47 48.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.02 -179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -127.21 103.91 7.67 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.505 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 51.91 51.04 17.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.057 0.456 . . . . 0.0 110.462 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.95 17.96 66.02 Favored Glycine 0 N--CA 1.442 -0.96 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.76 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.3 t -118.43 104.78 16.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.772 0.32 . . . . 0.0 111.033 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.57 137.69 58.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.657 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.851 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.33 126.68 4.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.979 -179.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.9 166.29 23.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -157.89 -85.43 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.069 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.205 -0.903 . . . . 0.0 111.108 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -145.54 147.04 17.87 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.56 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 t -78.87 -30.02 44.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.819 0.342 . . . . 0.0 110.97 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -87.35 3.22 47.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.023 0.44 . . . . 0.0 111.548 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -142.37 29.63 1.59 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.861 -0.608 . . . . 0.0 110.976 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.0 OUTLIER -75.95 -51.82 2.78 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.382 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.484 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.62 -28.15 6.12 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 123.319 2.679 . . . . 0.0 112.496 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -30.51 48.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.952 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 25.2 m-70 -79.01 -65.82 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.942 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.48 128.79 37.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.928 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.1 pttp -82.16 163.09 22.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.801 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.495 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 132.1 103.77 0.92 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.506 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -60.39 -23.66 64.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.649 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -128.88 34.74 4.42 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.126 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -123.12 104.09 8.97 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.836 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.72 130.64 52.23 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.887 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.405 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 94.2 Cg_endo -79.07 150.97 23.47 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.676 2.251 . . . . 0.0 112.571 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 25' ' ' ASN . 10.7 t -134.84 152.69 51.96 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.671 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.6 117.92 35.21 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.069 -179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -128.99 104.14 7.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.596 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.12 51.28 16.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.04 0.448 . . . . 0.0 110.566 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.31 16.36 64.74 Favored Glycine 0 N--CA 1.442 -0.963 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.833 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -116.51 104.35 16.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 120.781 0.324 . . . . 0.0 110.91 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -72.41 147.66 45.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.884 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.514 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.15 124.84 3.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.884 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -99.04 146.05 26.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.7 m-80 -147.25 -82.26 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.068 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.152 -179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.818 0.342 . . . . 0.0 111.141 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.54 114.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.555 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.55 -35.33 75.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -86.92 3.3 46.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.586 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -128.96 26.89 5.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.047 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.472 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -77.78 -52.44 1.64 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.054 0.454 . . . . 0.0 111.414 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.472 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.1 Cg_exo -46.75 -28.02 6.21 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.323 2.682 . . . . 0.0 112.467 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.52 -30.72 63.27 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.881 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.4 m-70 -83.68 -75.19 0.34 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 92.2 m -90.03 120.29 31.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.908 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.34 115.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.919 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.63 -83.68 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.492 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -157.32 -32.03 0.08 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.663 0.268 . . . . 0.0 111.423 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -131.49 33.0 4.11 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.01 110.85 6.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.015 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.9 ttpm? -117.02 135.22 22.99 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.024 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.403 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 71.3 Cg_endo -74.6 147.37 35.72 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.678 2.252 . . . . 0.0 112.309 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 25' ' ' ASN . 11.7 t -132.27 153.6 50.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.04 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -109.99 118.97 37.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.994 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -128.32 101.12 6.09 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.768 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 52.0 52.56 14.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.043 0.449 . . . . 0.0 110.664 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.54 13.69 63.52 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.871 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 27.7 t -114.47 102.52 13.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.799 0.333 . . . . 0.0 110.798 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -72.36 141.12 48.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.915 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.85 ' O ' HG22 ' A' ' 18' ' ' THR . 1.4 m-20 -160.18 124.82 3.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.855 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -96.66 139.28 32.97 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.833 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.0 m-80 -135.33 -86.17 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.545 HG22 ' OXT' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.256 -0.878 . . . . 0.0 111.047 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 9.0 m . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.808 0.337 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -152.31 -90.68 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.578 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.45 -19.86 12.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.648 0.261 . . . . 0.0 111.205 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -85.55 3.0 42.52 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.995 0.426 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -136.0 36.05 2.82 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.862 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.478 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.2 m -76.18 -52.12 2.54 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.496 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 73.3 Cg_exo -46.38 -54.91 4.2 Favored 'Trans proline' 0 N--CA 1.465 -0.186 0 C-N-CA 123.324 2.683 . . . . 0.0 112.632 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 17.4 mtm -58.67 -29.64 66.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.049 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 15.1 m-70 -88.78 144.53 26.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.949 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m 55.61 104.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.221 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 27.3 mtpt -138.62 116.68 11.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.936 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.05 -98.62 0.29 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.442 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.0 -42.04 0.05 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.785 0.326 . . . . 0.0 110.948 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -124.86 32.54 5.4 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 121.243 0.544 . . . . 0.0 109.592 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.78 100.71 7.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.156 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.5 ttpt -93.48 133.24 28.56 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.728 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -74.3 142.74 30.66 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.613 2.209 . . . . 0.0 112.558 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.27 143.43 50.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.853 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -101.56 116.17 32.