data_2lvh_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 2lvh _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.707 0.289 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.666 ' HB3' HG22 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.486 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.486 ' H ' ' C ' ' A' ' 13' ' ' CYS . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.811 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.811 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.666 HG22 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.594 ' HA ' HG11 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.608 HD13 ' HB3' ' A' ' 45' ' ' TYR . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.547 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.595 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.573 HG22 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.515 ' HA ' HG22 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.608 ' HB3' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.534 ' HB2' HD23 ' A' ' 14' ' ' LEU . 53.5 tt0 . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.839 ' HB ' HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.724 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.413 ' C ' ' H ' ' A' ' 15' ' ' ARG . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 13' ' ' CYS . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.595 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.595 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.839 HG21 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.451 ' NE2' HD13 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.632 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.632 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.541 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.653 HG11 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.662 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.664 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.521 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.653 ' HA ' HG11 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.537 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.5 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.647 ' O ' HG21 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.521 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.647 HG21 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.444 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.662 ' OE2' ' HB3' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.45 HG22 HD13 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.554 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.554 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.547 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.547 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.41 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.59 HG13 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.652 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.711 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.458 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.59 ' HG2' HG13 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.665 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.665 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.66 ' HZ2' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.403 HG13 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.403 ' HA ' HG13 ' A' ' 36' ' ' VAL . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.747 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.747 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 tt0 . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.655 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.627 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.655 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.655 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.655 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.413 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.401 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.475 HD12 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.445 ' O ' HG22 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.626 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.627 ' OE1' ' HB3' ' A' ' 15' ' ' ARG . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' HG12 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 ' HB3' ' A' ' 30' ' ' LEU . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.406 ' HA ' HD13 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.588 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.448 ' HB3' HD21 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.616 ' HB3' HG21 ' A' ' 19' ' ' THR . 3.1 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.604 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.727 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.727 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.616 HG21 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.544 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 11' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.438 ' CE1' HD13 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.562 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.545 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.416 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.453 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.604 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.453 ' HD2' ' O ' ' A' ' 41' ' ' ILE . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 . . . . . 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 120.917 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.1 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 HD22 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.749 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.749 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.555 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.555 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.594 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.594 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.448 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.597 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.597 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HB2' HD22 ' A' ' 14' ' ' LEU . 7.4 tp60 . . . . . 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.827 ' HB ' HG23 ' A' ' 19' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.16 0.505 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG22 ' A' ' 19' ' ' THR . 3.8 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.496 HD22 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.62 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.658 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.827 HG23 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.442 ' HE ' ' HB2' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.62 ' HZ1' ' HB2' ' A' ' 23' ' ' LYS . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.438 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.404 HG21 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.648 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.648 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.404 ' HB3' HG21 ' A' ' 27' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.496 ' HB2' HD22 ' A' ' 14' ' ' LEU . 29.4 tp60 . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.585 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 15.9 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NH2' ' HA ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.801 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.56 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.471 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.598 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.598 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.402 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.434 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.434 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.625 ' HB2' HD23 ' A' ' 14' ' ' LEU . 17.0 tt0 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m . . . . . 0 N--CA 1.449 -0.503 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.885 ' HG2' HG23 ' A' ' 19' ' ' THR . 9.6 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 15' ' ' ARG . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.58 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.783 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.783 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.885 HG23 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.528 ' HZ3' ' HB3' ' A' ' 23' ' ' LYS . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.472 HD22 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.592 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.657 ' HB2' HG22 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.657 HG22 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.483 ' HA ' HG11 ' A' ' 36' ' ' VAL . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CG ' HD22 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.448 ' HA ' ' HA ' ' A' ' 51' ' ' SER . 3.9 mpp? . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.994 0.426 . . . . 0.0 109.883 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -155.98 165.07 37.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.258 -176.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.641 ' HD3' ' HB3' ' A' ' 47' ' ' SER . 37.4 ttm180 -99.35 118.21 35.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.282 0.563 . . . . 0.0 109.885 176.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.594 HG11 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m -103.24 164.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.373 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.666 ' HB3' HG22 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.486 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.486 ' H ' ' C ' ' A' ' 13' ' ' CYS . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.811 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.811 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.666 HG22 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.594 ' HA ' HG11 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.608 HD13 ' HB3' ' A' ' 45' ' ' TYR . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.547 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.595 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.573 HG22 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.515 ' HA ' HG22 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.608 ' HB3' HD13 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.534 ' HB2' HD23 ' A' ' 14' ' ' LEU . 53.5 tt0 -130.38 136.18 48.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.641 ' HB3' ' HD3' ' A' ' 9' ' ' ARG . 16.3 m -93.48 125.0 37.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.571 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -135.11 137.31 42.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.161 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 15.7 m -97.9 128.43 44.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.678 0.275 . . . . 0.0 110.5 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -127.32 149.24 32.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.239 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 7' ' ' MET . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.22 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.79 141.89 51.38 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 122.154 -0.341 . . . . 0.0 110.222 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 0.1 OUTLIER -103.8 137.7 41.45 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.267 -178.718 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.839 ' HB ' HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER -125.51 143.47 38.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.724 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.413 ' C ' ' H ' ' A' ' 15' ' ' ARG . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' H ' ' C ' ' A' ' 13' ' ' CYS . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.595 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.595 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.839 HG21 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.431 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.451 ' NE2' HD13 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.632 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.632 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.541 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -122.68 128.06 50.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 t -110.99 127.31 55.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.819 0.343 . . . . 0.0 110.463 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -140.78 147.55 39.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.712 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 19.9 m -101.55 140.95 35.15 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.998 0.428 . . . . 0.0 110.693 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.0 m -96.03 179.89 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.005 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -175.939 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.055 0.455 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.44 133.45 35.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.126 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -98.67 106.48 18.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 172.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.653 HG11 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m -98.41 175.39 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.581 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.612 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.662 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.664 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.664 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.521 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.653 ' HA ' HG11 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.537 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.5 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.647 ' O ' HG21 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.521 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.647 HG21 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.444 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.662 ' OE2' ' HB3' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.45 HG22 HD13 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.554 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.554 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.547 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.547 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.41 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 -124.0 137.73 54.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.519 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 8.0 t -88.82 134.93 33.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -131.93 141.39 49.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.922 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.2 m -84.98 127.73 34.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.88 -178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.448 HG13 ' N ' ' A' ' 51' ' ' SER . 24.7 t -96.37 164.36 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.448 ' N ' HG13 ' A' ' 50' ' ' VAL . 48.9 m . . . . . 0 C--N 1.323 -0.57 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.5 ptm . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.798 0.808 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 21' ' ' ARG . 0.8 OUTLIER -152.67 166.79 31.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.41 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.706 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 58.5 ttp180 -98.52 114.64 27.12 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.59 HG13 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m -105.53 152.59 7.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.211 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.053 ' HA ' ' HB2' ' A' ' 47' ' ' SER . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.652 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.711 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.458 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.411 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.59 ' HG2' HG13 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.665 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.665 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.66 ' HZ2' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.403 HG13 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.433 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.403 ' HA ' HG13 ' A' ' 36' ' ' VAL . