data_2csa_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 2csa _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.773 0.32 . . . . 99.99 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 99.99 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 99.99 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 99.99 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 99.99 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 99.99 111.171 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 99.99 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 99.99 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 99.99 110.994 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 99.99 112.515 179.992 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 CA--C 1.528 0.096 0 CA-C-O 120.976 0.417 . . . . 99.99 110.875 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 99.99 110.922 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 99.99 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 t30 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 99.99 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 99.99 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 99.99 111.181 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 99.99 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 99.99 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 99.99 110.996 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 99.99 112.512 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.927 0.394 . . . . 99.99 110.935 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 99.99 110.96 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 99.99 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 99.99 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 99.99 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 99.99 111.171 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 99.99 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.412 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 99.99 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 99.99 110.949 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 99.99 112.494 179.997 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.843 0.354 . . . . 99.99 110.899 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 99.99 110.906 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 99.99 110.894 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 99.99 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 99.99 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 99.99 111.376 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 99.99 111.151 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 99.99 112.372 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 99.99 110.899 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 99.99 112.48 -179.984 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.548 0.213 . . . . 99.99 111.405 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 99.99 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 99.99 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 99.99 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 99.99 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 99.99 111.233 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 99.99 110.933 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 99.99 112.379 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 99.99 110.833 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 99.99 112.49 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.781 0.324 . . . . 99.99 110.877 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 99.99 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 99.99 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 99.99 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 99.99 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 99.99 110.967 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 99.99 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 99.99 112.7 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 99.99 110.939 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 99.99 112.493 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 99.99 110.899 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 99.99 110.886 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 99.99 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 99.99 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 99.99 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 99.99 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 2.3 m-70 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 99.99 111.011 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 99.99 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 99.99 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 99.99 112.536 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.893 0.378 . . . . 99.99 110.938 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 99.99 110.904 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 99.99 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 99.99 110.901 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 99.99 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 99.99 110.879 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 99.99 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 99.99 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 99.99 110.894 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 99.99 112.513 179.997 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.794 0.331 . . . . 99.99 110.842 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 99.99 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 99.99 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 99.99 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 99.99 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 99.99 111.73 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.419 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 99.99 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 99.99 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 99.99 111.055 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 99.99 112.514 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.864 0.364 . . . . 99.99 110.886 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 99.99 110.942 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 99.99 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 99.99 110.894 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 99.99 110.905 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 99.99 111.12 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 99.99 111.23 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 99.99 112.85 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 99.99 110.996 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 99.99 112.539 -179.952 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.814 0.34 . . . . 99.99 111.197 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.73 -85.78 0.36 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 99.99 112.473 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.73 129.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.807 0.336 . . . . 99.99 110.894 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -149.99 -47.13 0.13 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 99.99 110.898 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.31 -167.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 99.99 111.061 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -58.15 -30.08 66.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.443 . . . . 99.99 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 99.99 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 99.99 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 99.99 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 99.99 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 99.99 111.171 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 99.99 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 99.99 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 99.99 110.994 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.0 139.26 3.03 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 99.99 112.515 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -109.09 -31.52 7.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 99.99 110.902 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -60.38 -74.54 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 99.99 110.906 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -108.99 -69.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 99.99 110.916 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 99.99 110.874 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.775 0.321 . . . . 99.99 111.18 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.95 168.03 35.23 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.738 -0.744 . . . . 99.99 112.521 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.4 m -134.95 80.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.827 0.346 . . . . 99.99 110.931 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -160.57 -51.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 99.99 110.867 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.68 -78.7 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 99.99 111.083 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.09 52.51 2.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.035 -0.53 . . . . 