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.046 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -128.81 103.3 6.97 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.669 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 52.26 51.5 16.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.019 0.438 . . . . 0.0 110.632 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.0 15.04 64.42 Favored Glycine 0 N--CA 1.441 -0.989 0 CA-C-N 115.83 -0.623 . . . . 0.0 112.873 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -115.27 103.29 15.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.817 0.341 . . . . 0.0 110.845 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.83 137.39 39.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.981 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.23 124.98 3.83 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.783 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 27.8 p -85.25 147.73 26.42 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.914 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -125.66 -81.81 0.63 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.548 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.512 -0.756 . . . . 0.0 111.059 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.808 0.337 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -126.2 152.12 18.13 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.711 -0.756 . . . . 0.0 112.499 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 m -61.61 -19.24 62.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.651 0.262 . . . . 0.0 111.166 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -85.0 2.8 41.5 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.918 0.39 . . . . 0.0 111.561 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -129.72 26.4 5.29 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.972 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.501 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -74.05 -53.07 4.08 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 111.452 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_endo -77.58 -4.4 14.57 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 123.169 2.579 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -99.31 -30.69 12.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.936 0.398 . . . . 0.0 110.512 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -79.27 -61.24 2.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.846 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 m -93.09 124.72 37.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.41 116.27 3.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.959 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -143.92 -96.83 0.23 Allowed Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.42 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.7 tptp -156.08 -40.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.86 0.362 . . . . 0.0 111.084 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.49 32.75 5.12 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.67 104.22 7.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.161 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -100.69 133.69 21.04 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.878 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.0 146.43 29.19 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.678 2.252 . . . . 0.0 112.443 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.899 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.0 t -133.26 153.54 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.4 m -106.86 117.73 34.81 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.982 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -127.58 103.12 7.15 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.512 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.89 51.54 16.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.67 16.54 65.81 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.807 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 38.5 t -117.43 103.73 15.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.805 0.336 . . . . 0.0 110.975 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.5 m -70.63 139.43 51.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.754 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.899 ' O ' HG22 ' A' ' 18' ' ' THR . 0.3 OUTLIER -160.24 125.07 3.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.932 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.7 p -94.45 148.73 21.94 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.737 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 50.7 m-20 -138.74 -86.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.191 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.222 -0.894 . . . . 0.0 111.183 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.637 HG23 ' HB3' ' A' ' 24' ' ' CYS . 3.9 m . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.839 0.352 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.67 173.04 38.24 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.509 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -28.69 15.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.727 0.299 . . . . 0.0 110.967 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mp0 -93.41 3.53 55.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.974 0.416 . . . . 0.0 111.579 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -131.81 28.89 4.51 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.065 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.454 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -77.85 -53.32 1.49 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.044 0.45 . . . . 0.0 111.374 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 72.8 Cg_exo -46.4 -27.99 5.52 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 123.359 2.706 . . . . 0.0 112.573 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.4 ttp -82.79 -29.78 29.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.028 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 52.1 m-70 -89.91 -30.92 17.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.997 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 m -130.39 121.52 26.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.972 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.93 142.33 53.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.758 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -104.75 48.75 0.96 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.663 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.5 tptt -119.24 -23.94 6.59 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.839 0.352 . . . . 0.0 111.357 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -142.11 29.08 1.67 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-O 121.474 0.654 . . . . 0.0 109.237 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 178.48 131.05 0.07 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.067 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 tttt -105.62 132.55 20.79 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.791 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.41 144.42 36.43 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.584 2.19 . . . . 0.0 112.493 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.1 t -130.35 153.5 48.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.841 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 56.9 m -110.68 118.44 36.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.935 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -128.64 102.28 6.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.625 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 52.24 51.97 15.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.044 0.45 . . . . 0.0 110.645 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.11 14.42 63.67 Favored Glycine 0 N--CA 1.442 -0.938 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.848 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 32.7 t -115.04 103.36 15.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.752 0.31 . . . . 0.0 110.857 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.637 ' HB3' HG23 ' A' ' 1' ' ' VAL . 0.7 OUTLIER -74.84 147.83 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.978 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.474 ' O ' HG22 ' A' ' 18' ' ' THR . 0.4 OUTLIER -160.18 124.84 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.79 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.0 p -94.52 124.38 38.51 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.772 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -132.9 -84.01 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.147 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.576 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.6 p . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.214 -0.898 . . . . 0.0 111.112 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.792 0.329 . . . . 0.0 111.134 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.6 162.72 40.92 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.507 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -88.24 -30.76 19.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.813 0.339 . . . . 0.0 110.895 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -90.39 3.22 54.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.578 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -111.83 19.63 17.79 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.187 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.8 OUTLIER -78.92 -52.87 1.2 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.078 0.466 . . . . 0.0 111.359 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.471 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.5 Cg_exo -46.73 -27.77 5.89 Favored 'Trans proline' 0 N--CA 1.465 -0.155 0 C-N-CA 123.318 2.679 . . . . 0.0 112.502 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.9 ttp -75.01 -29.85 60.97 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.993 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -71.75 -77.72 0.09 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.041 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 132.02 34.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.922 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -156.58 117.47 3.72 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.38 -94.94 0.18 Allowed Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -160.21 -37.34 0.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.808 0.337 . . . . 0.0 111.168 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.7 m-20 -129.94 31.69 4.66 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.59 110.6 6.87 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.994 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -110.44 134.49 20.82 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.442 ' HG3' ' HA ' ' A' ' 7' ' ' PRO . 72.2 Cg_endo -77.41 145.75 24.07 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.619 2.213 . . . . 0.0 112.473 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.7 130.26 36.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.815 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 14.4 p -84.74 125.05 32.21 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.005 0.431 . . . . 