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.747 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.747 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.566 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 tt0 -151.16 132.75 14.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 1.053 ' HB2' ' HA ' ' A' ' 11' ' ' TYR . 2.9 m -174.87 -174.03 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.467 175.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -156.03 167.62 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -164.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.706 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 38.5 m -71.69 128.63 36.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 176.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.9 m -109.8 156.38 10.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.553 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 87.6 mmm . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 121.087 0.47 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -103.83 123.36 46.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.403 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -99.18 108.14 20.66 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m -99.24 141.89 15.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 -175.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.655 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.627 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.655 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.655 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.655 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.413 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.401 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.475 HD12 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.445 ' O ' HG22 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.626 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.627 ' OE1' ' HB3' ' A' ' 15' ' ' ARG . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' O ' HG12 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 ' HB3' ' A' ' 30' ' ' LEU . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.588 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.406 ' HA ' HD13 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.588 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -113.64 134.61 54.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 p -96.56 133.03 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -121.93 137.69 54.69 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 174.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -105.42 127.47 53.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.306 0.574 . . . . 0.0 111.877 -174.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 20.1 t -114.15 121.82 67.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.344 176.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.7 m . . . . . 0 C--N 1.32 -0.712 0 O-C-N 122.295 -0.253 . . . . 0.0 110.461 -177.299 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 121.281 0.562 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -86.47 111.7 20.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.886 0.374 . . . . 0.0 110.708 -176.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -84.86 104.25 14.64 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 172.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m -99.47 157.81 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.749 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.448 ' HB3' HD21 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.616 ' HB3' HG21 ' A' ' 19' ' ' THR . 3.1 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.604 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.727 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.727 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.616 HG21 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.544 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.544 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 11' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.438 ' CE1' HD13 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.562 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.562 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.49 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.545 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.416 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.453 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.604 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.453 ' HD2' ' O ' ' A' ' 41' ' ' ILE . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -139.5 141.68 37.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.3 m -87.61 126.69 35.09 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -132.95 138.76 47.01 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.1 m -107.54 128.59 54.65 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.049 0.452 . . . . 0.0 111.35 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.3 m -116.98 153.27 18.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.716 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.512 -175.799 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.708 0.289 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -78.67 169.44 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.452 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.5 mtm-85 -129.99 133.19 46.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.352 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.522 HG21 ' HB3' ' A' ' 48' ' ' PHE . 1.1 m -108.24 131.88 57.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.626 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.1 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 HD22 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.749 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.749 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.555 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.402 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.555 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.594 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.594 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.557 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.448 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.597 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.597 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HB2' HD22 ' A' ' 14' ' ' LEU . 7.4 tp60 -123.57 130.38 52.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 p -101.12 141.29 34.22 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.934 0.397 . . . . 0.0 110.768 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.522 ' HB3' HG21 ' A' ' 10' ' ' VAL . 79.1 t80 -134.62 136.95 43.26 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.4 p -98.85 130.8 45.28 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.0 m -90.22 151.91 3.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.317 -0.825 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.748 -172.296 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 80.2 mtp . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.301 0.096 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.531 ' HB2' ' CG1' ' A' ' 50' ' ' VAL . 8.1 mm-40 -112.51 116.32 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.861 -173.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 -95.91 100.69 12.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.079 0.466 . . . . 0.0 110.247 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.827 ' HB ' HG23 ' A' ' 19' ' ' THR . 0.3 OUTLIER -101.4 148.17 7.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.171 -178.332 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG22 ' A' ' 19' ' ' THR . 3.8 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.496 HD22 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.62 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.658 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.827 HG23 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.442 ' HE ' ' HB2' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.62 ' HB2' ' HZ1' ' A' ' 23' ' ' LYS . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.438 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.404 HG21 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.438 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.648 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.648 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.404 ' HB3' HG21 ' A' ' 27' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.496 ' HB2' HD22 ' A' ' 14' ' ' LEU . 29.4 tp60 -123.13 128.61 50.32 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.5 p -86.96 126.44 34.71 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.576 ' HB3' HG21 ' A' ' 10' ' ' VAL . 66.7 t80 -116.73 135.57 53.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 121.011 0.434 . . . . 0.0 109.902 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -111.82 127.58 55.86 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.163 176.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.531 ' CG1' ' HB2' ' A' ' 8' ' ' GLU . 4.8 p -124.33 143.24 38.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.172 -172.345 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' MET . . . . . 0.474 ' HE3' ' HG3' ' A' ' 8' ' ' GLU . 49.7 ttp . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.582 0.229 . . . . 0.0 111.016 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.474 ' HG3' ' HE3' ' A' ' 7' ' ' MET . 43.6 mt-10 -92.33 162.27 14.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 0.0 111.292 -176.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -121.89 128.44 51.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.473 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m -109.22 155.74 10.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 -176.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.47 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.585 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 15.9 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.625 HD23 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' NH2' ' HA ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.801 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.801 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.56 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.471 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.598 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.517 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.598 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.402 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.434 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.434 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.625 ' HB2' HD23 ' A' ' 14' ' ' LEU . 17.0 tt0 -120.9 145.59 47.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.5 m -116.81 134.73 54.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.621 0.248 . . . . 0.0 110.431 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -144.87 148.78 34.34 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 p -92.27 128.27 38.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.712 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.713 HG23 ' H ' ' A' ' 51' ' ' SER . 10.2 p -108.3 -179.86 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.713 ' H ' HG23 ' A' ' 50' ' ' VAL . 19.5 m . . . . . 0 C--N 1.319 -0.722 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.9 ptp . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.291 0.567 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -119.17 141.82 48.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.324 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.45 120.79 40.51 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.671 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m -102.75 131.27 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 172.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.885 ' HG2' HG23 ' A' ' 19' ' ' THR . 9.6 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 15' ' ' ARG . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.58 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.783 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.783 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.885 HG23 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.528 ' HZ3' ' HB3' ' A' ' 23' ' ' LYS . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.472 HD22 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.592 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.657 ' HB2' HG22 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.657 HG22 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HA ' HG22 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.483 ' HA ' HG11 ' A' ' 36' ' ' VAL . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TYR . . . . . 0.472 ' CG ' HD22 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -128.3 130.34 47.67 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.413 ' OG ' ' HE1' ' A' ' 45' ' ' TYR . 17.3 m -88.88 126.34 35.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.07 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -122.44 136.46 54.9 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -96.4 127.97 42.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.02 0.438 . . . . 0.0 110.616 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.87 161.69 14.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m . . . . . 0 C--N 1.319 -0.755 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.828 -176.665 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.707 0.289 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.713 ' HB3' HG23 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.45 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.561 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.84 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.84 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.713 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.603 ' HA ' HG12 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.658 HD23 ' HG3' ' A' ' 34' ' ' GLU . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' ILE . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.564 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.658 ' HG3' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.624 ' HA ' HG23 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.624 HG23 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.637 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.561 ' HB2' HD21 ' A' ' 14' ' ' LEU . 53.5 tt0 . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.869 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.738 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.625 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.869 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.46 ' NE2' HD12 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.658 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 35' ' ' LYS . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.537 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD22 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.676 HG12 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.666 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.694 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.694 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.522 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.676 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.534 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.507 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.413 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.681 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.574 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG12 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.62 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 46' ' ' GLN . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.663 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.742 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.742 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.685 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.685 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' NZ ' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.432 HG11 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' ILE . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.413 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.456 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.752 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.752 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 60.2 tt0 . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.633 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.691 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' HG12 ' A' ' 10' ' ' VAL . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.465 HD13 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.437 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 28' ' ' ARG . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.649 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HA ' HG23 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.431 ' HA ' HD12 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.663 ' HB3' HG22 ' A' ' 19' ' ' THR . 28.3 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 46' ' ' GLN . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.609 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.757 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.757 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.663 HG22 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.551 HD11 ' HB2' ' A' ' 45' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.443 ' CE1' HD12 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.579 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.613 HG23 ' HB2' ' A' ' 34' ' ' GLU . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.609 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.551 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.405 ' CB ' HD21 ' A' ' 14' ' ' LEU . 7.0 tp60 . . . . . 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 120.917 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 13.3 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.434 HD21 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.598 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.777 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.554 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.435 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.554 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.617 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.642 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.617 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.468 ' HA ' HG11 ' A' ' 36' ' ' VAL . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' HD21 ' A' ' 14' ' ' LEU . 7.4 tp60 . . . . . 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.849 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.16 0.505 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 19' ' ' THR . 11.4 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.631 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.687 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.849 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' HB2' ' HE ' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.4 HG23 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.667 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.667 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.42 ' HA ' HG23 ' A' ' 41' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.42 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.518 ' HB2' HD21 ' A' ' 14' ' ' LEU . 29.4 tp60 . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 15.9 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HE ' ' CD ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.832 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.832 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 45' ' ' TYR . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.472 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.618 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.618 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.466 ' HB2' HD11 ' A' ' 26' ' ' LEU . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.647 ' HB2' HD21 ' A' ' 14' ' ' LEU . 17.0 tt0 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m . . . . . 0 N--CA 1.449 -0.503 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.896 ' HG2' HG22 ' A' ' 19' ' ' THR . 42.7 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.589 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.814 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.814 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.896 HG22 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.604 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.488 HD21 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.612 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.678 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.678 HG23 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HA ' HG23 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.499 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CG ' HD21 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 51' ' ' SER . 3.9 mpp? . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.994 0.426 . . . . 0.0 109.883 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -155.98 165.07 37.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.258 -176.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.655 ' HD3' ' HB3' ' A' ' 47' ' ' SER . 37.4 ttm180 -99.35 118.21 35.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.282 0.563 . . . . 0.0 109.885 176.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m -103.24 164.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.373 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.713 ' HB3' HG23 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.45 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.561 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.84 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.84 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.713 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.603 ' HA ' HG12 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.658 HD23 ' HG3' ' A' ' 34' ' ' GLU . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' ILE . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.564 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.658 ' HG3' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.624 ' HA ' HG23 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.624 HG23 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.637 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.561 ' HB2' HD21 ' A' ' 14' ' ' LEU . 53.5 tt0 -130.38 136.18 48.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.655 ' HB3' ' HD3' ' A' ' 9' ' ' ARG . 16.3 m -93.48 125.0 37.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.571 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -135.11 137.31 42.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.161 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 15.7 m -97.9 128.43 44.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.678 0.275 . . . . 0.0 110.5 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -127.32 149.24 32.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.239 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 7' ' ' MET . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.22 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.79 141.89 51.38 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 122.154 -0.341 . . . . 0.0 110.222 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 0.1 OUTLIER -103.8 137.7 41.45 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.267 -178.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.869 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.6 OUTLIER -125.51 143.47 38.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.738 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.625 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.869 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.46 ' NE2' HD12 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.658 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 35' ' ' LYS . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.537 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD22 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -122.68 128.06 50.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 t -110.99 127.31 55.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.819 0.343 . . . . 0.0 110.463 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -140.78 147.55 39.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.712 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 19.9 m -101.55 140.95 35.15 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.998 0.428 . . . . 0.0 110.693 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.0 m -96.03 179.89 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.005 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -175.939 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.055 0.455 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.44 133.45 35.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.126 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -98.67 106.48 18.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 172.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.676 HG12 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m -98.41 175.39 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.581 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.666 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.694 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.694 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.522 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.676 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.534 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.413 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.681 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.574 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 -124.0 137.73 54.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 8.0 t -88.82 134.93 33.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -131.93 141.39 49.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.922 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.2 m -84.98 127.73 34.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.88 -178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.437 HG12 ' N ' ' A' ' 51' ' ' SER . 24.7 t -96.37 164.36 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.437 ' N ' HG12 ' A' ' 50' ' ' VAL . 48.9 m . . . . . 0 C--N 1.323 -0.57 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.5 ptm . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.798 0.808 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.514 ' HG3' ' HD2' ' A' ' 21' ' ' ARG . 0.8 OUTLIER -152.67 166.79 31.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.41 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.733 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 58.5 ttp180 -98.52 114.64 27.12 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG12 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m -105.53 152.59 7.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.211 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 1.064 ' HA ' ' HB2' ' A' ' 47' ' ' SER . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.62 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 46' ' ' GLN . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.663 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.742 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.742 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.685 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.685 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' HB2' ' NZ ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.432 HG11 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.456 ' HA ' HG23 ' A' ' 41' ' ' ILE . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.413 HD22 ' N ' ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.456 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.752 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.752 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 60.2 tt0 -151.16 132.75 14.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 1.064 ' HB2' ' HA ' ' A' ' 11' ' ' TYR . 2.9 m -174.87 -174.03 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.467 175.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -156.03 167.62 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -164.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.733 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 38.5 m -71.69 128.63 36.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 176.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.9 m -109.8 156.38 10.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.553 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 87.6 mmm . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 121.087 0.47 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -103.83 123.36 46.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.403 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -99.18 108.14 20.66 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m -99.24 141.89 15.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 -175.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.633 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.691 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' HG12 ' A' ' 10' ' ' VAL . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.465 HD13 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.437 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 28' ' ' ARG . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.649 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HA ' HG23 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.431 ' HA ' HD12 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -113.64 134.61 54.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 p -96.56 133.03 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -121.93 137.69 54.69 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 174.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -105.42 127.47 53.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.306 0.574 . . . . 0.0 111.877 -174.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 20.1 t -114.15 121.82 67.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.344 176.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.7 m . . . . . 0 C--N 1.32 -0.712 0 O-C-N 122.295 -0.253 . . . . 0.0 110.461 -177.299 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 121.281 0.562 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -86.47 111.7 20.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.886 0.374 . . . . 0.0 110.708 -176.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -84.86 104.25 14.64 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 172.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m -99.47 157.81 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.749 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.663 ' HB3' HG22 ' A' ' 19' ' ' THR . 28.3 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 46' ' ' GLN . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.609 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.757 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.757 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.663 HG22 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.551 HD11 ' HB2' ' A' ' 45' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.443 ' CE1' HD12 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.579 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.613 HG23 ' HB2' ' A' ' 34' ' ' GLU . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.609 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.551 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.405 ' CB ' HD21 ' A' ' 14' ' ' LEU . 7.0 tp60 -139.5 141.68 37.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.3 m -87.61 126.69 35.09 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -132.95 138.76 47.01 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.1 m -107.54 128.59 54.65 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.049 0.452 . . . . 0.0 111.35 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.3 m -116.98 153.27 18.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.716 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.512 -175.799 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.708 0.289 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -78.67 169.44 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.452 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.5 mtm-85 -129.99 133.19 46.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.352 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.533 HG23 ' HB3' ' A' ' 48' ' ' PHE . 1.1 m -108.24 131.88 57.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 13.3 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.434 HD21 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.598 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.777 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.554 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.435 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.554 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.617 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.642 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.617 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.468 ' HA ' HG11 ' A' ' 36' ' ' VAL . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' HD21 ' A' ' 14' ' ' LEU . 7.4 tp60 -123.57 130.38 52.