99.99 110.875 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 99.99 110.922 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 99.99 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 t30 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 99.99 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 99.99 110.877 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 99.99 111.181 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 99.99 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 99.99 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 99.99 110.996 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.8 -28.62 0.42 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 99.99 112.512 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.8 m -132.2 35.14 3.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 99.99 110.914 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t -69.98 -41.05 74.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 99.99 110.919 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -91.34 -54.28 3.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 99.99 110.895 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 99.99 110.977 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.92 0.39 . . . . 99.99 111.148 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.8 162.42 16.18 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.75 -0.738 . . . . 99.99 112.407 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 62.4 m -103.64 80.01 1.74 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 99.99 110.913 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -149.98 -47.18 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 99.99 110.885 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.99 -70.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 99.99 111.149 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -86.18 -77.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.054 -0.521 . . . . 99.99 110.935 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 99.99 110.96 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 99.99 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 99.99 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 99.99 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 99.99 111.171 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 99.99 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.412 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 99.99 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 99.99 110.949 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 176.53 -44.36 0.11 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 99.99 112.494 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -134.23 137.31 44.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 99.99 110.848 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.0 p -162.83 147.0 11.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 99.99 110.93 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -82.03 147.39 29.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 99.99 110.851 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 99.99 110.881 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.8 p . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.795 0.331 . . . . 99.99 111.163 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -104.68 41.11 2.23 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.688 -0.768 . . . . 99.99 112.482 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.4 m 60.58 110.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 99.99 110.899 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -159.93 31.59 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 99.99 110.889 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.88 -175.99 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 99.99 111.139 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -62.07 -32.96 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 99.99 110.899 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 99.99 110.906 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 99.99 110.894 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 99.99 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 99.99 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 99.99 111.376 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 99.99 111.151 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 99.99 112.372 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 99.99 110.899 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -164.78 -135.66 1.86 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 99.99 112.48 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.0 p -106.14 -32.38 8.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.883 0.373 . . . . 99.99 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.5 t -176.4 -170.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 99.99 110.886 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -131.92 99.63 4.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 99.99 110.909 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 99.99 110.913 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.849 0.357 . . . . 99.99 111.216 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.54 -176.72 40.76 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.713 -0.756 . . . . 99.99 112.479 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.404 ' OG1' ' CG ' ' A' ' 12' ' ' HIS . 1.4 m 60.43 87.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.722 0.296 . . . . 99.99 110.933 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -152.24 31.67 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 99.99 110.927 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.41 170.55 16.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 99.99 111.024 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -90.21 16.81 7.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 99.99 111.405 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 99.99 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 99.99 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 99.99 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 99.99 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 99.99 111.233 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.404 ' CG ' ' OG1' ' A' ' 3' ' ' THR . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 99.99 110.933 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 99.99 112.379 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 99.99 110.833 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.3 86.95 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 99.99 112.49 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -65.78 146.77 54.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.809 0.338 . . . . 99.99 110.916 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 m -76.1 -63.14 1.38 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 99.99 110.881 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -166.98 105.09 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 99.99 110.869 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 99.99 110.978 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.762 0.315 . . . . 99.99 111.176 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 137.92 100.02 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.786 -0.721 . . . . 99.99 112.501 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.2 m -163.77 95.05 0.79 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.829 0.347 . . . . 99.99 110.877 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -150.52 31.76 0.65 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 99.99 110.879 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.67 -79.36 0.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 99.99 111.097 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -89.99 -31.68 17.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.144 -0.48 . . . . 99.99 110.877 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 99.99 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 99.99 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 99.99 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 99.99 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 99.99 110.967 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 99.99 110.89 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 99.99 112.7 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 99.99 110.939 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.01 -124.25 1.73 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 99.99 112.493 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.39 35.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 99.99 110.904 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 m -79.01 -178.97 6.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 99.99 110.873 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.14 -64.67 1.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 99.99 110.887 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 99.99 110.874 179.998 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.808 0.337 . . . . 99.99 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.42 -90.32 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 99.99 112.465 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.7 p 56.95 104.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.908 0.385 . . . . 99.99 111.004 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -161.25 121.39 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 99.99 110.942 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.92 -31.34 69.