0.0 111.318 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -130.94 103.09 6.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.544 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 51.77 52.75 13.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.047 0.451 . . . . 0.0 110.542 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.06 14.23 65.61 Favored Glycine 0 N--CA 1.442 -0.958 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.872 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.2 t -119.32 97.09 4.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 110.981 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.8 t -70.46 138.02 50.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.872 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -160.14 122.63 3.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.825 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.432 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 14.2 p -95.51 150.41 20.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.959 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -127.35 -83.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.056 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 28' ' ' VAL . 17.3 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.088 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 26.5 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.835 0.35 . . . . 0.0 111.112 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -117.74 -165.23 13.5 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.486 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.5 m -101.66 -27.19 13.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.757 0.313 . . . . 0.0 110.968 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.94 2.65 41.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.967 0.413 . . . . 0.0 111.525 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -139.63 31.51 2.06 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.781 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.473 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.3 m -65.88 -52.29 42.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.384 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.473 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.61 -50.92 9.75 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 123.304 2.669 . . . . 0.0 112.582 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 18.0 ttp -65.36 -29.55 70.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.947 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -76.24 -31.18 58.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.995 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 13.7 m -143.05 129.19 19.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.924 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 160.99 3.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.855 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -124.22 48.45 0.96 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.581 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -124.17 -26.42 3.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.856 0.36 . . . . 0.0 111.32 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -140.43 29.21 1.99 Allowed 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -177.65 129.75 0.15 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.112 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.8 tttt -96.35 131.59 28.25 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.728 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -73.01 144.18 37.58 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.582 2.188 . . . . 0.0 112.453 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.89 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.5 t -138.06 154.49 49.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.928 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.8 m -119.03 119.22 33.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.97 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -127.62 103.31 7.25 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.53 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 51.67 51.54 16.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.051 0.453 . . . . 0.0 110.574 -179.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.69 16.91 66.37 Favored Glycine 0 N--CA 1.441 -0.968 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.835 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.5 t -117.89 103.61 15.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.771 0.32 . . . . 0.0 110.955 179.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 7.2 t -58.51 156.13 11.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.823 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.89 ' O ' HG22 ' A' ' 18' ' ' THR . 0.7 OUTLIER -160.15 124.78 3.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.961 179.953 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 32.1 p -124.01 126.0 45.53 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.726 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -127.18 -83.24 0.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.1 t . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.15 -179.943 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.799 0.333 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.89 -152.52 5.67 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.477 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.4 m -88.01 -24.3 23.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.764 0.316 . . . . 0.0 111.062 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -86.2 3.05 44.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.015 0.436 . . . . 0.0 111.638 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -118.01 25.61 10.23 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.458 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -78.03 -53.26 1.44 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.057 0.456 . . . . 0.0 111.327 -179.984 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.3 Cg_exo -46.64 -45.79 19.12 Favored 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 123.37 2.713 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.8 tmm? -67.91 -35.31 78.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.961 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -80.49 -75.36 0.27 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.951 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 17.5 m -79.17 169.63 17.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.972 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.31 163.31 18.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.891 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -132.11 60.89 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.772 -0.727 . . . . 0.0 112.535 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -155.18 -25.52 0.11 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.632 0.253 . . . . 0.0 111.654 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -139.32 29.53 2.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 179.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.03 128.75 0.23 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.068 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -101.56 132.27 21.97 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.79 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -72.43 141.89 35.91 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.546 2.164 . . . . 0.0 112.624 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.65 151.84 39.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.84 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.2 m -111.8 117.93 34.17 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.944 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -129.28 102.73 6.57 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.735 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 52.58 51.74 15.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.998 0.428 . . . . 0.0 110.706 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 13.76 62.73 Favored Glycine 0 N--CA 1.441 -0.973 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.879 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.7 t -113.78 103.5 15.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.849 0.356 . . . . 0.0 110.825 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -75.5 141.28 43.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.939 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -160.15 124.83 3.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.789 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 19.3 p -82.48 144.62 30.31 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.874 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -124.88 -82.16 0.64 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.973 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.452 HG22 ' OXT' ' A' ' 28' ' ' VAL . 10.5 p . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.253 -0.88 . . . . 0.0 111.064 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.816 0.341 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.94 118.8 9.14 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.496 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.3 m -59.16 -28.48 66.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.733 0.301 . . . . 0.0 110.977 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -90.01 3.36 53.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.997 0.427 . . . . 0.0 111.64 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -120.52 8.49 10.72 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.458 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.593 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 55.2 m -80.23 -41.97 1.36 Allowed Pre-proline 0 C--N 1.331 -0.233 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.593 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.0 Cg_exo -49.12 -25.97 10.05 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 123.031 2.488 . . . . 0.0 112.512 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.1 tmm? -81.27 -26.98 35.33 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.076 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -76.11 -77.49 0.13 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.078 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -83.97 116.49 22.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.991 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.13 121.09 8.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.073 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -140.86 -89.61 0.16 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.321 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -158.85 -41.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.98 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.5 m-80 -126.64 32.88 5.07 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -127.97 104.54 7.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.164 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.406 ' CD ' ' HD2' ' A' ' 17' ' ' PRO . 6.5 tppt? -109.45 133.4 20.85 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.816 179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' HD2' ' CD ' ' A' ' 16' ' ' LYS . 