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 p -101.12 141.29 34.22 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.934 0.397 . . . . 0.0 110.768 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.533 ' HB3' HG23 ' A' ' 10' ' ' VAL . 79.1 t80 -134.62 136.95 43.26 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.4 p -98.85 130.8 45.28 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.0 m -90.22 151.91 3.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.317 -0.825 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.748 -172.296 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 80.2 mtp . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.301 0.096 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.54 ' HB2' ' CG1' ' A' ' 50' ' ' VAL . 8.1 mm-40 -112.51 116.32 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.861 -173.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 9' ' ' ARG . 35.1 mtm180 -95.91 100.69 12.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.079 0.466 . . . . 0.0 110.247 172.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.849 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER -101.4 148.17 7.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.171 -178.332 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 19' ' ' THR . 11.4 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.631 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.687 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.849 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' HB2' ' HE ' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.4 HG23 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.667 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.667 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.42 ' HA ' HG23 ' A' ' 41' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.42 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.518 ' HB2' HD21 ' A' ' 14' ' ' LEU . 8.3 tp-100 -123.13 128.61 50.32 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.5 p -86.96 126.44 34.71 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.606 ' HB3' HG23 ' A' ' 10' ' ' VAL . 66.7 t80 -116.73 135.57 53.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 121.011 0.434 . . . . 0.0 109.902 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -111.82 127.58 55.86 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.163 176.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.54 ' CG1' ' HB2' ' A' ' 8' ' ' GLU . 4.8 p -124.33 143.24 38.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.172 -172.345 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' MET . . . . . 0.43 ' HB3' ' HE2' ' A' ' 7' ' ' MET . 49.7 ttp . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.582 0.229 . . . . 0.0 111.016 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -92.33 162.27 14.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 0.0 111.292 -176.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -121.89 128.44 51.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.473 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m -109.22 155.74 10.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 -176.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 10.0 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HE ' ' CD ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.832 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.832 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 45' ' ' TYR . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.472 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.618 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.618 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.466 ' HB2' HD11 ' A' ' 26' ' ' LEU . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.647 ' HB2' HD21 ' A' ' 14' ' ' LEU . 17.0 tt0 -120.9 145.59 47.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.5 m -116.81 134.73 54.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.621 0.248 . . . . 0.0 110.431 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -144.87 148.78 34.34 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 p -92.27 128.27 38.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.712 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.665 HG22 ' H ' ' A' ' 51' ' ' SER . 10.2 p -108.3 -179.86 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.665 ' H ' HG22 ' A' ' 50' ' ' VAL . 19.5 m . . . . . 0 C--N 1.319 -0.722 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.9 ptp . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.291 0.567 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -119.17 141.82 48.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.324 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.45 120.79 40.51 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.671 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m -102.75 131.27 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 172.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.896 ' HG2' HG22 ' A' ' 19' ' ' THR . 42.7 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.589 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.814 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.814 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.896 HG22 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.604 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.488 HD21 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.612 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.678 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.678 HG23 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HA ' HG23 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.499 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CG ' HD21 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -128.3 130.34 47.67 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.413 ' OG ' ' HE1' ' A' ' 45' ' ' TYR . 17.3 m -88.88 126.34 35.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.07 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -122.44 136.46 54.9 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -96.4 127.97 42.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.02 0.438 . . . . 0.0 110.616 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.87 161.69 14.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m . . . . . 0 C--N 1.319 -0.755 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.828 -176.665 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 120.707 0.289 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.713 ' HB3' HG23 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.45 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.561 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.84 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.84 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.713 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.603 ' HA ' HG12 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.658 HD23 ' HG3' ' A' ' 34' ' ' GLU . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' ILE . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.564 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.658 ' HG3' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.624 ' HA ' HG23 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.624 HG23 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.637 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.561 ' HB2' HD21 ' A' ' 14' ' ' LEU . 53.5 tt0 . . . . . 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.869 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.738 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.625 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.869 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.46 ' NE2' HD12 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.658 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 35' ' ' LYS . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.537 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD22 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.676 HG12 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.581 -0.155 . . . . 0.0 110.581 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.666 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.694 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.694 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.522 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.676 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.534 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.507 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.413 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.681 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.574 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.613 HG12 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m . . . . . 0 C--O 1.239 0.508 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.62 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 46' ' ' GLN . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.663 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.742 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.742 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.685 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.685 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.455 ' NZ ' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.432 HG11 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.413 HD22 ' N ' ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.456 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.752 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.752 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 tt0 . . . . . 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m . . . . . 0 N--CA 1.447 -0.599 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.633 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.691 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' HG12 ' A' ' 10' ' ' VAL . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.465 HD13 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.437 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 28' ' ' ARG . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.649 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HA ' HG23 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.431 ' HA ' HD12 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.023 0.44 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.663 ' HB3' HG22 ' A' ' 19' ' ' THR . 3.1 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 46' ' ' GLN . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.609 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.757 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.757 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.663 HG22 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.551 HD11 ' HB2' ' A' ' 45' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.443 ' CE1' HD12 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.579 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.613 HG23 ' HB2' ' A' ' 34' ' ' GLU . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.609 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.551 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.405 ' CB ' HD21 ' A' ' 14' ' ' LEU . 7.0 tp60 . . . . . 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.451 -0.424 0 CA-C-O 120.917 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.1 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.434 HD21 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.598 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.777 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.554 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.435 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.554 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.617 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.642 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.617 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.468 ' HA ' HG11 ' A' ' 36' ' ' VAL . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' HD21 ' A' ' 14' ' ' LEU . 7.4 tp60 . . . . . 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.849 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.16 0.505 . . . . 0.0 111.171 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 19' ' ' THR . 3.8 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.631 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.687 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.849 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.445 ' HE ' ' HB2' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.4 HG23 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.667 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.667 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.42 ' HA ' HG23 ' A' ' 41' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.42 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.518 ' HB2' HD21 ' A' ' 14' ' ' LEU . 29.4 tp60 . . . . . 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.3 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 15.9 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HE ' ' CD ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.832 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.832 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 45' ' ' TYR . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.472 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.618 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.618 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.466 ' HB2' HD11 ' A' ' 26' ' ' LEU . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.647 ' HB2' HD21 ' A' ' 14' ' ' LEU . 17.0 tt0 . . . . . 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m . . . . . 0 N--CA 1.449 -0.503 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.896 ' HG2' HG22 ' A' ' 19' ' ' THR . 9.6 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.589 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.814 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.814 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.896 HG22 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.604 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.488 HD21 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.612 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.678 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.678 HG23 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HA ' HG23 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.499 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CG ' HD21 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 51' ' ' SER . 3.9 mpp? . . . . . 0 N--CA 1.481 1.098 0 CA-C-O 120.994 0.426 . . . . 0.0 109.883 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.5 pm0 -155.98 165.07 37.55 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.258 -176.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.655 ' HD3' ' HB3' ' A' ' 47' ' ' SER . 37.4 ttm180 -99.35 118.21 35.5 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.282 0.563 . . . . 0.0 109.885 176.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.603 HG12 ' HA ' ' A' ' 21' ' ' ARG . 23.4 m -103.24 164.83 3.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.373 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -132.49 120.58 22.11 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.225 -0.658 . . . . 0.0 109.225 -174.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.713 ' HB3' HG23 ' A' ' 19' ' ' THR . 24.6 pt20 -103.93 150.04 24.56 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.796 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.45 ' C ' ' H ' ' A' ' 15' ' ' ARG . 13.7 p -83.15 127.93 34.04 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 172.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.561 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.4 OUTLIER -71.88 13.83 0.26 Allowed 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.03 0.443 . . . . 0.0 111.662 -176.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.5 mmm180 -108.8 -56.7 2.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.479 -175.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.84 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 3.2 m -98.87 -17.57 18.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.297 0.57 . . . . 0.0 109.569 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.29 21.82 61.82 Favored Glycine 0 N--CA 1.447 -0.578 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.285 -174.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.84 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 70.3 mt -85.7 123.59 31.27 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.459 -175.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.713 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -106.51 134.46 49.63 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.151 0.501 . . . . 0.0 111.216 -174.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 7.5 m-85 -120.68 153.37 36.