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 99.99 111.093 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.35 -31.64 43.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 99.99 110.899 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 99.99 110.886 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 99.99 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 99.99 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 99.99 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 99.99 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 2.3 m-70 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 99.99 111.011 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 99.99 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 99.99 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 169.06 157.5 11.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 99.99 112.536 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.03 124.71 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 99.99 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.2 p -93.71 111.53 23.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 99.99 110.919 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 60.51 89.58 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 99.99 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 99.99 110.881 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.881 0.372 . . . . 99.99 111.258 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.76 -31.16 7.84 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 99.99 112.506 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.35 -68.99 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.729 0.299 . . . . 99.99 110.954 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -176.51 -67.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 99.99 110.917 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.85 -176.09 4.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 99.99 111.097 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -89.95 52.38 2.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 99.99 110.938 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 99.99 110.904 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 99.99 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 99.99 110.901 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 99.99 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 99.99 110.879 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 99.99 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 99.99 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 99.99 110.894 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.0 -95.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 99.99 112.513 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.0 p 58.49 35.45 24.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.81 0.338 . . . . 99.99 110.926 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 m -65.17 95.06 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 99.99 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -172.76 159.93 4.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 99.99 110.903 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 99.99 110.936 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.823 0.344 . . . . 99.99 111.21 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -140.27 132.8 5.66 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 99.99 112.537 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.37 37.84 19.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.794 0.331 . . . . 99.99 110.881 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -149.96 77.67 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 99.99 110.908 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -90.03 -177.98 5.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 99.99 111.119 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -76.11 -35.37 59.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 99.99 110.842 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 99.99 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 99.99 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 99.99 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 99.99 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 99.99 111.73 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.419 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 99.99 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 99.99 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 99.99 111.055 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.76 -36.98 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 99.99 112.514 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 m -83.85 -173.22 4.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.824 0.345 . . . . 99.99 110.911 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.1 m -145.26 175.03 10.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 99.99 110.85 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 60.65 157.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 99.99 110.91 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.944 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 99.99 111.16 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.92 176.38 16.45 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 99.99 112.441 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.8 m -105.5 -72.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.886 0.374 . . . . 99.99 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -179.93 130.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 99.99 110.838 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.42 79.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 99.99 111.163 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -90.1 51.5 2.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.05 -0.523 . . . . 99.99 110.886 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 99.99 110.942 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 99.99 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 99.99 110.894 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 99.99 110.905 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 99.99 111.12 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 99.99 111.23 -179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 99.99 112.85 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 99.99 110.996 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.02 44.91 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 99.99 112.539 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.84 166.1 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.845 0.355 . . . . 99.99 110.878 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.9 p -159.25 31.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 99.99 110.927 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -60.9 165.66 3.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 99.99 110.905 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.907 179.971 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.773 0.32 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.171 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.515 179.992 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 CA--C 1.528 0.096 0 CA-C-O 120.976 0.417 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.582 HG22 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.922 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 t30 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.582 ' CE1' HG22 ' A' ' 7' ' ' THR . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.181 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 0.0 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.512 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.927 0.394 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.96 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' ' HG3' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 14' ' ' THR . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.171 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.426 ' HG3' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 0.0 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.704 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 0.0 110.949 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.494 179.997 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.705 ' O ' HG23 ' A' ' 7' ' ' THR . 92.2 mt-10 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.705 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 14' ' ' THR . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.376 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.4 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.151 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 0.0 112.372 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.899 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.48 -179.984 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.548 0.213 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.482 ' O ' HG22 ' A' ' 14' ' ' THR . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.233 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.411 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.933 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 0.0 112.379 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.833 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.49 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.781 0.324 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.705 ' O ' HG22 ' A' ' 14' ' ' THR . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 0.0 110.967 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.401 ' N ' ' HD2' ' A' ' 13' ' ' PRO . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.89 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.7 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.705 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 0.0 110.939 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.493 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.886 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 0.0 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 0.3 OUTLIER 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.011 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 0.0 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.536 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.627 HG23 ' H ' ' A' ' 9' ' ' ASN . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.627 ' H ' HG23 ' A' ' 7' ' ' THR . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 14' ' ' THR . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.879 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 0.0 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.894 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.513 179.997 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.794 0.331 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.792 ' O ' HG22 ' A' ' 14' ' ' THR . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 0.0 111.73 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 0.0 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 0.0 111.055 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.514 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.864 0.364 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.704 HG23 ' H ' ' A' ' 9' ' ' ASN . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.704 ' H ' HG23 ' A' ' 7' ' ' THR . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.698 ' O ' HG13 ' A' ' 11' ' ' VAL . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.905 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.12 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.419 ' H ' HG23 ' A' ' 11' ' ' VAL . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.23 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 0.0 112.85 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.539 -179.952 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.814 0.34 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.73 -85.78 0.36 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.473 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.73 129.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.807 0.336 . . . . 0.0 110.894 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -149.99 -47.13 0.13 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.898 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.31 -167.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.061 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -58.15 -30.08 66.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.171 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.0 139.26 3.03 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.515 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -109.09 -31.52 7.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 110.902 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -60.38 -74.54 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -108.99 -69.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 99.99 110.874 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.95 168.03 35.23 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.521 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.447 HG23 ' CG2' ' A' ' 7' ' ' THR . 13.4 m -134.95 80.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.827 0.346 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -160.57 -51.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.68 -78.7 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.083 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.09 52.51 2.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.582 HG22 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.922 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.582 ' CE1' HG22 ' A' ' 7' ' ' THR . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.181 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 0.0 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.8 -28.62 0.42 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.512 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.8 m -132.2 35.14 3.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 0.0 110.914 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t -69.98 -41.05 74.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.919 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -91.34 -54.28 3.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 99.99 110.977 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.92 0.39 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.8 162.42 16.18 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.407 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.855 ' CG2' HG23 ' A' ' 7' ' ' THR . 62.4 m -103.64 80.01 1.74 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 0.0 110.913 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -149.98 -47.18 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.885 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.99 -70.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -86.18 -77.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.935 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.855 HG23 ' CG2' ' A' ' 3' ' ' THR . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.96 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' ' HG3' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 14' ' ' THR . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.171 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.426 ' HG3' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 0.0 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.704 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 0.0 110.949 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 176.53 -44.36 0.11 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.494 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -134.23 137.31 44.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.848 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.0 p -162.83 147.0 11.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.93 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -82.03 147.39 29.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.851 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 99.99 110.881 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.8 p . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -104.68 41.11 2.23 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.482 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.685 HG23 ' CB ' ' A' ' 8' ' ' GLU . 63.4 m 60.58 110.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -159.93 31.59 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.88 -175.99 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.139 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.705 ' O ' HG23 ' A' ' 7' ' ' THR . 92.2 mt-10 -62.07 -32.96 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.705 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.685 ' CB ' HG23 ' A' ' 3' ' ' THR . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 14' ' ' THR . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.376 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.4 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.151 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 0.0 112.372 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.899 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -164.78 -135.66 1.86 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.48 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.0 p -106.14 -32.38 8.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.5 t -176.4 -170.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -131.92 99.63 4.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.909 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 99.99 110.913 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.849 0.357 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.54 -176.72 40.76 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.479 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.441 HG23 ' CB ' ' A' ' 12' ' ' HIS . 1.4 m 60.43 87.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.722 0.296 . . . . 0.0 110.933 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -152.24 31.67 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.927 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.41 170.55 16.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.024 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -90.21 16.81 7.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.405 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.482 ' O ' HG22 ' A' ' 14' ' ' THR . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.233 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 3' ' ' THR . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.933 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 0.0 112.379 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.833 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.3 86.95 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.49 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -65.78 146.77 54.