19.6 Cg_exo -64.98 131.48 29.0 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.638 2.225 . . . . 0.0 112.219 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.13 144.31 43.86 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.98 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -107.38 116.25 31.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.936 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -129.61 104.25 7.34 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.767 -179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 51.73 51.41 16.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.062 0.458 . . . . 0.0 110.743 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.35 14.68 66.97 Favored Glycine 0 N--CA 1.441 -0.978 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.95 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.5 t -112.29 101.43 12.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.799 0.333 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.7 133.65 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -160.27 124.35 3.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.81 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.72 131.23 35.89 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.762 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -121.72 -88.99 0.61 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.204 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.555 HG12 ' OXT' ' A' ' 28' ' ' VAL . 31.6 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 29.0 m . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.869 0.366 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.61 -172.28 17.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.479 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 4.9 m -71.31 -21.7 62.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.7 0.286 . . . . 0.0 111.118 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -84.94 2.87 40.93 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.964 0.412 . . . . 0.0 111.554 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -129.97 29.13 4.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.891 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.479 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 0.1 OUTLIER -76.67 -52.07 2.21 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.129 0.49 . . . . 0.0 111.413 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.479 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.4 Cg_exo -46.46 -28.05 5.71 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 123.335 2.69 . . . . 0.0 112.576 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.62 -37.09 28.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.937 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -98.9 173.93 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.921 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 56.78 -172.91 0.08 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.035 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.0 mtmt -103.2 161.84 13.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.718 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -134.51 54.42 0.76 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.65 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 6.8 mttm -161.02 -34.57 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.723 0.297 . . . . 0.0 111.423 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.45 29.58 3.59 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -160.2 120.45 2.92 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 114.96 -1.018 . . . . 0.0 111.323 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -98.81 130.89 26.71 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.762 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -80.95 150.14 18.05 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.695 2.263 . . . . 0.0 112.586 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.816 HG22 ' O ' ' A' ' 25' ' ' ASN . 1.3 t -131.12 142.33 50.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.746 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.7 m -99.46 116.76 32.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.119 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -127.49 103.35 7.3 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.432 179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 52.16 51.31 16.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.049 0.452 . . . . 0.0 110.428 -179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.81 16.66 66.3 Favored Glycine 0 N--CA 1.441 -1.0 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.791 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.4 t -118.71 108.43 24.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 120.733 0.302 . . . . 0.0 111.026 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 141.53 51.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.703 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.816 ' O ' HG22 ' A' ' 18' ' ' THR . 0.1 OUTLIER -160.27 125.54 3.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.017 0.436 . . . . 0.0 110.903 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 65.1 m -74.94 154.95 37.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.833 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -112.56 -69.99 0.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.133 0.492 . . . . 0.0 110.988 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.112 179.959 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.429 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.839 0.352 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.429 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -120.15 158.77 15.29 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.509 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.97 -12.04 61.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.63 0.252 . . . . 0.0 111.284 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -85.08 2.69 42.23 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.962 0.411 . . . . 0.0 111.567 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -123.69 18.35 9.51 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.124 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 1.8 m -80.35 -47.2 1.32 Allowed Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.816 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 63.5 Cg_endo -80.13 61.16 8.12 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.056 2.504 . . . . 0.0 112.251 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 ttm -176.96 -40.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.485 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -37.25 75.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.793 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 1.3 m -113.42 168.76 9.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -70.82 155.71 40.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.834 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.99 58.7 0.7 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.59 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -153.65 -25.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.682 0.277 . . . . 0.0 111.714 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -139.71 29.4 2.13 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -176.21 128.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.153 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.81 131.79 25.0 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.76 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.86 145.05 35.65 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.607 2.205 . . . . 0.0 112.439 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.753 HG22 ' O ' ' A' ' 25' ' ' ASN . 13.3 t -132.69 154.36 50.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.86 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.61 118.77 34.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.083 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -129.41 105.16 7.92 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.616 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 52.09 50.86 17.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.067 0.46 . . . . 0.0 110.652 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.28 16.75 65.25 Favored Glycine 0 N--CA 1.442 -0.966 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.885 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.6 t -116.58 104.73 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 10.4 t -71.06 147.88 48.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.929 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.753 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.13 124.74 3.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.842 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 22.9 p -99.27 131.75 45.07 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.83 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -138.37 -82.02 0.32 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.06 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.192 -179.948 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.435 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.435 ' N ' HG12 ' A' ' 1' ' ' VAL . . . 152.18 169.26 17.4 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.539 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -28.74 69.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.782 0.325 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -87.18 3.59 45.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.009 0.433 . . . . 0.0 111.568 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -100.18 -26.85 13.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.097 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.584 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 36.7 m -67.46 -42.65 38.62 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.758 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 58.4 Cg_exo -49.72 -24.99 10.65 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.836 2.357 . . . . 0.0 111.93 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.5 ttp -105.15 -36.67 7.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.139 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.54 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 1.0 OUTLIER -92.01 17.13 9.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.668 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 48.1 t -126.96 97.14 4.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.76 0.314 . . . . 0.0 111.009 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.54 151.11 33.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.413 179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 126.5 105.96 1.44 Allowed Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.319 -179.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.1 ttpm? -57.17 -22.34 39.69 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.966 0.413 . . . . 0.0 110.788 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -128.68 37.58 4.08 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.455 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -115.23 98.4 6.