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.813 -178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.603 ' HA ' HG12 ' A' ' 10' ' ' VAL . 35.3 mtp180 -87.36 -7.07 58.17 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 21.5 p -140.26 149.97 43.5 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.859 0.361 . . . . 0.0 110.429 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -67.47 -26.57 66.45 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.971 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 60.5 tttp -60.38 -49.43 77.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.889 0.376 . . . . 0.0 110.654 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -63.61 -35.81 81.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.235 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 45' ' ' TYR . 13.1 tp -65.55 -52.92 48.83 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.366 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 31' ' ' VAL . 85.9 mt -65.3 -44.24 94.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.2 -174.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 10.0 ptm180 -63.13 -29.17 70.59 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.832 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 60.1 t60 -81.76 -42.23 20.07 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.836 -0.165 . . . . 0.0 110.845 178.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.658 HD23 ' HG3' ' A' ' 34' ' ' GLU . 14.0 mt -52.23 -47.59 65.63 Favored 'General case' 0 CA--C 1.528 0.126 0 CA-C-O 120.646 0.26 . . . . 0.0 110.476 171.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' ILE . 98.1 t -66.49 -48.83 79.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.225 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -64.39 -60.16 3.49 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.564 ' HB ' ' OE1' ' A' ' 34' ' ' GLU . 16.5 m -94.98 -43.27 8.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -168.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.658 ' HG3' HD23 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -89.71 3.93 51.21 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 121.142 -0.223 . . . . 0.0 111.178 -174.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 21.5 pttp 51.19 32.67 8.32 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.424 1.089 . . . . 0.0 112.42 -179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.591 HG23 ' HB2' ' A' ' 34' ' ' GLU . 99.0 t -93.88 123.39 45.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.799 -179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -76.34 145.03 75.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.624 ' HA ' HG23 ' A' ' 41' ' ' ILE . 15.1 Cg_endo -56.76 -19.21 30.0 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.73 2.953 . . . . 0.0 114.285 -173.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 84.4 mt -86.94 -3.99 59.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.759 0.314 . . . . 0.0 111.591 177.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.8 m -124.72 17.01 8.74 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.693 0.282 . . . . 0.0 111.473 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.624 HG23 ' HA ' ' A' ' 38' ' ' PRO . 29.2 pt -70.25 -23.07 24.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -57.05 -24.66 55.48 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -169.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -92.22 -20.81 20.79 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -108.91 4.05 22.98 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.381 -171.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.637 ' HB3' HD11 ' A' ' 30' ' ' LEU . 1.0 OUTLIER -131.29 145.66 51.98 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.081 174.4 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.561 ' HB2' HD21 ' A' ' 14' ' ' LEU . 53.5 tt0 -130.38 136.18 48.81 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.695 179.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.655 ' HB3' ' HD3' ' A' ' 9' ' ' ARG . 16.3 m -93.48 125.0 37.85 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.571 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -135.11 137.31 42.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.161 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 15.7 m -97.9 128.43 44.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.678 0.275 . . . . 0.0 110.5 -179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -127.32 149.24 32.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.239 -178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 7' ' ' MET . 14.9 m . . . . . 0 C--N 1.323 -0.587 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.22 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 41.0 ttp . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -70.79 141.89 51.38 Favored 'General case' 0 C--N 1.329 -0.297 0 O-C-N 122.154 -0.341 . . . . 0.0 110.222 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 0.1 OUTLIER -103.8 137.7 41.45 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.267 -178.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.869 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.6 OUTLIER -125.51 143.47 38.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.06 0.457 . . . . 0.0 111.233 179.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' THR . 72.9 m-85 -109.01 117.37 34.03 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.7 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.738 ' HG3' HG23 ' A' ' 19' ' ' THR . 11.8 mt-30 -98.78 129.17 45.19 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.723 -0.217 . . . . 0.0 110.866 177.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.6 p -77.06 122.55 25.11 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 107.007 -1.479 . . . . 0.0 107.007 168.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.6 12.06 0.89 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.905 0.383 . . . . 0.0 111.724 -174.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -104.24 -51.98 3.02 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.799 0.333 . . . . 0.0 110.515 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.625 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -105.9 -12.07 15.97 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 121.157 0.503 . . . . 0.0 110.042 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.06 24.6 63.67 Favored Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.786 -176.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.625 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 62.8 mt -85.51 129.22 34.87 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.49 -176.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.869 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.93 136.42 49.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.937 0.399 . . . . 0.0 111.581 -176.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -127.4 147.57 50.28 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.352 -0.611 . . . . 0.0 109.352 178.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -94.71 6.97 47.34 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.387 0.613 . . . . 0.0 110.284 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -139.11 132.54 30.18 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.064 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -67.71 -23.88 65.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.735 -174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.0 mttm -67.72 -43.23 80.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.853 0.359 . . . . 0.0 111.046 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -68.82 -27.64 66.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.311 177.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 11' ' ' TYR . 16.3 tp -66.06 -52.88 44.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.185 175.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 68.5 mt -60.96 -42.52 93.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.81 -177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 73.8 mtt180 -54.97 -51.08 67.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.035 0.445 . . . . 0.0 111.02 177.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.46 ' NE2' HD12 ' A' ' 18' ' ' LEU . 56.6 t60 -69.42 -45.83 68.24 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.003 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.658 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.9 mm? -52.44 -52.33 54.56 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 175.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 64.5 t -73.14 -43.3 58.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.094 0.473 . . . . 0.0 111.735 -175.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -79.95 -48.35 13.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.758 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.5 m -95.67 -43.19 8.03 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -172.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.658 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -84.42 1.3 46.01 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.313 -178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 35' ' ' LYS . 17.9 ptmt 49.34 33.4 5.32 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.484 1.114 . . . . 0.0 112.094 -175.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.475 HG23 ' O ' ' A' ' 34' ' ' GLU . 94.5 t -109.26 110.3 31.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -67.91 155.19 92.33 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.109 -177.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.537 ' O ' HG12 ' A' ' 41' ' ' ILE . 74.4 Cg_exo -49.74 -42.38 43.74 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.123 2.549 . . . . 0.0 113.484 -172.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD22 ' HB2' ' A' ' 38' ' ' PRO . 3.5 mm? -77.97 11.72 2.11 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.998 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.8 m -138.91 6.31 2.41 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 122.25 -0.281 . . . . 0.0 111.75 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.6 pt -68.46 -15.64 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 -177.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -46.28 -40.21 11.25 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.785 0.834 . . . . 0.0 112.763 -174.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -85.26 -21.12 29.17 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.612 0.597 . . . . 0.0 112.612 -175.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -105.26 -10.38 17.08 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -166.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.446 ' HD1' ' O ' ' A' ' 41' ' ' ILE . 4.7 p90 -117.66 140.59 49.45 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.424 178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -122.68 128.06 50.1 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.642 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.6 t -110.99 127.31 55.48 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.819 0.343 . . . . 0.0 110.463 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -140.78 147.55 39.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.712 176.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 19.9 m -101.55 140.95 35.15 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.998 0.428 . . . . 0.0 110.693 -177.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.0 m -96.03 179.89 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.005 178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 6.2 m . . . . . 0 C--N 1.323 -0.568 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -175.939 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.055 0.455 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -80.44 133.45 35.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.126 -178.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -98.67 106.48 18.76 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 172.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.676 HG12 ' HA ' ' A' ' 21' ' ' ARG . 27.6 m -98.41 175.39 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.581 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -126.89 126.08 42.67 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.644 ' HB3' HG23 ' A' ' 19' ' ' THR . 20.7 pt20 -109.5 140.66 42.98 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.717 0.294 . . . . 0.0 110.625 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.2 p -81.23 131.42 35.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -76.34 8.98 2.89 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.666 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 9.8 tpt180 -99.85 -56.45 2.38 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.924 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.694 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -103.5 -16.44 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.987 0.422 . . . . 0.0 110.506 -174.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.96 1.57 86.75 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.606 -176.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.694 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 83.3 mt -66.58 124.67 23.47 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.506 0.193 . . . . 0.0 110.519 -177.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.3 OUTLIER -108.9 138.13 45.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.135 -177.522 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.522 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 2.4 m-85 -124.93 147.25 48.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.356 -176.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.676 ' HA ' HG12 ' A' ' 10' ' ' VAL . 9.3 mpt_? -84.4 -28.56 26.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.779 178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.06 134.21 52.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.176 0.513 . . . . 0.0 110.763 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.534 ' O ' HG12 ' A' ' 27' ' ' ILE . 48.2 tttp -65.9 -32.97 74.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.85 -174.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -63.93 -39.89 95.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.778 0.323 . . . . 0.0 110.893 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -67.23 -33.5 75.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.061 0.457 . . . . 0.0 109.9 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' HB3' ' O ' ' A' ' 23' ' ' LYS . 13.5 tp -60.85 -51.56 68.8 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.996 174.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.658 ' O ' HG22 ' A' ' 31' ' ' VAL . 8.4 mm -60.6 -46.66 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.239 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.452 -177.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -51.32 -46.83 62.73 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.513 0.508 . . . . 0.0 111.642 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.522 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 67.2 t60 -74.14 -45.86 46.13 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.866 -178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.681 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.0 mm? -52.05 -49.12 64.09 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 175.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.658 HG22 ' O ' ' A' ' 27' ' ' ILE . 14.6 m -69.22 -52.06 37.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.413 ' N ' HG23 ' A' ' 31' ' ' VAL . 61.4 t30 -71.97 -60.34 2.28 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.2 m -80.34 -48.23 13.28 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.91 0.337 . . . . 0.0 111.91 -171.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.681 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.06 -4.27 54.67 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -178.386 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.569 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 17.4 ptpt 48.69 33.65 4.44 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.179 1.392 . . . . 0.0 113.793 177.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.48 HG21 HD12 ' A' ' 30' ' ' LEU . 35.4 m -95.15 144.07 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.857 0 CA-C-O 121.33 0.586 . . . . 0.0 111.004 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.574 ' OD1' ' HD2' ' A' ' 38' ' ' PRO . 65.7 t30 -68.13 138.23 92.14 Favored Pre-proline 0 C--N 1.322 -0.593 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.574 ' HD2' ' OD1' ' A' ' 37' ' ' ASN . 77.2 Cg_exo -51.74 -19.87 8.56 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.65 2.9 . . . . 0.0 114.206 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -87.79 -4.14 58.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.054 0.454 . . . . 0.0 110.819 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 36.7 t -122.13 8.84 9.81 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.774 -176.