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 m -76.1 -63.14 1.38 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -166.98 105.09 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 99.99 110.978 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.762 0.315 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 137.92 100.02 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.2 m -163.77 95.05 0.79 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.829 0.347 . . . . 0.0 110.877 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -150.52 31.76 0.65 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.67 -79.36 0.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.097 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -89.99 -31.68 17.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.705 ' O ' HG22 ' A' ' 14' ' ' THR . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 0.0 110.967 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.401 ' N ' ' HD2' ' A' ' 13' ' ' PRO . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.89 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.7 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.705 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 0.0 110.939 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.01 -124.25 1.73 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.39 35.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 m -79.01 -178.97 6.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.14 -64.67 1.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 99.99 110.874 179.998 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.42 -90.32 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.465 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.7 p 56.95 104.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.908 0.385 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -161.25 121.39 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.92 -31.34 69.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' THR . 0.5 OUTLIER -79.35 -31.64 43.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.899 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.886 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 0.0 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 0.3 OUTLIER 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.011 179.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 0.0 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 169.06 157.5 11.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.536 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.03 124.71 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.2 p -93.71 111.53 23.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 60.51 89.58 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 99.99 110.881 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.881 0.372 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.76 -31.16 7.84 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.506 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.35 -68.99 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.729 0.299 . . . . 0.0 110.954 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -176.51 -67.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.85 -176.09 4.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.097 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -89.95 52.38 2.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.938 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.627 HG23 ' H ' ' A' ' 9' ' ' ASN . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.627 ' H ' HG23 ' A' ' 7' ' ' THR . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 14' ' ' THR . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.879 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 0.0 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.894 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.0 -95.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.513 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.0 p 58.49 35.45 24.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.81 0.338 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 m -65.17 95.06 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -172.76 159.93 4.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.903 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 99.99 110.936 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.823 0.344 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -140.27 132.8 5.66 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.537 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.37 37.84 19.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.794 0.331 . . . . 0.0 110.881 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -149.96 77.67 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.908 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -90.03 -177.98 5.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.119 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -76.11 -35.37 59.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.792 ' O ' HG22 ' A' ' 14' ' ' THR . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 0.0 111.73 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 0.0 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 0.0 111.055 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.76 -36.98 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.514 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 m -83.85 -173.22 4.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.824 0.345 . . . . 0.0 110.911 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.1 m -145.26 175.03 10.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 60.65 157.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.944 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.92 176.38 16.45 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.441 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.8 m -105.5 -72.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.886 0.374 . . . . 0.0 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -179.93 130.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.838 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.42 79.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.163 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -90.1 51.5 2.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.704 HG23 ' H ' ' A' ' 9' ' ' ASN . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.704 ' H ' HG23 ' A' ' 7' ' ' THR . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.698 ' O ' HG13 ' A' ' 11' ' ' VAL . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.905 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.12 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.419 ' H ' HG23 ' A' ' 11' ' ' VAL . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.23 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 0.0 112.85 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.02 44.91 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.539 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.84 166.1 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.845 0.355 . . . . 0.0 110.878 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.9 p -159.25 31.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -60.9 165.66 3.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.907 179.971 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.773 0.32 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.171 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.515 179.992 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 . . . . . 0 CA--C 1.528 0.096 0 CA-C-O 120.976 0.417 . . . . 0.0 110.875 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.582 HG22 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.922 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 t30 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.582 ' CE1' HG22 ' A' ' 7' ' ' THR . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.181 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 0.0 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.512 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.927 0.394 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.96 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' ' HG3' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 14' ' ' THR . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.171 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.426 ' HG3' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 0.0 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.704 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 0.0 110.949 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.494 179.997 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.705 ' O ' HG23 ' A' ' 7' ' ' THR . 92.2 mt-10 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.705 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 14' ' ' THR . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.376 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.4 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.151 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 0.0 112.372 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.899 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.48 -179.984 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 . . . . . 