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.004 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.55 130.6 46.64 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.805 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -82.62 152.4 15.19 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.731 2.288 . . . . 0.0 112.561 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.903 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.0 t -135.73 151.58 50.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.723 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 23.5 m -110.32 118.13 35.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.113 -179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -127.18 103.64 7.53 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.414 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 51.97 51.18 16.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.113 0.482 . . . . 0.0 110.481 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.36 17.2 66.02 Favored Glycine 0 N--CA 1.442 -0.935 0 CA-C-N 115.723 -0.671 . . . . 0.0 112.825 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.2 t -117.97 104.26 15.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.716 0.293 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 52.0 t -64.84 147.02 54.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.903 ' O ' HG22 ' A' ' 18' ' ' THR . 0.9 OUTLIER -160.19 124.63 3.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.856 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 78.0 m -95.73 159.59 14.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 19.2 m-20 -143.5 -82.45 0.17 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.904 0.383 . . . . 0.0 111.111 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.613 HG22 ' O ' ' A' ' 28' ' ' VAL . 13.9 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.404 -0.808 . . . . 0.0 111.054 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 7.0 m . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.781 0.324 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.59 -104.74 0.41 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.474 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -110.72 -45.04 3.55 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.779 0.323 . . . . 0.0 110.89 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -56.11 -25.9 47.74 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.526 0.679 . . . . 0.0 111.482 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -109.99 23.92 13.71 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 114.767 -1.106 . . . . 0.0 111.126 179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 2.4 t -80.55 -45.63 1.31 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.785 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 76.8 Cg_exo -48.58 -26.75 9.55 Favored 'Trans proline' 0 N--CA 1.466 -0.127 0 C-N-CA 123.107 2.538 . . . . 0.0 112.462 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.93 -28.12 30.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.062 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -71.91 -79.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.142 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.5 p -70.33 115.77 9.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.871 0.367 . . . . 0.0 111.137 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 61.7 tttt -69.89 164.86 22.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.651 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 15' ' ' ALA . . . 140.91 103.75 0.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.463 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.4 mmtp -58.2 -22.44 51.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.975 0.417 . . . . 0.0 110.641 179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -131.92 34.65 3.82 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.103 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.57 ' HB3' ' HA3' ' A' ' 12' ' ' GLY . . . -124.6 103.35 8.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.871 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.84 131.3 49.6 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.749 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 40.5 Cg_endo -68.12 139.19 45.8 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.579 2.186 . . . . 0.0 112.547 -179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.75 142.76 51.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.834 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 m -107.06 119.98 40.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.034 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -129.32 105.58 8.22 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 51.7 50.71 18.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.094 0.474 . . . . 0.0 110.671 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.8 16.5 68.18 Favored Glycine 0 N--CA 1.441 -0.993 0 CA-C-N 115.755 -0.657 . . . . 0.0 112.835 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 28.0 t -112.99 102.37 13.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.904 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.66 131.26 40.75 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.919 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.29 126.23 4.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.593 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 1.3 m -74.93 163.89 27.15 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.921 -179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -149.3 -82.36 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.975 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.128 -179.979 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.851 0.357 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -148.85 -123.08 1.26 Allowed Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.502 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -106.21 -18.49 13.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.668 0.271 . . . . 0.0 111.201 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -82.77 1.15 40.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.902 0.382 . . . . 0.0 111.616 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -112.94 -26.19 8.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.903 179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 7' ' ' PRO . 0.9 OUTLIER -52.37 -51.13 75.41 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.777 179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 56.0 Cg_endo -77.2 59.27 6.52 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 123.022 2.481 . . . . 0.0 112.183 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 30.8 ttm 179.14 -37.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.443 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.36 56.23 3.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.9 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -170.57 -83.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt 59.11 115.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.946 0.403 . . . . 0.0 111.259 179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -150.43 -101.65 0.23 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.243 179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.7 -58.66 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.892 0.377 . . . . 0.0 110.704 179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -118.66 31.7 6.52 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.08 102.1 7.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.066 -0.97 . . . . 0.0 111.259 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.5 ttpm? -92.81 132.64 30.73 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.812 179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_endo -78.36 145.65 21.45 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.687 2.258 . . . . 0.0 112.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.15 127.64 16.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.843 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 23' ' ' VAL . 20.1 p -90.41 145.5 24.88 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.966 0.412 . . . . 0.0 111.236 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -132.79 96.23 3.76 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 49.91 57.33 6.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.334 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.96 -9.56 65.67 Favored Glycine 0 N--CA 1.44 -1.062 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.234 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.472 HG12 ' N ' ' A' ' 24' ' ' CYS . 20.9 t -94.5 159.08 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.81 0.338 . . . . 0.0 110.733 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 23' ' ' VAL . 0.9 OUTLIER -126.44 137.88 53.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.018 -179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -160.26 126.06 4.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.937 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 60.3 m -99.43 151.0 21.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.57 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -151.05 -86.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.837 0.351 . . . . 0.0 111.254 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.227 -0.892 . . . . 0.0 111.257 -179.856 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 8.3 m . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.876 0.37 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -147.05 -106.13 0.45 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.472 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -110.91 -31.55 7.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.799 0.333 . . . . 0.0 110.921 -179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.9 3.4 51.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.535 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.403 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 3.4 mt-10 -113.45 -0.05 14.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.489 -180.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.588 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 28.6 m -69.84 -42.5 18.43 Favored Pre-proline 0 C--N 1.331 -0.199 0 CA-C-O 120.743 0.306 . . . . 0.0 111.642 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 51.8 Cg_exo -51.63 -24.53 17.67 Favored 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.746 2.297 . . . . 0.0 111.855 179.265 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.9 mpp? -105.11 -35.56 7.57 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.236 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.561 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.7 OUTLIER -91.17 17.16 8.54 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -150.25 88.37 1.51 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.767 0.318 . . . . 0.0 111.175 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -63.25 163.75 9.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.505 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 139.26 104.68 0.62 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.54 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.6 mtpp -58.19 -22.26 50.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.921 0.391 . . . . 