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.454 HG23 ' HA ' ' A' ' 38' ' ' PRO . 7.7 pt -58.57 -42.89 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.317 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -177.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 9.5 m-20 -57.87 -21.67 44.21 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 -173.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -79.49 -21.81 44.86 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.327 -177.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -117.73 2.58 12.28 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.555 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.6 p90 -124.43 145.34 49.55 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.882 -0.727 . . . . 0.0 110.939 174.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 46' ' ' GLN . 13.8 mm-40 -124.0 137.73 54.56 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.334 179.153 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.535 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 8.0 t -88.82 134.93 33.78 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -131.93 141.39 49.32 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.922 -179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.2 m -84.98 127.73 34.32 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.88 -178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.437 HG12 ' N ' ' A' ' 51' ' ' SER . 24.7 t -96.37 164.36 2.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 175.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.437 ' N ' HG12 ' A' ' 50' ' ' VAL . 48.9 m . . . . . 0 C--N 1.323 -0.57 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.5 ptm . . . . . 0 N--CA 1.48 1.025 0 CA-C-O 121.798 0.808 . . . . 0.0 110.513 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.514 ' HG3' ' HD2' ' A' ' 21' ' ' ARG . 0.8 OUTLIER -152.67 166.79 31.04 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.41 -179.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.733 ' HA ' ' HA ' ' A' ' 49' ' ' SER . 58.5 ttp180 -98.52 114.64 27.12 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 177.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.613 HG12 ' HG2' ' A' ' 21' ' ' ARG . 32.7 m -105.53 152.59 7.3 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.211 -178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 1.064 ' HA ' ' HB2' ' A' ' 47' ' ' SER . 0.6 OUTLIER -131.49 125.83 33.43 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 124.181 0.926 . . . . 0.0 108.587 176.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.62 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 11.9 pt20 -112.35 136.93 51.22 Favored 'General case' 0 CA--C 1.517 -0.327 0 C-N-CA 119.759 -0.777 . . . . 0.0 110.598 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.7 p -66.82 135.96 54.71 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' HB3' ' A' ' 46' ' ' GLN . 76.9 mt -72.84 5.95 2.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.025 0.441 . . . . 0.0 111.616 -175.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.663 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 10.3 tpt180 -99.42 -59.13 1.78 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.553 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.742 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.5 m -102.66 -10.36 19.29 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.032 0.444 . . . . 0.0 110.689 -172.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 74.91 14.64 81.49 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.939 -177.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.742 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 74.3 mt -73.97 122.84 23.21 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 121.327 -0.149 . . . . 0.0 111.389 -178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.473 ' CG2' ' HB3' ' A' ' 12' ' ' GLN . 2.9 p -94.77 137.67 33.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.013 0.435 . . . . 0.0 111.523 -178.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 17.8 m-85 -124.29 149.71 46.21 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 175.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.613 ' HG2' HG12 ' A' ' 10' ' ' VAL . 88.0 mtm180 -104.18 -16.03 15.34 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.475 0.655 . . . . 0.0 109.858 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 16.7 p -113.07 137.28 51.67 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.769 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -65.45 -27.23 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.901 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -63.9 -44.68 92.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.846 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -66.95 -33.65 76.05 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.853 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 38.5 tp -63.41 -51.89 63.86 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.972 177.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 76.7 mt -61.35 -44.93 99.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.618 -179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 91.7 mtt180 -55.66 -43.02 75.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.564 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 62.5 t60 -79.48 -46.64 17.05 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.256 -176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.685 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.5 -42.98 64.78 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 174.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 94.5 t -76.43 -40.67 34.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 120.717 0.294 . . . . 0.0 111.518 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -75.57 -57.46 3.87 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.219 0.451 . . . . 0.0 112.219 -174.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 57.3 m -96.32 -42.01 8.36 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -172.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.685 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -81.96 -3.07 53.51 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.967 0.413 . . . . 0.0 110.563 -176.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.455 ' NZ ' ' HB2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER 48.23 42.23 17.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.847 1.259 . . . . 0.0 112.972 178.132 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.432 HG11 ' HA ' ' A' ' 41' ' ' ILE . 86.2 t -109.52 134.77 50.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.073 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 56.5 m-20 -64.78 140.9 98.19 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.46 174.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 31.3 Cg_exo -59.14 -19.7 50.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.376 2.717 . . . . 0.0 112.977 -175.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.413 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.1 mm? -87.62 0.8 55.14 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.06 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.9 m -135.34 5.44 3.23 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -178.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.456 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -57.29 -30.07 34.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -177.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.752 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 12.3 t70 -58.23 -22.29 51.49 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 112.636 0.606 . . . . 0.0 112.636 -170.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -90.08 -20.89 22.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.698 0.285 . . . . 0.0 111.321 -177.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -108.83 5.55 24.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.2 0.524 . . . . 0.0 110.99 -172.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.752 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 3.8 p90 -132.16 146.01 51.74 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.179 171.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.587 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 tt0 -151.16 132.75 14.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 175.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 1.064 ' HB2' ' HA ' ' A' ' 11' ' ' TYR . 2.9 m -174.87 -174.03 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.467 175.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -156.03 167.62 29.85 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 -164.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.733 ' HA ' ' HA ' ' A' ' 9' ' ' ARG . 38.5 m -71.69 128.63 36.4 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.345 176.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 24.9 m -109.8 156.38 10.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 -176.553 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 87.6 mmm . . . . . 0 N--CA 1.484 1.228 0 CA-C-O 121.087 0.47 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -103.83 123.36 46.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.403 -173.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 83.0 mtm180 -99.18 108.14 20.66 Favored 'General case' 0 C--N 1.315 -0.91 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 18.1 m -99.24 141.89 15.9 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.002 0.43 . . . . 0.0 110.282 -175.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' A' ' 19' ' ' THR . 29.4 m-85 -116.97 123.68 47.53 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.01 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.72 ' HB3' HG23 ' A' ' 19' ' ' THR . 13.8 pt20 -108.24 132.63 53.47 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.1 p -73.4 139.01 45.61 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 178.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.431 HD12 ' HA ' ' A' ' 44' ' ' TYR . 86.6 mt -76.96 11.84 1.61 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.633 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 17.1 tpt180 -105.9 -59.03 1.83 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.661 0.267 . . . . 0.0 111.303 176.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.691 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.0 m -99.63 -15.95 18.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.865 0.364 . . . . 0.0 110.343 -172.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 79.45 7.46 88.47 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.943 -176.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.691 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 91.2 mt -68.8 124.79 24.64 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.452 -0.203 . . . . 0.0 110.452 -178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 12' ' ' GLN . 0.2 OUTLIER -108.9 134.52 51.46 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.132 -175.868 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.415 ' O ' ' HA ' ' A' ' 10' ' ' VAL . 7.1 m-85 -125.0 148.5 48.42 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.005 -177.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' HG2' HG12 ' A' ' 10' ' ' VAL . 81.6 mtm180 -88.64 -5.59 58.05 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 30.6 p -130.36 151.25 51.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.745 0.307 . . . . 0.0 111.592 -177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.415 ' HE3' ' OH ' ' A' ' 11' ' ' TYR . 29.9 mmtp -60.33 -44.62 95.33 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.212 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -53.5 -47.05 70.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.888 -176.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -66.26 -34.46 78.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.16 -178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.465 HD13 ' C ' ' A' ' 26' ' ' LEU . 3.2 tm? -74.18 -56.37 4.98 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.386 0.612 . . . . 0.0 109.892 -177.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.437 ' O ' HG23 ' A' ' 31' ' ' VAL . 66.5 mt -52.66 -50.89 39.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.648 -1.16 . . . . 0.0 112.144 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 28' ' ' ARG . 29.0 ptt85 -62.6 -37.66 87.12 Favored 'General case' 0 N--CA 1.462 0.132 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.179 -175.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -72.43 -46.15 56.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.894 0.378 . . . . 0.0 110.248 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.649 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 1.5 mm? -53.7 -47.41 70.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.045 174.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.461 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 95.9 t -71.93 -44.19 67.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -80.23 -53.92 6.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -171.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.0 m -92.69 -38.99 11.53 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -171.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.649 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.86 -0.02 54.25 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.133 -178.582 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER 44.2 41.62 4.43 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.394 1.078 . . . . 0.0 112.408 -176.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.461 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 96.1 t -99.21 125.43 52.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.422 177.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -55.57 129.49 70.05 Favored Pre-proline 0 C--N 1.33 -0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 174.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HA ' HG23 ' A' ' 41' ' ' ILE . 10.1 Cg_endo -54.03 -18.69 13.93 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 123.708 2.939 . . . . 0.0 113.493 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.1 mp -82.03 -18.66 42.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.813 0.339 . . . . 0.0 111.021 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 12.8 m -110.38 -5.11 15.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.791 -175.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.432 HG23 ' HA ' ' A' ' 38' ' ' PRO . 23.0 pt -53.92 -28.48 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -173.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 32.4 t70 -56.47 -23.75 41.21 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -173.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -92.0 -20.83 20.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.831 -177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.431 ' HA ' HD12 ' A' ' 14' ' ' LEU . 54.0 m-85 -107.51 5.84 27.52 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.909 0.385 . . . . 0.0 111.952 -170.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 8.5 p90 -124.13 144.2 50.03 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.442 173.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -113.64 134.61 54.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.979 179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 p -96.56 133.03 41.55 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.952 0.406 . . . . 0.0 111.523 -178.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -121.93 137.69 54.69 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 174.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -105.42 127.47 53.0 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.306 0.574 . . . . 0.0 111.877 -174.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 20.1 t -114.15 121.82 67.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.344 176.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.7 m . . . . . 0 C--N 1.32 -0.712 0 O-C-N 122.295 -0.253 . . . . 0.0 110.461 -177.299 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 121.281 0.562 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -86.47 111.7 20.8 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.886 0.374 . . . . 0.0 110.708 -176.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -84.86 104.25 14.64 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 172.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.3 m -99.47 157.81 3.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.749 -175.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.428 ' HB3' HD22 ' A' ' 26' ' ' LEU . 65.3 m-85 -111.15 117.94 34.61 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.663 ' HB3' HG22 ' A' ' 19' ' ' THR . 3.1 pt20 -108.99 143.96 37.58 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.458 -0.497 . . . . 0.0 111.135 -175.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.72 128.33 33.87 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 107.289 -1.375 . . . . 