0 CA--C 1.529 0.14 0 CA-C-O 120.548 0.213 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.482 ' O ' HG22 ' A' ' 14' ' ' THR . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.233 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.411 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.933 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 0.0 112.379 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.833 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.49 179.981 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.781 0.324 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.705 ' O ' HG22 ' A' ' 14' ' ' THR . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 0.0 110.967 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.401 ' N ' ' HD2' ' A' ' 13' ' ' PRO . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.89 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.7 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.705 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 0.0 110.939 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.493 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.783 0.325 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.886 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 0.0 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 2.3 m-70 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 0.0 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.536 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.893 0.378 . . . . 0.0 110.938 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.627 HG23 ' H ' ' A' ' 9' ' ' ASN . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.627 ' H ' HG23 ' A' ' 7' ' ' THR . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 14' ' ' THR . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.879 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 0.0 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.894 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.513 179.997 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.794 0.331 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.792 ' O ' HG22 ' A' ' 14' ' ' THR . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 0.0 111.73 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 0.0 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 0.0 111.055 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.514 179.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.864 0.364 . . . . 0.0 110.886 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.704 HG23 ' H ' ' A' ' 9' ' ' ASN . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.704 ' H ' HG23 ' A' ' 7' ' ' THR . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.698 ' O ' HG13 ' A' ' 11' ' ' VAL . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.905 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.12 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.419 ' H ' HG23 ' A' ' 11' ' ' VAL . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.23 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 0.0 112.85 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.539 -179.952 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.814 0.34 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 70.73 -85.78 0.36 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.473 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 63.73 129.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.807 0.336 . . . . 0.0 110.894 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -149.99 -47.13 0.13 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.898 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.31 -167.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.061 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -58.15 -30.08 66.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.978 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -172.52 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.921 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 59.75 30.93 20.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.935 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -173.6 100.38 0.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -147.88 -52.23 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.873 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.5 t -151.06 -46.89 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.171 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -79.55 -60.42 0.53 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.047 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.23 -6.25 17.03 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.621 2.214 . . . . 0.0 112.74 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.8 t -57.62 111.09 1.01 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.815 0.34 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.0 139.26 3.03 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.515 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -109.09 -31.52 7.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.787 0.327 . . . . 0.0 110.902 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 m -60.38 -74.54 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.906 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 9.7 tpp180 -108.99 -69.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 99.99 110.874 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.775 0.321 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.95 168.03 35.23 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.521 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.447 HG23 ' CG2' ' A' ' 7' ' ' THR . 13.4 m -134.95 80.39 1.84 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.827 0.346 . . . . 0.0 110.931 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -160.57 -51.86 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.867 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.68 -78.7 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.083 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -90.09 52.51 2.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.875 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.582 HG22 ' CE1' ' A' ' 10' ' ' PHE . 0.2 OUTLIER -161.19 81.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.922 179.886 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -143.2 107.71 4.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.871 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 t30 60.5 100.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.582 ' CE1' HG22 ' A' ' 7' ' ' THR . 5.9 p90 -152.41 -52.1 0.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.877 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.711 ' O ' HG22 ' A' ' 14' ' ' THR . 21.4 t -150.93 -46.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.181 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -79.52 -60.42 0.53 Allowed Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.032 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.18 -6.39 17.2 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.619 2.213 . . . . 0.0 112.769 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.711 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.57 155.28 9.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.833 0.349 . . . . 0.0 110.996 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 158.8 -28.62 0.42 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.512 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.8 m -132.2 35.14 3.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.764 0.316 . . . . 0.0 110.914 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t -69.98 -41.05 74.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.919 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.2 ttp180 -91.34 -54.28 3.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.895 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.201 -0.454 . . . . 99.99 110.977 179.952 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.92 0.39 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.8 162.42 16.18 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.407 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.855 ' CG2' HG23 ' A' ' 7' ' ' THR . 62.4 m -103.64 80.01 1.74 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.86 0.362 . . . . 0.0 110.913 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -149.98 -47.18 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.885 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.99 -70.14 0.18 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.149 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -86.18 -77.32 0.31 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.935 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.855 HG23 ' CG2' ' A' ' 3' ' ' THR . 1.9 m 60.57 92.25 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.96 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -131.72 31.5 4.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.934 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -153.81 103.05 2.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.426 ' CE1' ' HG3' ' A' ' 13' ' ' PRO . 6.9 p90 -127.89 -53.22 1.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.948 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.704 ' O ' HG22 ' A' ' 14' ' ' THR . 21.6 t -152.03 -46.69 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.171 -180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.401 ' CB ' ' CD ' ' A' ' 13' ' ' PRO . 