0.0 110.77 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -130.16 35.81 4.06 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.286 179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -121.01 101.85 7.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.632 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 20.0 ttpt -93.83 130.94 33.17 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.096 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 5.3 Cg_exo -76.44 125.31 8.27 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.868 2.379 . . . . 0.0 112.065 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -109.8 149.76 29.34 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 92.2 m -112.24 121.11 44.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.005 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -128.99 100.84 5.81 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.662 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 51.72 53.13 13.21 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.723 -179.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.16 14.02 63.14 Favored Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 121.045 -0.598 . . . . 0.0 112.861 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 31.0 t -115.14 103.58 15.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.828 0.347 . . . . 0.0 110.881 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.4 t -66.37 149.65 50.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.992 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -160.05 123.73 3.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.468 179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 3.9 m -93.98 134.89 35.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.024 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -140.9 -82.48 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.985 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.168 -179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 14.4 m . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.821 0.343 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -114.62 164.39 12.08 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.503 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.3 m -71.98 -20.38 61.74 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.691 0.281 . . . . 0.0 111.157 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -85.69 2.6 44.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 111.679 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -118.53 15.3 13.73 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.168 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.57 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 7.6 m -80.83 -44.11 1.25 Allowed Pre-proline 0 C--N 1.33 -0.272 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 59.6 Cg_endo -80.06 -26.95 4.02 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.887 2.391 . . . . 0.0 112.263 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.9 ttm -73.8 -28.76 61.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.986 0.422 . . . . 0.0 110.483 179.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -86.41 -52.87 5.33 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.817 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -178.7 4.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.834 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.646 ' HG2' ' HB3' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -89.41 162.48 15.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.774 179.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -133.31 58.42 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.59 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.12 -30.67 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.545 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -137.45 29.16 2.7 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.646 ' HB3' ' HG2' ' A' ' 11' ' ' LYS . . . -175.51 128.83 0.26 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.233 -179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -104.91 130.96 22.25 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.686 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.426 ' HB2' ' HB3' ' A' ' 6' ' ' CYS . 87.1 Cg_endo -84.35 147.08 11.25 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.745 2.297 . . . . 0.0 112.779 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -154.98 127.68 8.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.715 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 29.3 p -107.41 153.49 22.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.031 0.443 . . . . 0.0 111.408 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 23' ' ' VAL . 4.0 t70 -135.42 108.81 7.84 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.558 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 47.85 53.16 11.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 110.827 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 75.66 13.99 82.49 Favored Glycine 0 N--CA 1.441 -1.029 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.945 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 20' ' ' ASP . 34.8 t -111.34 99.11 8.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-O 120.749 0.309 . . . . 0.0 110.824 179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.79 136.87 51.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.104 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -160.28 126.03 4.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.897 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.85 152.78 21.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.452 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 10.6 m-20 -125.27 -93.29 0.5 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.324 -179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.54 HG22 ' O ' ' A' ' 28' ' ' VAL . 9.9 p . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.091 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 19.1 m . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.839 0.352 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.96 -132.39 6.45 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.493 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -92.34 -27.93 17.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.836 0.351 . . . . 0.0 110.971 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -92.62 3.34 55.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.583 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -115.37 17.52 16.46 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.304 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.614 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.8 OUTLIER -80.3 -47.62 1.31 Allowed Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.93 0.395 . . . . 0.0 111.528 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.522 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.6 Cg_exo -46.43 -25.85 3.65 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.846 2.364 . . . . 0.0 111.603 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.72 -34.25 16.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.699 179.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.614 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -100.0 129.5 46.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.277 -179.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' CB ' ' O ' ' A' ' 9' ' ' HIS . 0.5 OUTLIER 82.41 89.66 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.797 -179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.95 117.25 29.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.939 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.46 -102.8 0.54 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.413 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -160.67 -43.09 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.859 0.361 . . . . 0.0 110.998 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.66 34.37 5.16 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.164 0.507 . . . . 0.0 109.67 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.14 99.12 7.01 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.08 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 134.02 20.31 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.866 179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -72.12 143.67 40.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.662 2.242 . . . . 0.0 112.549 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 4.4 t -128.63 146.95 50.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.697 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.4 m -103.31 116.83 33.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.101 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -128.1 104.56 7.84 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.548 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 52.03 50.81 17.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.064 0.459 . . . . 0.0 110.567 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.51 17.07 66.21 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.835 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.1 t -117.62 104.24 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.735 0.302 . . . . 0.0 110.972 179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -75.66 146.43 40.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.91 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -160.23 125.21 3.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -83.26 126.74 32.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.721 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -137.98 -87.77 0.26 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.2 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.196 -179.842 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 2' ' ' GLY . 2.9 t . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.766 0.317 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.432 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -76.87 -168.92 29.91 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.493 179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 -29.85 10.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.757 0.313 . . . . 0.0 110.916 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -87.01 2.97 47.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.463 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -109.76 -25.87 10.13 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.002 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.575 ' HA ' ' HD2' ' A' ' 9' ' ' HIS . 7.0 m -59.3 -44.68 98.61 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.761 -179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 79.3 Cg_exo -46.33 -27.78 5.18 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.752 2.301 . . . . 0.0 111.28 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 53.6 ttp -71.4 -45.19 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.254 178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.575 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER -68.63 -24.67 64.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.18 -179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.3 OUTLIER -123.05 87.43 2.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.889 179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -118.56 115.54 24.