0.0 107.289 169.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.405 HD21 ' CB ' ' A' ' 46' ' ' GLN . 89.0 mt -75.77 11.38 1.38 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.658 0.266 . . . . 0.0 111.716 -175.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.609 HH21 ' HA ' ' A' ' 44' ' ' TYR . 14.4 mmt180 -106.19 -55.66 2.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.882 0.372 . . . . 0.0 111.086 -173.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.757 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.9 m -99.51 -6.99 26.57 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 178.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 71.97 26.03 73.45 Favored Glycine 0 N--CA 1.447 -0.6 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.374 -177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.757 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 36.1 mt -86.11 125.62 33.61 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.377 -0.529 . . . . 0.0 111.063 -174.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.663 HG22 ' HB3' ' A' ' 12' ' ' GLN . 31.5 p -100.95 145.26 28.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.415 -177.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 15.0 m-85 -134.07 144.63 48.74 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -85.89 -8.45 58.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.717 0.294 . . . . 0.0 111.196 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 38.6 p -138.84 151.12 46.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.986 0.422 . . . . 0.0 110.32 177.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpp -70.46 -20.11 62.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.825 -177.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.7 mttm -57.87 -52.05 67.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.397 0.617 . . . . 0.0 110.385 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 57.5 mt-30 -65.68 -34.21 77.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.254 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.551 HD11 ' HB2' ' A' ' 45' ' ' TYR . 28.7 tp -63.93 -52.79 58.17 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.017 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 77.1 mt -62.22 -41.71 92.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.849 -176.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 96.3 mtt180 -60.43 -38.67 84.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.474 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.443 ' CE1' HD12 ' A' ' 18' ' ' LEU . 71.1 t60 -82.41 -45.89 14.23 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.209 -178.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.579 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -52.18 -49.27 64.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.786 176.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 94.7 t -72.68 -47.05 52.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.471 -177.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -70.77 -56.29 6.68 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -173.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.9 m -91.4 -38.73 12.4 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.613 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.1 OUTLIER -85.33 -2.52 58.17 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.433 -178.264 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 29.5 pttt 65.32 10.36 6.43 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.729 1.211 . . . . 0.0 111.777 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.613 HG23 ' HB2' ' A' ' 34' ' ' GLU . 53.2 t -72.48 130.12 35.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.589 0.709 . . . . 0.0 112.168 -171.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 32.3 t-20 -65.59 132.28 94.96 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 114.771 -1.104 . . . . 0.0 108.368 172.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 51.6 Cg_exo -53.59 -25.57 33.63 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 123.293 2.662 . . . . 0.0 113.16 -177.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.41 ' N ' HD22 ' A' ' 39' ' ' LEU . 3.2 mm? -89.45 11.49 19.17 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.132 178.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.3 t -129.21 3.96 5.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.5 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.45 ' O ' ' HD2' ' A' ' 45' ' ' TYR . 17.7 pt -60.03 -31.52 48.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -173.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -56.92 -22.35 36.99 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -176.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -92.05 -20.3 21.45 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.609 ' HA ' HH21 ' A' ' 15' ' ' ARG . 75.1 m-85 -111.68 -12.99 13.82 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -172.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.551 ' HB2' HD11 ' A' ' 26' ' ' LEU . 0.9 OUTLIER -110.9 155.15 23.06 Favored 'General case' 0 C--N 1.318 -0.783 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.586 176.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.405 ' CB ' HD21 ' A' ' 14' ' ' LEU . 7.0 tp60 -139.5 141.68 37.32 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.979 178.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.3 m -87.61 126.69 35.09 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 177.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -132.95 138.76 47.01 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 -175.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 15.1 m -107.54 128.59 54.65 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.049 0.452 . . . . 0.0 111.35 -176.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.3 m -116.98 153.27 18.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.859 -0.609 . . . . 0.0 109.716 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 41.8 m . . . . . 0 C--N 1.316 -0.85 0 CA-C-N 116.704 -0.226 . . . . 0.0 110.512 -175.799 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.708 0.289 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -78.67 169.44 18.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.452 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 42.5 mtm-85 -129.99 133.19 46.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.352 -178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.533 HG23 ' HB3' ' A' ' 48' ' ' PHE . 1.1 m -108.24 131.88 57.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.372 174.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -110.8 114.42 27.75 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.639 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 4.1 pt20 -107.49 133.86 51.36 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.566 -0.453 . . . . 0.0 111.069 -176.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 12.2 p -74.29 134.56 42.59 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 175.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.434 HD21 ' HB2' ' A' ' 46' ' ' GLN . 87.4 mt -75.22 10.57 1.5 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.062 0.458 . . . . 0.0 111.83 -176.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.598 ' HB3' ' OE2' ' A' ' 34' ' ' GLU . 1.7 tpm_? -100.91 -60.87 1.45 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.9 178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.777 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -99.5 -17.6 17.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.973 0.416 . . . . 0.0 110.064 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.88 13.76 80.74 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.84 -176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.777 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 89.5 mt -74.89 127.75 33.93 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.537 0.199 . . . . 0.0 111.537 -177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.9 p -94.56 144.03 25.93 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.844 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.554 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 29.6 m-85 -125.51 163.26 23.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.036 -0.529 . . . . 0.0 109.86 175.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -96.24 -39.39 9.69 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 123.541 0.526 . . . . 0.0 110.46 -177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.4 p -111.73 163.6 13.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.139 -176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.1 ttmt -70.91 -27.14 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.047 0.451 . . . . 0.0 110.137 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -67.48 -43.79 80.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.562 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.435 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 98.2 mt-30 -60.81 -33.68 73.39 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 120.983 0.421 . . . . 0.0 110.52 176.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.43 -52.64 30.49 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.508 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 70.6 mt -61.39 -43.25 96.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.342 -177.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -53.92 -49.19 69.19 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.9 0.381 . . . . 0.0 111.549 -179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.554 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 74.6 t60 -78.13 -46.45 20.62 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.279 -175.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.617 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.9 mm? -53.15 -52.47 58.64 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.642 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 92.1 t -70.48 -48.55 58.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -78.11 -55.92 4.89 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.2 m -84.35 -48.15 9.99 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -170.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.617 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.9 mm-40 -77.08 -11.67 59.84 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.233 -177.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.0 ptpp? 71.41 10.84 6.64 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.463 1.105 . . . . 0.0 111.192 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.642 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 73.2 t -78.09 131.47 34.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.209 -175.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -68.19 140.61 93.25 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.04 175.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.26 -23.19 29.06 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.728 2.952 . . . . 0.0 114.065 -176.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -86.97 -12.94 46.05 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.833 0.349 . . . . 0.0 110.909 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 m -110.73 -2.32 16.29 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.749 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.468 ' HA ' HG11 ' A' ' 36' ' ' VAL . 26.9 pt -53.83 -33.48 23.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.431 0 CA-C-O 120.72 0.295 . . . . 0.0 111.749 -177.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.604 ' HA ' ' CE2' ' A' ' 45' ' ' TYR . 18.8 t70 -54.95 -30.54 59.12 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.052 -176.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -82.28 -21.13 36.32 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.11 10.04 13.76 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -170.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' A' ' 42' ' ' ASP . 2.0 p90 -126.98 148.56 50.08 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.764 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.434 ' HB2' HD21 ' A' ' 14' ' ' LEU . 7.4 tp60 -123.57 130.38 52.59 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.361 174.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 36.7 p -101.12 141.29 34.22 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.934 0.397 . . . . 0.0 110.768 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.533 ' HB3' HG23 ' A' ' 10' ' ' VAL . 79.1 t80 -134.62 136.95 43.26 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 57.4 p -98.85 130.8 45.28 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.0 m -90.22 151.91 3.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.317 -0.825 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.748 -172.296 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 80.2 mtp . . . . . 0 N--CA 1.48 1.029 0 CA-C-O 120.301 0.096 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.54 ' HB2' ' CG1' ' A' ' 50' ' ' VAL . 8.1 mm-40 -112.51 116.32 30.06 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.861 -173.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 9' ' ' ARG . 35.1 mtm180 -95.91 100.69 12.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.079 0.466 . . . . 0.0 110.247 172.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.849 ' HB ' HG22 ' A' ' 19' ' ' THR . 0.3 OUTLIER -101.4 148.17 7.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.171 -178.332 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.552 ' HD1' ' HE1' ' A' ' 45' ' ' TYR . 40.5 m-85 -113.48 120.7 41.92 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.653 ' HB3' HG23 ' A' ' 19' ' ' THR . 3.8 pt20 -113.81 134.82 54.55 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.081 0.467 . . . . 0.0 110.862 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 5.3 p -79.32 135.06 36.63 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' A' ' 46' ' ' GLN . 94.3 mt -78.22 9.2 3.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.048 0.452 . . . . 0.0 111.794 -174.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.631 ' HB3' ' OE1' ' A' ' 34' ' ' GLU . 6.7 tpm_? -99.81 -60.85 1.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.759 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.687 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.2 m -99.01 -13.44 19.89 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.142 0.496 . . . . 0.0 110.277 -173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 76.94 10.32 86.26 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.656 -177.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.687 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 85.6 mt -70.22 129.67 39.98 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.608 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.849 HG22 ' HB ' ' A' ' 10' ' ' VAL . 0.2 OUTLIER -109.56 135.08 51.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.009 -177.014 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 -121.54 151.67 40.06 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.445 ' HE ' ' HB2' ' A' ' 21' ' ' ARG . 4.2 ttm180 -102.43 3.49 37.8 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.56 0.695 . . . . 0.0 109.544 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.3 p -135.8 137.02 41.16 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.093 179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -68.64 -31.15 70.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.845 -172.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -61.27 -45.35 94.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.881 0.372 . . . . 0.0 110.643 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.46 ' HA ' ' HG2' ' A' ' 28' ' ' ARG . 2.8 mp0 -66.42 -25.93 66.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.196 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 45' ' ' TYR . 19.8 tp -68.93 -51.87 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.063 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.4 HG23 ' HB3' ' A' ' 38' ' ' PRO . 71.4 mt -65.39 -44.0 94.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.69 -174.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.46 ' HG2' ' HA ' ' A' ' 25' ' ' GLN . 14.9 ptm180 -60.38 -32.96 71.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.146 -179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -81.44 -46.78 14.09 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.695 0.283 . . . . 0.0 110.606 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.667 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.9 mm? -51.23 -46.12 62.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.909 173.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 36' ' ' VAL . 81.3 t -70.89 -48.54 56.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.768 0.318 . . . . 0.0 111.515 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -71.33 -56.97 4.93 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 -173.