1.6 m170 -79.36 -60.7 0.52 Allowed Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.045 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.426 ' HG3' ' CE1' ' A' ' 10' ' ' PHE . 72.9 Cg_endo -76.54 -5.44 16.09 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.524 2.15 . . . . 0.0 112.741 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.704 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.9 t -57.71 -178.12 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.806 0.336 . . . . 0.0 110.949 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 176.53 -44.36 0.11 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.494 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -134.23 137.31 44.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.884 0.373 . . . . 0.0 110.848 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 87.0 p -162.83 147.0 11.45 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.93 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -82.03 147.39 29.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.851 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 99.99 110.881 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 32.8 p . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -104.68 41.11 2.23 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.482 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.685 HG23 ' CB ' ' A' ' 8' ' ' GLU . 63.4 m 60.58 110.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.341 . . . . 0.0 110.899 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -159.93 31.59 0.18 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.88 -175.99 4.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.139 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.705 ' O ' HG23 ' A' ' 7' ' ' THR . 92.2 mt-10 -62.07 -32.96 73.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.705 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -168.96 80.09 0.13 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.685 ' CB ' HG23 ' A' ' 3' ' ' THR . 0.6 OUTLIER -76.26 -172.31 2.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.894 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -92.93 87.79 5.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.3 p90 -129.88 -51.51 1.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.461 ' O ' HG22 ' A' ' 14' ' ' THR . 55.0 t -153.62 -45.28 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.376 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.4 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -47.25 -58.46 7.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.151 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 83.3 Cg_endo -80.64 53.8 4.94 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.698 2.265 . . . . 0.0 112.372 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.461 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.8 t -105.19 -171.2 1.87 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.899 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -164.78 -135.66 1.86 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.48 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 96.0 p -106.14 -32.38 8.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.883 0.373 . . . . 0.0 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.5 t -176.4 -170.09 0.33 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.886 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -131.92 99.63 4.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.909 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.469 . . . . 99.99 110.913 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.849 0.357 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.54 -176.72 40.76 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.479 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.441 HG23 ' CB ' ' A' ' 12' ' ' HIS . 1.4 m 60.43 87.98 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.722 0.296 . . . . 0.0 110.933 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -152.24 31.67 0.53 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.927 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -77.41 170.55 16.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.024 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -90.21 16.81 7.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.405 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.4 t -111.0 -33.64 6.44 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.01 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 60.11 28.01 17.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.01 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -179.18 86.44 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.893 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.434 ' CD1' ' N ' ' A' ' 10' ' ' PHE . 1.8 p90 -135.04 -57.81 0.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.056 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.482 ' O ' HG22 ' A' ' 14' ' ' THR . 59.5 t -155.5 -45.71 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.233 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.441 ' CB ' HG23 ' A' ' 3' ' ' THR . 1.1 m170 -53.11 -58.99 10.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.933 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' HD3' ' CB ' ' A' ' 12' ' ' HIS . 90.5 Cg_endo -81.79 52.07 4.08 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.637 2.225 . . . . 0.0 112.379 179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.482 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.9 t -101.65 35.78 2.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.833 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.3 86.95 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.49 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.0 t -65.78 146.77 54.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.809 0.338 . . . . 0.0 110.916 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.7 m -76.1 -63.14 1.38 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.881 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -166.98 105.09 0.57 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.869 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.1 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 99.99 110.978 -179.96 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.9 m . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.762 0.315 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 137.92 100.02 0.51 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.501 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 63.2 m -163.77 95.05 0.79 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.829 0.347 . . . . 0.0 110.877 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -150.52 31.76 0.65 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.879 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.67 -79.36 0.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.097 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -89.99 -31.68 17.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 60.52 97.96 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.919 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -103.21 -31.52 10.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.928 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.6 m120 -131.63 100.75 5.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -95.45 -85.43 0.32 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.769 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.705 ' O ' HG22 ' A' ' 14' ' ' THR . 39.2 t -155.89 -68.56 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.985 0.421 . . . . 0.0 110.967 179.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.401 ' N ' ' HD2' ' A' ' 13' ' ' PRO . 1.6 m-70 -80.03 -53.77 0.93 Allowed Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.89 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 92.5 Cg_endo -81.22 -2.99 11.97 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.663 2.242 . . . . 0.0 112.7 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.705 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.4 t -58.54 -38.13 77.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.762 0.315 . . . . 0.0 110.939 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.01 -124.25 1.73 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.39 35.45 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.9 0.381 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 m -79.01 -178.97 6.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.14 -64.67 1.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.887 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.2 t . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 99.99 110.874 179.998 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 147.42 -90.32 0.15 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.465 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.7 p 56.95 104.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.908 0.385 . . . . 0.0 111.004 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -161.25 121.39 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.942 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.92 -31.34 69.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.093 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.42 ' O ' HG23 ' A' ' 7' ' ' THR . 0.5 OUTLIER -79.35 -31.64 43.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.899 179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 6' ' ' GLU . 