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -142.45 -102.05 0.43 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.513 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.5 -36.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.746 0.308 . . . . 0.0 111.275 179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.74 34.48 4.64 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.73 106.48 8.49 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.331 -0.849 . . . . 0.0 111.051 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.78 134.97 19.47 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.072 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 72.3 Cg_endo -76.55 147.41 28.32 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.805 2.337 . . . . 0.0 112.34 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.865 HG22 ' O ' ' A' ' 25' ' ' ASN . 12.9 t -139.11 154.13 48.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.036 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 12.7 m -117.21 121.11 40.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.814 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -128.31 104.37 7.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.747 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 50.33 51.68 16.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.06 0.457 . . . . 0.0 110.685 -179.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.84 17.0 70.94 Favored Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.813 -0.631 . . . . 0.0 112.858 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 33.2 t -113.03 100.13 10.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.81 0.338 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -72.52 136.19 45.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.879 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.865 ' O ' HG22 ' A' ' 18' ' ' THR . 1.3 m-20 -160.29 125.15 3.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.834 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 7.0 p -105.17 129.9 53.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.799 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -129.86 -79.64 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.087 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.584 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.2 p . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.129 -0.939 . . . . 0.0 111.087 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.51 HG21 ' CD2' ' A' ' 9' ' ' HIS . 24.1 m . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.778 0.323 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.56 -155.16 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.483 -179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.75 -25.84 10.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.76 0.314 . . . . 0.0 111.074 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -90.44 3.61 53.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.994 0.426 . . . . 0.0 111.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.426 ' HG2' ' HE2' ' A' ' 8' ' ' MET . 3.4 mt-10 -136.15 25.83 3.25 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.165 -179.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.563 ' HA ' ' HD2' ' A' ' 9' ' ' HIS . 1.2 m -81.26 -45.42 1.15 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.875 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 84.1 Cg_exo -46.21 -27.95 5.11 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.886 2.39 . . . . 0.0 111.244 179.381 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.426 ' HE2' ' HG2' ' A' ' 5' ' ' GLU . 1.6 mpp? -71.99 -44.34 63.65 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.233 178.978 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.563 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -72.65 -24.6 61.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.112 -179.655 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -125.68 98.97 5.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.766 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.6 mtpp -116.99 115.11 24.81 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.032 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -146.2 -101.78 0.31 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.348 179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -163.14 -42.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.84 0.352 . . . . 0.0 110.965 179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -123.45 34.6 5.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 121.175 0.512 . . . . 0.0 109.645 179.294 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -116.61 99.62 7.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.169 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -103.71 134.02 19.96 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.853 179.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 45.3 Cg_endo -69.25 139.88 43.14 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.621 2.214 . . . . 0.0 112.509 -179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.59 136.85 54.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.021 179.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -105.64 114.47 28.65 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.971 179.933 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -129.74 105.63 8.16 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.77 -179.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.39 50.87 17.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.11 0.481 . . . . 0.0 110.771 -179.678 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.82 15.75 69.42 Favored Glycine 0 N--CA 1.441 -0.992 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.855 179.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 29.8 t -111.55 100.2 10.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.794 0.331 . . . . 0.0 110.79 179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 15.1 t -83.98 134.31 34.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.002 -179.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -160.27 125.88 4.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.846 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.412 ' HA ' ' HA ' ' A' ' 17' ' ' PRO . 13.9 p -80.66 134.16 35.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.676 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -126.32 -90.08 0.55 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.24 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.579 HG12 ' O ' ' A' ' 28' ' ' VAL . 21.5 t . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.197 -0.906 . . . . 0.0 111.128 -179.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.846 0.355 . . . . 0.0 111.103 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.97 -165.84 28.32 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.548 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.8 t -122.58 -41.81 2.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.815 0.34 . . . . 0.0 110.975 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -99.58 3.24 45.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.59 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.4 mm-40 -118.72 15.38 13.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.364 179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.61 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 57.5 m -80.33 -39.22 1.17 Allowed Pre-proline 0 C--N 1.33 -0.259 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.61 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 71.4 Cg_exo -47.89 -26.11 6.9 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.602 2.201 . . . . 0.0 111.318 179.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 55.6 mmm -74.49 -39.5 62.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.33 179.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HD2' ' HA ' ' A' ' 6' ' ' CYS . 0.1 OUTLIER -78.41 -17.45 56.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.372 -179.548 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 9' ' ' HIS . 1.9 t -136.63 124.32 22.42 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.934 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.9 mtpt -54.28 121.82 9.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.884 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -91.65 48.61 2.82 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.698 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -119.44 -26.01 5.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.882 0.372 . . . . 0.0 111.286 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -141.28 28.9 1.83 Allowed 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -179.63 130.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.109 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 21.1 tttp -110.2 134.01 20.89 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.731 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -69.72 139.39 40.25 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.519 2.146 . . . . 0.0 112.571 -179.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.35 139.34 54.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.895 179.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 24.7 m -110.34 115.26 29.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -129.4 105.76 8.32 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.679 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 51.16 50.94 18.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.021 0.439 . . . . 0.0 110.639 -179.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 69.35 16.27 71.15 Favored Glycine 0 N--CA 1.442 -0.951 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.8 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 25.0 t -110.52 99.35 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.805 0.336 . . . . 0.0 110.891 179.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.29 135.53 35.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.007 -179.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -160.16 122.65 3.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.871 179.944 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 15.5 p -92.13 122.62 34.79 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.792 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -120.64 -80.02 0.62 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.086 -179.792 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.294 -0.86 . . . . 0.0 111.171 -179.934 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.424 HG23 ' HB3' ' A' ' 24' ' ' CYS . 12.2 m . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.804 0.335 . . . . 0.0 111.118 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.87 177.06 10.48 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.464 179.931 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -96.93 -31.61 12.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.795 0.331 . . . . 0.0 110.925 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -99.69 3.33 45.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.559 -179.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -120.85 17.02 11.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.373 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.573 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.4 m -80.9 -47.44 1.16 Allowed Pre-proline 0 C--N 1.331 -0.21 0 CA-C-O 120.785 0.326 . . . . 