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 17.0 m -90.03 -46.66 8.34 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -171.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.667 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -81.58 -11.6 59.08 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.778 -174.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.532 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 3.4 ptpp? 72.95 10.92 5.32 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.54 1.136 . . . . 0.0 111.84 177.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.43 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 57.6 t -87.31 141.92 13.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.185 0.517 . . . . 0.0 112.011 -171.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -74.27 140.54 76.37 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.25 173.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.42 ' HA ' HG23 ' A' ' 41' ' ' ILE . 18.8 Cg_endo -59.96 -17.16 42.88 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.867 2.378 . . . . 0.0 112.916 -178.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.8 mm? -87.12 -17.03 33.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.817 0.341 . . . . 0.0 110.63 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 16.2 m -115.82 19.38 15.21 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.06 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.42 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.5 pt -68.8 -16.13 20.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -49.93 -36.59 28.29 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -92.96 -21.51 19.75 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -174.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -108.6 -7.66 15.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.118 0.485 . . . . 0.0 111.397 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.552 ' HE1' ' HD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -122.94 144.93 48.91 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.209 176.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.518 ' HB2' HD21 ' A' ' 14' ' ' LEU . 29.4 tp60 -123.13 128.61 50.32 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.472 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 38.5 p -86.96 126.44 34.71 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.606 ' HB3' HG23 ' A' ' 10' ' ' VAL . 66.7 t80 -116.73 135.57 53.66 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-O 121.011 0.434 . . . . 0.0 109.902 -178.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 10.6 p -111.82 127.58 55.86 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.163 176.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.54 ' CG1' ' HB2' ' A' ' 8' ' ' GLU . 4.8 p -124.33 143.24 38.38 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 176.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 35.2 t . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.172 -172.345 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . 0.43 ' HB3' ' HE2' ' A' ' 7' ' ' MET . 49.7 ttp . . . . . 0 N--CA 1.475 0.82 0 CA-C-O 120.582 0.229 . . . . 0.0 111.016 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -92.33 162.27 14.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.121 0.486 . . . . 0.0 111.292 -176.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.6 mtp180 -121.89 128.44 51.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.473 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.0 m -109.22 155.74 10.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-O 120.857 0.36 . . . . 0.0 110.793 -176.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.477 ' O ' ' HA ' ' A' ' 19' ' ' THR . 15.3 m-85 -113.43 133.43 55.19 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 18' ' ' LEU . 15.9 pt20 -117.13 138.45 51.64 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.033 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 3.1 p -77.41 130.0 36.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.647 HD21 ' HB2' ' A' ' 46' ' ' GLN . 0.8 OUTLIER -70.14 1.25 4.92 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -174.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.469 ' HE ' ' CD ' ' A' ' 34' ' ' GLU . 6.4 mtm180 -99.37 -55.93 2.55 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.519 -0.473 . . . . 0.0 111.228 -176.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.832 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 1.8 m -99.36 -9.16 23.85 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.22 0.533 . . . . 0.0 109.693 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.01 28.35 68.72 Favored Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.626 -176.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.832 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 40.2 mt -85.22 125.6 32.99 Favored 'General case' 0 C--N 1.332 -0.187 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.501 -174.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' TYR . 11.8 p -94.3 145.86 24.44 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.048 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.58 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 16.9 m-85 -134.89 147.16 49.78 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -92.02 -12.58 32.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 -178.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -139.6 153.21 47.32 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 178.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -65.85 -28.44 68.98 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.79 -173.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 84.2 tttt -61.65 -43.88 98.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.608 -178.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.58 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 53.5 mt-30 -64.32 -36.39 83.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.208 0.528 . . . . 0.0 109.948 176.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 45' ' ' TYR . 27.7 tp -65.01 -52.66 54.85 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.447 -179.355 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.26 -43.02 98.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.969 -177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 49.2 mtp180 -54.18 -46.35 72.36 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 121.036 -0.265 . . . . 0.0 111.477 178.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.472 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 51.5 t60 -77.15 -46.55 23.05 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.588 0.232 . . . . 0.0 111.115 -176.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.618 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 3.2 mm? -54.16 -48.3 71.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 175.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 98.9 t -73.73 -45.42 50.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -80.34 -60.58 2.27 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.3 m -78.91 -41.7 28.95 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 121.061 -0.255 . . . . 0.0 111.503 -174.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.618 ' CG ' ' HA ' ' A' ' 30' ' ' LEU . 1.4 mm-40 -87.08 -7.29 58.21 Favored 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.35 -176.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' O ' ' A' ' 31' ' ' VAL . 57.8 pttt 49.73 33.22 5.92 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.649 1.18 . . . . 0.0 112.482 -177.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 85.4 t -102.66 123.82 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.47 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.547 179.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -61.65 144.74 92.56 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.819 178.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' O ' HG12 ' A' ' 41' ' ' ILE . 29.9 Cg_exo -61.3 -19.79 65.42 Favored 'Trans proline' 0 C--N 1.349 0.574 0 C-N-CA 123.384 2.723 . . . . 0.0 112.808 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 69.4 mt -86.64 -5.41 59.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.076 0.465 . . . . 0.0 110.556 177.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 m -120.24 -7.78 9.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.251 -176.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' ' HD1' ' A' ' 45' ' ' TYR . 35.6 pt -62.18 -18.99 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -47.18 -39.67 14.3 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -175.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -88.33 -22.0 24.08 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -175.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 57.8 m-85 -100.04 -4.42 29.94 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.578 -170.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.466 ' HB2' HD11 ' A' ' 26' ' ' LEU . 1.6 p90 -124.44 143.26 50.73 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.096 -0.642 . . . . 0.0 111.171 174.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.647 ' HB2' HD21 ' A' ' 14' ' ' LEU . 17.0 tt0 -120.9 145.59 47.51 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.216 -179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.5 m -116.81 134.73 54.43 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.621 0.248 . . . . 0.0 110.431 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -144.87 148.78 34.34 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 68.1 p -92.27 128.27 38.06 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.712 -177.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.665 HG22 ' H ' ' A' ' 51' ' ' SER . 10.2 p -108.3 -179.86 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.665 ' H ' HG22 ' A' ' 50' ' ' VAL . 19.5 m . . . . . 0 C--N 1.319 -0.722 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 21.9 ptp . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.291 0.567 . . . . 0.0 110.548 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -119.17 141.82 48.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.324 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.45 120.79 40.51 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.614 -0.266 . . . . 0.0 110.671 -175.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.537 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 34.6 m -102.75 131.27 51.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.292 0.567 . . . . 0.0 109.477 172.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -105.05 117.86 35.08 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 -177.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.896 ' HG2' HG22 ' A' ' 19' ' ' THR . 9.6 mt-30 -99.69 130.22 45.89 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.763 -177.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 4.8 p -84.43 122.68 29.31 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.2 mt -74.69 12.06 0.9 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.978 0.418 . . . . 0.0 111.784 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.589 ' HG3' ' HB3' ' A' ' 34' ' ' GLU . 13.4 mmm180 -105.79 -49.19 3.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.854 0.359 . . . . 0.0 110.537 -174.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.814 ' HB2' ' HG ' ' A' ' 18' ' ' LEU . 2.8 m -103.99 -15.76 15.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.375 0.607 . . . . 0.0 109.471 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 80.62 23.77 59.65 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.577 -175.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.814 ' HG ' ' HB2' ' A' ' 16' ' ' CYS . 72.1 mt -85.71 136.82 33.19 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.961 -0.296 . . . . 0.0 111.626 -173.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.896 HG22 ' HG2' ' A' ' 12' ' ' GLN . 17.1 p -103.37 136.26 43.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.928 178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' GLN . 44.9 m-85 -122.53 144.34 49.15 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 176.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 65.1 mtp180 -88.64 -22.89 23.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.106 0.479 . . . . 0.0 110.636 -177.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 141.79 51.82 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.762 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -69.19 -16.8 63.7 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.745 -0.662 . . . . 0.0 111.868 -171.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 61.8 tttp -66.44 -35.84 81.31 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.821 0.343 . . . . 0.0 110.15 175.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.604 ' HB2' ' HB3' ' A' ' 20' ' ' PHE . 40.3 mt-30 -67.52 -27.2 66.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.465 0.65 . . . . 0.0 109.45 176.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.488 HD21 ' CG ' ' A' ' 45' ' ' TYR . 14.6 tp -77.27 -52.66 8.83 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.703 -176.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.8 mt -63.63 -44.32 98.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.13 -175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -58.95 -35.79 73.71 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.967 0.413 . . . . 0.0 110.862 179.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.538 ' CD2' ' HZ ' ' A' ' 20' ' ' PHE . 68.9 t60 -84.22 -45.59 12.75 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.082 -175.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.612 ' HA ' ' CG ' ' A' ' 34' ' ' GLU . 2.6 mm? -51.55 -48.27 63.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.651 174.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 78.5 t -73.18 -44.02 56.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 120.804 0.335 . . . . 0.0 111.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -77.13 -50.22 13.49 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -173.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.4 m -90.35 -51.67 5.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -171.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.678 ' HB2' HG23 ' A' ' 36' ' ' VAL . 0.0 OUTLIER -85.22 3.15 40.67 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 121.306 -0.158 . . . . 0.0 110.822 -175.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 1.6 pttm 51.15 27.7 3.58 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.482 1.113 . . . . 0.0 112.284 -178.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.678 HG23 ' HB2' ' A' ' 34' ' ' GLU . 75.0 t -82.08 133.9 28.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.082 0.468 . . . . 0.0 110.72 -177.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.411 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 27.7 t-20 -78.52 137.12 59.38 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.464 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.499 ' HA ' HG23 ' A' ' 41' ' ' ILE . 73.1 Cg_exo -52.66 -20.96 13.48 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.685 2.924 . . . . 0.0 114.3 -176.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD13 ' HA ' ' A' ' 39' ' ' LEU . 3.7 mm? -86.94 -7.75 57.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.972 0.415 . . . . 0.0 111.312 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.5 m -125.11 10.73 8.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.335 -177.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.499 HG23 ' HA ' ' A' ' 38' ' ' PRO . 11.4 pt -56.6 -42.32 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -61.5 -21.09 63.9 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.766 0.317 . . . . 0.0 111.746 -173.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.89 -21.63 50.96 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.696 -179.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -118.34 1.32 11.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.629 0.252 . . . . 0.0 111.379 -174.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TYR . . . . . 0.488 ' CG ' HD21 ' A' ' 26' ' ' LEU . 1.2 p90 -133.72 150.36 51.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.962 0.41 . . . . 0.0 110.827 173.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -128.3 130.34 47.67 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.182 175.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.413 ' OG ' ' HE1' ' A' ' 45' ' ' TYR . 17.3 m -88.88 126.34 35.33 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.07 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -122.44 136.46 54.9 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 t -96.4 127.97 42.89 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.02 0.438 . . . . 0.0 110.616 -179.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.87 161.69 14.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.2 m . . . . . 0 C--N 1.319 -0.755 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.828 -176.665 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_