0.8 OUTLIER -158.34 84.44 0.85 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.886 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -81.91 115.75 21.24 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.908 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 15.0 m120 60.54 80.63 0.2 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.9 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -73.92 -85.19 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.753 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 13.2 t -154.28 -53.37 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.001 0.429 . . . . 0.0 111.074 -179.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.417 ' N ' ' CD ' ' A' ' 13' ' ' PRO . 2.3 m-70 178.35 -52.06 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.011 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.417 ' CD ' ' N ' ' A' ' 12' ' ' HIS . 32.3 Cg_exo -58.28 -19.85 44.63 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.449 2.1 . . . . 0.0 112.365 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.1 t -54.54 179.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.06 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 169.06 157.5 11.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.536 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -170.03 124.71 0.77 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.832 0.349 . . . . 0.0 110.897 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 13.2 p -93.71 111.53 23.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.919 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 60.51 89.58 0.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.905 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 99.99 110.881 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.8 p . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.881 0.372 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 96.76 -31.16 7.84 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.506 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 68.35 -68.99 0.16 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.729 0.299 . . . . 0.0 110.954 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -176.51 -67.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.917 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -89.85 -176.09 4.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.097 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -89.95 52.38 2.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.938 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.627 HG23 ' H ' ' A' ' 9' ' ' ASN . 9.6 t -70.79 -31.6 68.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.904 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.61 35.13 20.03 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.864 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.627 ' H ' HG23 ' A' ' 7' ' ' THR . 2.3 t30 -170.23 99.4 0.27 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.7 t80 -109.82 -85.58 0.54 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.793 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.687 ' O ' HG22 ' A' ' 14' ' ' THR . 39.5 t -155.88 -69.42 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.973 0.416 . . . . 0.0 110.879 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -79.31 -54.57 0.97 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -81.5 2.0 8.86 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.597 2.198 . . . . 0.0 112.714 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.687 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.77 -36.68 74.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.909 0.385 . . . . 0.0 110.894 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 154.0 -95.62 0.15 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.513 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.0 p 58.49 35.45 24.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.81 0.338 . . . . 0.0 110.926 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.3 m -65.17 95.06 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -172.76 159.93 4.36 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.903 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 24.3 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 99.99 110.936 -179.986 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.823 0.344 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -140.27 132.8 5.66 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.537 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 60.37 37.84 19.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.794 0.331 . . . . 0.0 110.881 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -149.96 77.67 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.908 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -90.03 -177.98 5.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.119 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -76.11 -35.37 59.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.9 t -123.62 -43.84 2.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.948 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -175.38 179.33 1.5 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.888 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -127.72 87.69 2.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.758 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.463 ' CE1' ' CG ' ' A' ' 13' ' ' PRO . 3.1 p90 -121.62 -54.6 1.95 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.38 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.792 ' O ' HG22 ' A' ' 14' ' ' THR . 21.2 t -152.71 -58.42 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.825 0.345 . . . . 0.0 111.73 -179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.427 ' CB ' ' HD3' ' A' ' 13' ' ' PRO . 1.7 m-70 -72.67 -62.82 1.28 Allowed Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.244 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.463 ' CG ' ' CE1' ' A' ' 10' ' ' PHE . 87.9 Cg_endo -77.64 -4.32 14.46 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.464 2.109 . . . . 0.0 112.808 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 11' ' ' VAL . 11.6 t -58.18 -33.76 69.61 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.896 0.379 . . . . 0.0 111.055 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 156.76 -36.98 0.57 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.514 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.1 m -83.85 -173.22 4.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.824 0.345 . . . . 0.0 110.911 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 61.1 m -145.26 175.03 10.58 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.85 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 60.65 157.96 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.91 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.944 179.945 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.864 0.364 . . . . 0.0 111.16 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.92 176.38 16.45 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.441 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 86.8 m -105.5 -72.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.886 0.374 . . . . 0.0 110.865 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -179.93 130.36 0.09 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.838 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -57.83 -40.42 79.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.163 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -90.1 51.5 2.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.886 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.704 HG23 ' H ' ' A' ' 9' ' ' ASN . 12.1 t -104.11 -31.33 9.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.942 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 59.61 30.8 20.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.978 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.704 ' H ' HG23 ' A' ' 7' ' ' THR . 56.5 t-20 -176.8 99.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.894 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.698 ' O ' HG13 ' A' ' 11' ' ' VAL . 12.4 t80 -107.38 -70.52 0.79 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.905 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG13 ' O ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -178.28 -78.61 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.12 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.419 ' H ' HG23 ' A' ' 11' ' ' VAL . 9.3 m80 -79.4 -52.46 1.14 Allowed Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.23 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 12' ' ' HIS . 97.0 Cg_endo -79.72 1.18 9.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.496 2.131 . . . . 0.0 112.85 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.664 HG22 ' O ' ' A' ' 11' ' ' VAL . 12.3 t -58.5 -42.56 87.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.902 0.382 . . . . 0.0 110.996 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 150.02 44.91 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.539 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.84 166.1 24.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.845 0.355 . . . . 0.0 110.878 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.9 p -159.25 31.62 0.2 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.927 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -60.9 165.66 3.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.905 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 t . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 99.99 110.907 179.971 . . . . . . . . 0 0 . 1 stop_ save_