0.0 111.671 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.521 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 78.1 Cg_exo -46.44 -26.56 4.22 Favored 'Trans proline' 0 N--CA 1.464 -0.259 0 C-N-CA 122.809 2.339 . . . . 0.0 111.316 179.223 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.19 -40.33 37.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.642 179.286 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.573 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER -84.51 -48.3 9.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.362 -179.221 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.428 ' N ' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -89.91 170.64 10.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.992 -179.958 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -77.93 163.51 25.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.879 179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -131.21 52.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.513 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -151.87 -26.13 0.18 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -138.18 30.2 2.46 Favored 'General case' 0 N--CA 1.446 -0.672 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -163.65 122.6 2.01 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.179 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 4.9 ttpm? -104.24 132.1 21.29 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.809 179.886 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 24.4 Cg_exo -62.73 133.54 42.63 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.608 2.205 . . . . 0.0 112.3 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.53 126.68 40.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.821 179.69 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.27 118.41 35.88 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.033 -179.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -128.11 102.81 6.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.666 179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 52.37 51.57 15.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.02 0.438 . . . . 0.0 110.597 -179.571 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 67.04 14.92 64.33 Favored Glycine 0 N--CA 1.442 -0.94 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.855 -179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 37.8 t -115.24 103.35 15.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.852 0.358 . . . . 0.0 110.871 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' HB3' HG23 ' A' ' 1' ' ' VAL . 38.2 t -65.26 150.93 47.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.889 -179.903 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -160.17 125.35 3.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.854 179.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 5.5 p -115.7 121.52 42.77 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.845 179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -121.42 -82.28 0.65 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.093 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.186 -0.911 . . . . 0.0 111.146 -179.898 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.775 0.322 . . . . 0.0 111.118 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.43 -178.98 17.23 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.5 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.8 t -105.87 -34.69 7.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.857 0.36 . . . . 0.0 110.888 -179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -91.81 3.24 55.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.558 -179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -114.7 -11.47 12.31 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.425 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.526 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 0.5 OUTLIER -47.31 -52.25 36.95 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-O 121.157 0.503 . . . . 0.0 111.541 179.848 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.477 ' HD2' ' N ' ' A' ' 6' ' ' CYS . 85.2 Cg_exo -45.6 -26.09 2.74 Favored 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 123.252 2.634 . . . . 0.0 112.453 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ttm -110.76 -30.04 7.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.229 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.526 ' CD2' ' HA ' ' A' ' 6' ' ' CYS . 0.8 OUTLIER -95.84 13.1 27.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.539 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.57 81.06 1.86 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.902 179.544 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.85 164.71 14.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.864 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 149.9 -46.75 0.63 Allowed Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.657 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 0.0 OUTLIER 77.78 -14.56 0.84 Allowed 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 122.921 0.488 . . . . 0.0 111.688 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -139.02 34.57 2.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.948 179.449 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -135.57 109.84 8.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.912 -179.873 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.76 130.94 51.0 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.72 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.11 142.22 37.71 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.712 2.275 . . . . 0.0 112.649 -179.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.14 126.94 47.96 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.824 179.69 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -98.76 111.62 23.95 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.081 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -129.82 105.8 8.26 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.585 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.17 51.07 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.065 0.46 . . . . 0.0 110.675 -179.683 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 68.94 16.23 70.22 Favored Glycine 0 N--CA 1.441 -0.98 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.838 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 26.8 t -111.62 99.36 8.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.795 0.331 . . . . 0.0 110.845 179.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 2.3 t -85.29 138.29 32.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.974 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -160.16 121.43 3.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 17.0 p -92.8 127.34 38.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.862 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -116.64 -81.22 0.61 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.043 -179.887 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.206 -0.902 . . . . 0.0 111.11 -179.948 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.539 HG11 ' CD2' ' A' ' 9' ' ' HIS . 2.9 t . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.969 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.442 ' N ' HG12 ' A' ' 1' ' ' VAL . . . -67.8 172.32 32.89 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.537 179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.16 -28.25 27.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 179.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.79 3.04 46.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.004 0.431 . . . . 0.0 111.508 -179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -111.42 -4.73 14.76 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.398 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.599 ' N ' ' CD ' ' A' ' 7' ' ' PRO . 37.8 m -63.25 -42.21 73.87 Favored Pre-proline 0 C--N 1.332 -0.172 0 CA-C-O 120.781 0.324 . . . . 0.0 111.681 179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 6' ' ' CYS . 50.8 Cg_exo -51.05 -23.79 13.07 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.795 2.33 . . . . 0.0 111.988 179.427 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 6.2 ttp -110.04 -34.29 6.45 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.539 ' CD2' HG11 ' A' ' 1' ' ' VAL . 0.8 OUTLIER -91.19 16.45 9.83 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 -179.663 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.22 78.74 1.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.843 0.354 . . . . 0.0 110.914 179.528 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -59.74 164.66 3.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.89 179.925 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 13' ' ' LYS . . . 146.11 -46.03 0.78 Allowed Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.535 -179.955 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 12' ' ' GLY . 20.5 tttt 77.7 -14.54 0.84 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.964 0.506 . . . . 0.0 111.72 179.886 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -139.09 34.06 2.13 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.042 179.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.24 107.2 7.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.058 -179.777 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.3 tttp -84.92 131.09 50.07 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.591 179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -78.42 146.03 21.59 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.669 2.246 . . . . 0.0 112.642 -179.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.893 HG22 ' O ' ' A' ' 25' ' ' ASN . 7.7 t -128.88 152.06 48.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.676 179.546 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.34 118.41 36.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.087 -179.808 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -127.71 102.83 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.588 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 51.93 51.7 15.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.059 0.457 . . . . 0.0 110.553 -179.598 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 66.85 16.0 65.44 Favored Glycine 0 N--CA 1.441 -0.976 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.873 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 40.0 t -116.53 103.76 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.755 0.312 . . . . 0.0 110.901 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.2 t -70.64 141.79 51.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.878 -179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.893 ' O ' HG22 ' A' ' 18' ' ' THR . 3.3 p-10 -160.14 123.16 3.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.698 179.792 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 33.6 m -95.29 163.49 13.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 67.2 m-80 -147.45 -79.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.934 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.586 ' OXT' HG13 ' A' ' 28' ' ' VAL . 9.8 p . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.048 179.949 . . . . . . . . 1 1 . 1 stop_ save_