data_1mr4_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 1mr4 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.436 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.351 0.596 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.515 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.7 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.458 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.682 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.682 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.669 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.673 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.549 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.722 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.542 HG22 ' O ' ' A' ' 44' ' ' THR . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.557 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.673 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.711 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.454 HG23 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.454 ' HG ' HG23 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.7 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 30' ' ' THR . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 121.418 0.627 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.514 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.614 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.473 HG21 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.614 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.646 HG23 ' HG1' ' A' ' 16' ' ' THR . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.646 ' HG1' HG23 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HG3' ' HE3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.892 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.74 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 44' ' ' THR . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.465 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.409 ' H ' ' C ' ' A' ' 35' ' ' SER . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.473 ' HD2' HG21 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.74 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.663 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.888 ' HZ2' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.586 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.43 ' HG1' ' HG3' ' A' ' 27' ' ' GLU . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.636 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.748 HD12 ' H ' ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.636 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.577 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.577 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.471 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.866 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.463 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.484 ' OE1' ' HA ' ' A' ' 27' ' ' GLU . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.816 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.41 ' CG ' ' H ' ' A' ' 32' ' ' GLY . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.598 ' HB2' HD22 ' A' ' 42' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.424 ' O ' HG21 ' A' ' 37' ' ' ILE . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.424 HG21 ' O ' ' A' ' 36' ' ' LYS . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' HG3' ' SG ' ' A' ' 14' ' ' CYS . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.586 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.888 ' HG ' ' HZ2' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.663 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.816 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.62 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.436 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 23.0 tp10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.943 0.878 . . . . 0.0 112.188 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.499 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.543 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.554 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 13' ' ' ILE . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.712 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.52 ' HZ3' ' CG ' ' A' ' 31' ' ' ASP . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.712 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.507 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.473 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.678 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' CD ' ' HZ3' ' A' ' 28' ' ' LYS . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.493 ' HZ3' ' CD ' ' A' ' 27' ' ' GLU . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.643 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.52 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.678 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.737 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.737 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.643 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 44' ' ' THR . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HD2' HD21 ' A' ' 42' ' ' LEU . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.504 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.504 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.521 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.728 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 1.038 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.728 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 1.038 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.441 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.458 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.537 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.512 HG22 ' HG3' ' A' ' 46' ' ' PRO . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.458 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.426 HD11 HG22 ' A' ' 37' ' ' ILE . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.521 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.417 HD21 ' HD2' ' A' ' 4' ' ' LYS . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HG22 ' A' ' 30' ' ' THR . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.516 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.632 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.548 ' H ' HD13 ' A' ' 13' ' ' ILE . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.548 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.684 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.433 ' O ' HG13 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 22' ' ' LYS . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.405 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.403 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.782 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.405 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.538 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.538 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.429 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 42' ' ' LEU . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.572 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.782 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 121.579 0.704 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.575 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.454 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.451 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.456 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.552 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.44 HG22 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.695 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.695 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.557 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.71 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.402 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.625 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HB2' HG22 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.71 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 121.456 0.646 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.513 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.471 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.599 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.628 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.473 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.679 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.516 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.708 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.721 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.432 HG21 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.708 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.419 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.419 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.542 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.721 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.597 ' CD ' ' HZ1' ' A' ' 4' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.672 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HZ1' ' CD ' ' A' ' 2' ' ' GLU . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.658 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.584 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.584 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.542 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.454 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.567 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.456 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.462 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.584 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 21' ' ' ARG . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.584 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.549 ' HE1' HG21 ' A' ' 44' ' ' THR . 36.9 p-80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.491 ' HB2' HD21 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HZ3' ' HA ' ' A' ' 36' ' ' LYS . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' A' ' 35' ' ' SER . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.549 HG21 ' HE1' ' A' ' 33' ' ' HIS . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.728 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.728 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.412 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.56 0.695 . . . . 0.0 111.584 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.592 ' O ' ' HA ' ' A' ' 44' ' ' THR . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.496 ' HD3' HG21 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.601 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.518 HD11 ' H ' ' A' ' 13' ' ' ILE . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.601 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.406 HD11 HG23 ' A' ' 15' ' ' ILE . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.597 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HZ3' ' HG3' ' A' ' 21' ' ' ARG . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.597 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.553 ' HG3' ' HZ3' ' A' ' 17' ' ' LYS . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.614 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.584 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.614 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.417 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.46 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.473 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.592 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.601 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.601 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.419 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 . . . . . 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.548 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.553 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.637 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.419 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.425 ' CG2' ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.65 HG23 ' HG1' ' A' ' 16' ' ' THR . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.65 ' HG1' HG23 ' A' ' 15' ' ' ILE . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.598 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.608 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.417 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.6 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.6 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.58 ' HE2' HD23 ' A' ' 42' ' ' LEU . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.642 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.425 ' HG2' ' CG2' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.642 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.553 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.501 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.493 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.52 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 13' ' ' ILE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.421 ' H ' ' C ' ' A' ' 11' ' ' PRO . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.408 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.702 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.707 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.707 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.606 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.493 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.493 ' HD2' ' C ' ' A' ' 27' ' ' GLU . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.753 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 44' ' ' THR . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.477 HG22 HD13 ' A' ' 37' ' ' ILE . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.408 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.497 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.753 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.516 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.454 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.566 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.512 HG21 ' HD2' ' A' ' 39' ' ' ARG . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.566 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.663 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.919 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.692 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.919 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' HB3' ' OG ' ' A' ' 7' ' ' SER . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.459 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.599 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.907 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.455 ' HB ' HD23 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.512 ' HD2' HG21 ' A' ' 13' ' ' ILE . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.491 HH11 ' HG3' ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.516 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.907 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.895 0.379 . . . . 0.0 111.619 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.477 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.793 ' H ' HD13 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.603 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.632 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.723 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.723 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.442 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.819 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.788 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.615 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 ' O ' ' A' ' 44' ' ' THR . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.657 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.788 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.432 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.4 ' H ' ' C ' ' A' ' 35' ' ' SER . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.432 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.657 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 . . . . . 0 C--O 1.236 0.377 0 CA-C-O 121.491 0.662 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.547 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.491 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HE3' ' HD2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.738 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.738 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.579 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.835 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.473 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.562 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.581 ' OE2' HG23 ' A' ' 44' ' ' THR . 3.5 tm-20 . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.514 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HZ1' ' CD ' ' A' ' 2' ' ' GLU . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.561 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.708 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.476 HG23 ' N ' ' A' ' 14' ' ' CYS . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.708 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.719 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.719 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.668 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HG2' HH11 ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.868 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.794 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.495 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.583 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.788 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.489 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.794 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.422 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.543 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.561 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.581 HG23 ' OE2' ' A' ' 2' ' ' GLU . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.788 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 121.566 0.698 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.653 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.471 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.655 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.416 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 13' ' ' ILE . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.702 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.663 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.612 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.53 ' OE1' ' HA ' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.583 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.378 0.609 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.535 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.674 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.613 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.439 HG21 ' N ' ' A' ' 14' ' ' CYS . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.635 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.484 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.687 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.687 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.844 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.459 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.836 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.464 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.46 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.46 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.674 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.836 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.76 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.409 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.473 HG23 ' HD2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.726 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.56 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.892 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.593 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.609 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.609 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.609 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.56 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.473 ' HD2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.609 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.76 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.41 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 121.418 0.628 . . . . 0.0 111.781 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.686 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 5' ' ' THR . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.627 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.571 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.629 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.877 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.668 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.668 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.877 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.502 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.628 ' HZ1' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 37' ' ' ILE . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 36' ' ' LYS . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.404 ' CD1' ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . 0.4 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.643 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.643 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.451 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.365 0.126 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.436 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 66.3 53.9 0.98 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.886 0.741 . . . . 0.0 111.559 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.515 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.7 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.458 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.682 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.682 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.669 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.673 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.549 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.722 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.542 HG22 ' O ' ' A' ' 44' ' ' THR . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.557 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.673 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.711 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.454 HG23 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.454 ' HG ' HG23 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.711 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.7 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 30' ' ' THR . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.451 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 64.28 54.51 1.57 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.968 0.793 . . . . 0.0 112.411 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.514 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.575 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.614 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.473 HG21 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.614 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.646 HG23 ' HG1' ' A' ' 16' ' ' THR . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.646 ' HG1' HG23 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.589 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.453 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.477 ' HG3' ' HE3' ' A' ' 17' ' ' LYS . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.892 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.74 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 44' ' ' THR . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.465 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.409 ' H ' ' C ' ' A' ' 35' ' ' SER . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.52 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.473 ' HD2' HG21 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.74 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.635 ' HG2' ' HA ' ' A' ' 46' ' ' PRO . 4.4 ttp180 . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.663 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 68.49 61.47 0.37 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.565 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.888 ' HZ2' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.547 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.586 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.43 ' HG1' ' HG3' ' A' ' 27' ' ' GLU . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.636 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.748 HD12 ' H ' ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.636 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.577 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.535 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.577 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.471 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.866 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.463 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.484 ' OE1' ' HA ' ' A' ' 27' ' ' GLU . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.816 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.41 ' CG ' ' H ' ' A' ' 32' ' ' GLY . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.463 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.598 ' HB2' HD22 ' A' ' 42' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.424 ' O ' HG21 ' A' ' 37' ' ' ILE . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.424 HG21 ' O ' ' A' ' 36' ' ' LYS . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.446 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' HG3' ' SG ' ' A' ' 14' ' ' CYS . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.586 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.888 ' HG ' ' HZ2' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.663 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.816 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.635 ' HA ' ' HG2' ' A' ' 1' ' ' ARG . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.551 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.661 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 8.4 ttp85 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 118.297 -0.859 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.644 ' HB2' ' O ' ' A' ' 1' ' ' ARG . 23.0 tp10 158.71 35.52 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 O-C-N 124.467 1.104 . . . . 0.0 112.188 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.534 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.499 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.543 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.554 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.755 HD12 ' H ' ' A' ' 13' ' ' ILE . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.712 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.52 ' HZ3' ' CG ' ' A' ' 31' ' ' ASP . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.712 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.507 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.473 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.678 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' CD ' ' HZ3' ' A' ' 28' ' ' LYS . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.493 ' HZ3' ' CD ' ' A' ' 27' ' ' GLU . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.643 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.52 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.678 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.737 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.56 ' HB2' HG22 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.543 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.737 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.554 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.643 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.661 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.43 55.88 1.33 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 44' ' ' THR . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.417 ' HD2' HD21 ' A' ' 42' ' ' LEU . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.504 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.504 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.521 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.728 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 1.038 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.728 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 1.038 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.442 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.441 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.458 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.537 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.512 HG22 ' HG3' ' A' ' 46' ' ' PRO . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.458 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.417 ' HB2' HD23 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.426 HD11 HG22 ' A' ' 37' ' ' ILE . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.521 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.417 HD21 ' HD2' ' A' ' 4' ' ' LYS . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.538 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HG22 ' A' ' 30' ' ' THR . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.621 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 3.6 ptm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.558 ' HB2' ' NH1' ' A' ' 1' ' ' ARG . 3.6 tp10 63.52 50.07 2.92 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.516 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.632 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.548 ' H ' HD13 ' A' ' 13' ' ' ILE . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.548 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.414 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.684 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.684 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.433 ' O ' HG13 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.406 ' HE3' ' HB2' ' A' ' 22' ' ' LYS . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.405 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.403 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.403 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.782 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.405 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.538 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.538 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.429 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.436 HD13 ' HA ' ' A' ' 42' ' ' LEU . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.572 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.782 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.621 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.528 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.7 mtp180 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.196 0.073 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 17.5 mp0 61.59 53.41 3.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 124.064 0.852 . . . . 0.0 111.864 178.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.575 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.454 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.451 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.456 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.552 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.456 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.44 HG22 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.552 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.695 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.695 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.44 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.572 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.557 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.71 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.402 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.625 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.44 ' HB2' HG22 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.71 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 67.4 55.43 0.65 Allowed 'General case' 0 CA--C 1.53 0.185 0 O-C-N 123.805 0.691 . . . . 0.0 111.12 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.549 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.542 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.513 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.599 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.628 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.473 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.679 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.679 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.516 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.708 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.721 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.432 HG21 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.708 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.419 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.419 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.471 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.599 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.542 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.721 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.651 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 24.2 ptt180 . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.597 ' CD ' ' HZ1' ' A' ' 4' ' ' LYS . 0.0 OUTLIER 172.65 34.32 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.672 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.597 ' HZ1' ' CD ' ' A' ' 2' ' ' GLU . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.658 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.584 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.584 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.542 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.454 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.567 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.567 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.456 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.462 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.584 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 21' ' ' ARG . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.584 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.549 ' HE1' HG21 ' A' ' 44' ' ' THR . 36.9 p-80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.491 ' HB2' HD21 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HZ3' ' HA ' ' A' ' 36' ' ' LYS . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.491 HD21 ' HB2' ' A' ' 35' ' ' SER . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.549 HG21 ' HE1' ' A' ' 33' ' ' HIS . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.728 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.728 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.589 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.5 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 17.2 ptm180 . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.412 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER 63.11 50.21 3.14 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 123.817 0.698 . . . . 0.0 111.584 179.713 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.592 ' O ' ' HA ' ' A' ' 44' ' ' THR . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' HD3' HG21 ' A' ' 44' ' ' THR . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.504 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.601 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.518 HD11 ' H ' ' A' ' 13' ' ' ILE . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.601 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.406 HD11 HG23 ' A' ' 15' ' ' ILE . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.597 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.553 ' HZ3' ' HG3' ' A' ' 21' ' ' ARG . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.597 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.563 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.553 ' HG3' ' HZ3' ' A' ' 17' ' ' LYS . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.614 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.552 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.413 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.584 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.614 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.417 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.558 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.46 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.473 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.592 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.601 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.601 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 8.3 mtp180 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.419 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 56.28 48.95 16.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.548 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.553 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.637 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.419 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.425 ' CG2' ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.65 HG23 ' HG1' ' A' ' 16' ' ' THR . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.65 ' HG1' HG23 ' A' ' 15' ' ' ILE . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.598 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.608 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.608 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.437 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.457 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.417 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.6 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.437 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.6 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.58 ' HE2' HD23 ' A' ' 42' ' ' LEU . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.642 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.425 ' HG2' ' CG2' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.642 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.553 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.418 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.498 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 51.4 ttm-85 . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.479 ' OE1' ' HG2' ' A' ' 1' ' ' ARG . 2.9 mt-10 64.57 56.24 1.23 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.501 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.493 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.52 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 13' ' ' ILE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.421 ' H ' ' C ' ' A' ' 11' ' ' PRO . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.408 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.702 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.707 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.707 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.417 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.419 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.606 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.493 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.493 ' HD2' ' C ' ' A' ' 27' ' ' GLU . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.753 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.486 HG22 ' O ' ' A' ' 44' ' ' THR . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.477 HG22 HD13 ' A' ' 37' ' ' ILE . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.408 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.497 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.753 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.498 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.467 ' HG3' ' HA ' ' A' ' 46' ' ' PRO . 1.4 ttm180 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 66.66 59.61 0.59 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.516 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.454 ' OG ' ' HB3' ' A' ' 23' ' ' ALA . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.566 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.512 HG21 ' HD2' ' A' ' 39' ' ' ARG . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.566 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.663 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.919 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.692 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.692 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.919 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' HB3' ' OG ' ' A' ' 7' ' ' SER . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.459 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.498 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.599 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.907 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.455 ' HB ' HD23 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.512 ' HD2' HG21 ' A' ' 13' ' ' ILE . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.491 HH11 ' HG3' ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.516 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.417 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.487 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.599 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.907 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 110.675 -0.12 . . . . 0.0 110.675 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 70.56 54.69 0.28 Allowed 'General case' 0 C--N 1.341 0.2 0 O-C-N 123.769 0.668 . . . . 0.0 111.619 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.477 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.531 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.793 ' H ' HD13 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.603 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.632 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.723 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.723 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.442 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.819 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.788 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.615 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.474 HG21 ' O ' ' A' ' 44' ' ' THR . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.657 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.788 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.432 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.4 ' H ' ' C ' ' A' ' 35' ' ' SER . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.432 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.657 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.615 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.506 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.9 mtp180 . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.506 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 15.4 mp0 61.58 52.9 3.47 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 123.844 0.715 . . . . 0.0 111.61 178.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.547 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.446 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.491 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.446 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HE3' ' HD2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.738 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.738 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.579 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.835 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.579 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.562 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.489 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.473 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.473 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.562 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.581 ' OE2' HG23 ' A' ' 44' ' ' THR . 3.5 tm-20 72.09 49.79 0.23 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.514 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.511 ' HZ1' ' CD ' ' A' ' 2' ' ' GLU . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.561 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.708 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.476 HG23 ' N ' ' A' ' 14' ' ' CYS . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.708 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.719 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.719 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.668 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.575 ' HG2' HH11 ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.868 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.794 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.495 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.583 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.788 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.489 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.794 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.422 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.543 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.561 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.581 HG23 ' OE2' ' A' ' 2' ' ' GLU . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.788 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.585 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 16.4 ptm180 . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 66.5 51.0 1.18 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 124.027 0.829 . . . . 0.0 111.264 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.653 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.471 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.655 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.416 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 13' ' ' ILE . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.702 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.512 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.702 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.663 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.441 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.417 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.612 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.53 ' OE1' ' HA ' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.511 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.612 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.655 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.653 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.585 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.574 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 12.6 ptm180 . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 69.04 52.21 0.51 Allowed 'General case' 0 C--O 1.233 0.197 0 O-C-N 123.882 0.738 . . . . 0.0 110.382 -178.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.535 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.674 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.521 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.613 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.439 HG21 ' N ' ' A' ' 14' ' ' CYS . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.613 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.635 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.484 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.687 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.687 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.844 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.459 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.836 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.464 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.46 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.46 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.674 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.521 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.836 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.574 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.447 ' H3 ' ' CD ' ' A' ' 2' ' ' GLU . 27.8 ttm180 . . . . . 0 N--CA 1.486 1.333 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.76 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 -120.33 17.44 12.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.409 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.473 HG23 ' HD2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.726 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.726 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.699 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.56 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.892 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.593 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.609 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.609 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.609 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.56 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.593 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.473 ' HD2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.609 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.76 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.528 ' HD2' ' O ' ' A' ' 47' ' ' CYS . 6.6 mpt_? . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.41 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 66.02 55.71 0.9 Allowed 'General case' 0 CA--C 1.531 0.221 0 O-C-N 123.782 0.676 . . . . 0.0 111.781 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.686 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 5' ' ' THR . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.627 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.571 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.571 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.629 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.877 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.668 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.668 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.877 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.502 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.628 ' HZ1' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 37' ' ' ILE . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.475 HG22 ' O ' ' A' ' 36' ' ' LYS . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.404 ' CD1' ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . 0.4 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.686 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.643 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.643 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.351 0.596 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HD3' HG22 ' A' ' 44' ' ' THR . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.531 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.704 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.698 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.567 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.69 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.569 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.729 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.567 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.69 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.718 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.406 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.64 HG22 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.64 ' HG ' HG22 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.718 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.591 HG22 ' HD3' ' A' ' 4' ' ' LYS . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 121.418 0.627 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.589 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.616 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.445 HG23 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.599 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.599 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.726 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.901 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.726 HD11 HH11 ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.743 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.482 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' HG23 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.589 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.743 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.668 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.886 ' HD3' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.6 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.613 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.646 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.545 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.856 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.477 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.525 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.525 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.837 ' HA ' ' HB2' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' HD3' ' A' ' 46' ' ' PRO . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.477 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.453 ' HG2' HG23 ' A' ' 13' ' ' ILE . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.6 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.886 ' HG ' ' HD3' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.668 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.454 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 23.0 tp10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.943 0.878 . . . . 0.0 112.188 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.574 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.714 HG23 ' HB2' ' A' ' 39' ' ' ARG . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.732 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.524 ' HD3' ' HB2' ' A' ' 21' ' ' ARG . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.732 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.664 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HB2' ' HD3' ' A' ' 17' ' ' LYS . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.689 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 22' ' ' LYS . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.504 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.652 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.438 ' CG ' ' HZ1' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.689 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.714 ' HB2' HG23 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.549 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.756 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.652 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.592 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.514 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.747 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 1.03 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.747 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 1.03 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.438 ' HG2' ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.471 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.769 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.471 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.506 ' HB2' HD22 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD22 ' HB2' ' A' ' 35' ' ' SER . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.769 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.56 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.432 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.657 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.657 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.518 HH11 HD11 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.419 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.518 HD11 HH11 ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.785 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.419 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.554 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 35' ' ' SER . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.581 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.785 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 121.579 0.704 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.46 HG23 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.666 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.642 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.642 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.526 ' HB2' HD13 ' A' ' 42' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.46 ' HB2' HG23 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 35' ' ' SER . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.487 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.715 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 121.456 0.646 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.591 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.769 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.617 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.629 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.716 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.72 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.716 HD11 HH11 ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.725 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.72 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.769 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.725 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.7 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.549 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.666 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.59 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.546 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.562 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.595 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 22' ' ' LYS . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.595 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD22 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 42' ' ' LEU . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.731 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.731 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.56 0.695 . . . . 0.0 111.584 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.627 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.591 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.614 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.619 HH11 HD11 ' A' ' 25' ' ' ILE . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.619 HD11 HH11 ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.591 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.568 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.528 ' HG2' HG23 ' A' ' 13' ' ' ILE . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.489 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.627 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.604 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.435 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 . . . . . 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.565 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.644 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.881 HG23 ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.609 ' HD3' ' HB3' ' A' ' 17' ' ' LYS . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.41 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.61 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.665 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.881 ' HG2' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.624 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.516 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.534 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.673 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' CE ' ' A' ' 28' ' ' LYS . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.522 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 10' ' ' PHE . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.678 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.92 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.678 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.654 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.92 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.93 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.462 ' HB ' HD22 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.462 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.533 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.499 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.93 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.895 0.379 . . . . 0.0 111.619 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.672 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.645 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.698 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.833 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.803 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.803 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 . . . . . 0 C--O 1.236 0.377 0 CA-C-O 121.491 0.662 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.436 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.508 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.714 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.578 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.507 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 40' ' ' ARG . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.415 ' HD3' ' HB3' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.606 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.524 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.65 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.713 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.713 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.737 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.737 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.591 HH11 ' HG2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.86 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' OG ' ' A' ' 7' ' ' SER . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.809 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.568 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.794 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.809 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.513 ' H ' ' HD3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.544 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.567 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.65 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.794 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 121.566 0.698 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.475 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.653 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.58 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.58 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.677 HH11 HD11 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.426 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.63 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.677 HD11 HH11 ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.514 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.404 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.588 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.378 0.609 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.546 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.666 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.652 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.661 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.661 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.851 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.479 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.414 ' H ' ' HD1' ' A' ' 29' ' ' PHE . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.844 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.459 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.459 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.495 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.844 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.778 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.415 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.742 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.742 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.573 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.605 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.625 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.621 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.573 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.605 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.551 ' HB2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.444 ' HG3' HH11 ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.618 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.778 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.434 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 121.418 0.628 . . . . 0.0 111.781 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.653 ' HD3' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.637 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.644 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.889 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.646 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.889 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HZ2' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.543 ' HB3' HD23 ' A' ' 42' ' ' LEU . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.653 HD12 ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' CYS . . . . . 0.42 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.702 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.65 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.365 0.126 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 66.3 53.9 0.98 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.886 0.741 . . . . 0.0 111.559 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HD3' HG22 ' A' ' 44' ' ' THR . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.531 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.704 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.698 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.567 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.69 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.569 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.729 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.567 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.69 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.718 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.406 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.64 HG22 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.64 ' HG ' HG22 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.718 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.591 HG22 ' HD3' ' A' ' 4' ' ' LYS . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.454 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 64.28 54.51 1.57 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.968 0.793 . . . . 0.0 112.411 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.589 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.616 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.445 HG23 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.599 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.599 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.726 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.901 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.726 HD11 HH11 ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.743 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.482 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' HG23 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.589 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.743 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.689 ' HG2' ' HA ' ' A' ' 46' ' ' PRO . 4.4 ttp180 . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.668 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 68.49 61.47 0.37 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.886 ' HD3' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.6 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.613 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.646 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.545 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.856 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.477 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.525 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.525 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.837 ' HA ' ' HB2' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' HD3' ' A' ' 46' ' ' PRO . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.477 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.453 ' HG2' HG23 ' A' ' 13' ' ' ILE . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.6 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.886 ' HG ' ' HD3' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.668 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HA ' ' HG2' ' A' ' 1' ' ' ARG . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.559 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.714 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 8.4 ttp85 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 118.297 -0.859 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.654 ' HB2' ' O ' ' A' ' 1' ' ' ARG . 23.0 tp10 158.71 35.52 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 O-C-N 124.467 1.104 . . . . 0.0 112.188 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.574 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.714 HG23 ' HB2' ' A' ' 39' ' ' ARG . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.732 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.524 ' HD3' ' HB2' ' A' ' 21' ' ' ARG . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.732 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.664 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HB2' ' HD3' ' A' ' 17' ' ' LYS . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.689 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 22' ' ' LYS . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.504 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.652 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.438 ' CG ' ' HZ1' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.689 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.714 ' HB2' HG23 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.756 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.714 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.43 55.88 1.33 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.592 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.514 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.747 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 1.03 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.747 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 1.03 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.438 ' HG2' ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.471 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.769 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.471 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.506 ' HB2' HD22 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD22 ' HB2' ' A' ' 35' ' ' SER . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.769 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 3.6 ptm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.559 ' HB2' ' NH1' ' A' ' 1' ' ' ARG . 3.6 tp10 63.52 50.07 2.92 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.56 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.432 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.657 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.657 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.518 HH11 HD11 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.419 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.518 HD11 HH11 ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.785 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.419 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.554 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 35' ' ' SER . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.581 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.785 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.719 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.528 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.7 mtp180 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.196 0.073 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 17.5 mp0 61.59 53.41 3.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 124.064 0.852 . . . . 0.0 111.864 178.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.46 HG23 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.666 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.642 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.642 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.526 ' HB2' HD13 ' A' ' 42' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.46 ' HB2' HG23 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 35' ' ' SER . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.487 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.715 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 67.4 55.43 0.65 Allowed 'General case' 0 CA--C 1.53 0.185 0 O-C-N 123.805 0.691 . . . . 0.0 111.12 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.591 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.769 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.617 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.629 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.716 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.72 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.716 HD11 HH11 ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.725 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.72 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.769 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.725 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.72 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 24.2 ptt180 . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 172.65 34.32 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.7 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.549 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.666 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.59 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.546 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.562 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.595 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 22' ' ' LYS . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.595 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD22 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 42' ' ' LEU . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.731 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.731 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.584 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.498 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 17.2 ptm180 . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER 63.11 50.21 3.14 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 123.817 0.698 . . . . 0.0 111.584 179.713 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.627 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.591 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.614 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.619 HH11 HD11 ' A' ' 25' ' ' ILE . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.619 HD11 HH11 ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.591 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.568 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' HG2' HG23 ' A' ' 13' ' ' ILE . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.489 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.627 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.604 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 8.3 mtp180 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.435 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 56.28 48.95 16.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.565 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.644 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.881 HG23 ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.609 ' HD3' ' HB3' ' A' ' 17' ' ' LYS . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.61 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.665 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.881 ' HG2' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.624 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.53 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 51.4 ttm-85 . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' OE1' ' HG2' ' A' ' 1' ' ' ARG . 2.9 mt-10 64.57 56.24 1.23 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.516 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.534 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.673 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' CE ' ' A' ' 28' ' ' LYS . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.522 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.53 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.507 ' HG3' ' HA ' ' A' ' 46' ' ' PRO . 1.4 ttm180 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 66.66 59.61 0.59 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 10' ' ' PHE . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.678 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.92 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.678 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.654 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.92 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.93 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.462 ' HB ' HD22 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.462 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.533 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.499 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.93 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 110.675 -0.12 . . . . 0.0 110.675 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 70.56 54.69 0.28 Allowed 'General case' 0 C--N 1.341 0.2 0 O-C-N 123.769 0.668 . . . . 0.0 111.619 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.672 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.645 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.698 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.833 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.803 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.803 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.504 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.9 mtp180 . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.504 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 15.4 mp0 61.58 52.9 3.47 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 123.844 0.715 . . . . 0.0 111.61 178.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.436 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.508 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.714 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.578 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.507 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 40' ' ' ARG . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.415 ' HD3' ' HB3' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.606 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 72.09 49.79 0.23 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.524 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.65 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.713 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.713 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.737 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.737 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.591 HH11 ' HG2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.86 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' OG ' ' A' ' 7' ' ' SER . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.809 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.568 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.794 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.809 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.513 ' H ' ' HD3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.544 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.567 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.65 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.794 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.585 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 16.4 ptm180 . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 66.5 51.0 1.18 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 124.027 0.829 . . . . 0.0 111.264 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.475 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.653 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.58 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.58 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.677 HH11 HD11 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.63 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.677 HD11 HH11 ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.514 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.404 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.588 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.576 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 12.6 ptm180 . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.404 ' CD ' ' HE ' ' A' ' 1' ' ' ARG . 11.8 mp0 69.04 52.21 0.51 Allowed 'General case' 0 C--O 1.233 0.197 0 O-C-N 123.882 0.738 . . . . 0.0 110.382 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.546 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.666 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.0 m-20 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.652 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.661 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.661 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.851 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.479 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.414 ' H ' ' HD1' ' A' ' 29' ' ' PHE . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.844 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.459 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.459 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.495 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.844 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.576 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 . . . . . 0 N--CA 1.486 1.333 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.778 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 -120.33 17.44 12.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.415 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.742 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.742 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.573 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.605 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.625 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.621 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.573 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.605 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.551 ' HB2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.444 ' HG3' HH11 ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.618 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.778 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.551 ' HD2' ' O ' ' A' ' 47' ' ' CYS . 6.6 mpt_? . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.434 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 66.02 55.71 0.9 Allowed 'General case' 0 CA--C 1.531 0.221 0 O-C-N 123.782 0.676 . . . . 0.0 111.781 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.653 ' HD3' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.637 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.644 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.889 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.646 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.889 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HZ2' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.543 ' HB3' HD23 ' A' ' 42' ' ' LEU . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.653 HD12 ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . 0.42 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.702 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.65 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.351 0.596 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HD3' HG22 ' A' ' 44' ' ' THR . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.531 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.704 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.698 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.567 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.69 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.569 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.729 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.567 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.69 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.718 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.406 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.64 HG22 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.64 ' HG ' HG22 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.718 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.591 HG22 ' HD3' ' A' ' 4' ' ' LYS . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.175 0 CA-C-O 121.418 0.627 . . . . 0.0 112.411 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.589 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.616 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.445 HG23 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.599 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.599 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.726 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.901 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.726 HD11 HH11 ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.743 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.482 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' HG23 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.589 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.743 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.668 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.886 ' HD3' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.6 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.613 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.646 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.545 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.856 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.477 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.525 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.525 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.837 ' HA ' ' HB2' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' HD3' ' A' ' 46' ' ' PRO . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.477 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.453 ' HG2' HG23 ' A' ' 13' ' ' ILE . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.6 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.886 ' HG ' ' HD3' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.668 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.454 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 23.0 tp10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.943 0.878 . . . . 0.0 112.188 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.574 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.714 HG23 ' HB2' ' A' ' 39' ' ' ARG . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.732 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.524 ' HD3' ' HB2' ' A' ' 21' ' ' ARG . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.732 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.664 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HB2' ' HD3' ' A' ' 17' ' ' LYS . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.689 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 22' ' ' LYS . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.504 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.652 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.438 ' CG ' ' HZ1' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.689 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.714 ' HB2' HG23 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.549 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.756 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.652 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.155 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.592 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.514 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.747 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 1.03 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.747 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 1.03 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.438 ' HG2' ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.438 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.471 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.769 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.471 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.506 ' HB2' HD22 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD22 ' HB2' ' A' ' 35' ' ' SER . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.769 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.56 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.432 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.657 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.657 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.518 HH11 HD11 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.419 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.518 HD11 HH11 ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.785 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.419 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.554 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 35' ' ' SER . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.581 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.785 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 121.579 0.704 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.46 HG23 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.666 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.642 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.642 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.526 ' HB2' HD13 ' A' ' 42' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.46 ' HB2' HG23 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 35' ' ' SER . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.487 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.715 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 121.456 0.646 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.591 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.769 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.617 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.629 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.716 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.72 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.716 HD11 HH11 ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.725 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.72 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.769 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.725 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.7 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.549 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.666 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.59 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.546 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.562 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.595 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 22' ' ' LYS . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.595 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.589 ' HE1' HG23 ' A' ' 44' ' ' THR . 36.9 p-80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD22 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 42' ' ' LEU . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 33' ' ' HIS . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.731 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.731 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.56 0.695 . . . . 0.0 111.584 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.627 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.591 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.614 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.619 HH11 HD11 ' A' ' 25' ' ' ILE . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.619 HD11 HH11 ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.591 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.568 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.528 ' HG2' HG23 ' A' ' 13' ' ' ILE . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.489 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.627 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.604 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.435 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 . . . . . 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.565 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.644 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.881 HG23 ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.609 ' HD3' ' HB3' ' A' ' 17' ' ' LYS . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.41 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.61 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.665 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.881 ' HG2' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.624 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 . . . . . 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.516 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.534 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.422 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.673 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' CE ' ' A' ' 28' ' ' LYS . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.422 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.522 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 10' ' ' PHE . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.678 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.92 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.678 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.654 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.92 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.93 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.462 ' HB ' HD22 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.462 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.533 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.499 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.93 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.895 0.379 . . . . 0.0 111.619 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.672 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.645 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.698 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.833 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.803 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.803 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 . . . . . 0 C--O 1.236 0.377 0 CA-C-O 121.491 0.662 . . . . 0.0 111.61 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.436 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.508 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.714 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.578 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.507 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 40' ' ' ARG . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.415 ' HD3' ' HB3' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.606 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.524 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.65 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.713 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.713 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.737 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.737 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.591 HH11 ' HG2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.86 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' OG ' ' A' ' 7' ' ' SER . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.809 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.568 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.794 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.809 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.513 ' H ' ' HD3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.544 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.567 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.65 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.794 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 121.566 0.698 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.475 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.653 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.58 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.58 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.677 HH11 HD11 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.426 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.63 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.677 HD11 HH11 ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.514 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.404 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.588 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.8 mp0 . . . . . 0 C--O 1.233 0.197 0 CA-C-O 121.378 0.609 . . . . 0.0 110.382 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.546 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.666 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.652 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.661 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.661 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.851 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.479 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.414 ' H ' ' HD1' ' A' ' 29' ' ' PHE . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.844 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.459 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.459 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.495 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.844 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.778 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.415 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.742 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.742 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.573 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.605 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.625 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.621 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.573 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.605 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.551 ' HB2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.444 ' HG3' HH11 ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.618 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.778 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.434 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 . . . . . 0 CA--C 1.531 0.221 0 CA-C-O 121.418 0.628 . . . . 0.0 111.781 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.653 ' HD3' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.637 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.644 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.889 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.646 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.889 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HZ2' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.543 ' HB3' HD23 ' A' ' 42' ' ' LEU . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.653 HD12 ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . 0.42 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.702 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.65 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.454 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.365 0.126 . . . . 0.0 111.004 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 50.2 mm-40 66.3 53.9 0.98 Allowed 'General case' 0 C--O 1.235 0.317 0 O-C-N 123.886 0.741 . . . . 0.0 111.559 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 44' ' ' THR . 35.1 m -85.31 137.16 33.14 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.591 ' HD3' HG22 ' A' ' 44' ' ' THR . 41.7 mmtm -88.05 119.76 28.74 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.059 0.456 . . . . 0.0 111.396 -177.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.531 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 20.3 m -151.0 130.3 12.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -66.3 146.37 54.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.049 -179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.704 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 31.4 t -70.75 114.82 9.22 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.454 -178.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -73.38 -25.84 60.74 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 m -71.01 -35.06 71.9 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.983 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.461 ' HB2' ' HB3' ' A' ' 7' ' ' SER . 4.8 t80 -63.18 109.81 2.89 Favored Pre-proline 0 C--O 1.235 0.291 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.246 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.35 48.7 1.44 Allowed 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.128 2.552 . . . . 0.0 114.091 -178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.27 -159.72 30.84 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 119.381 -1.39 . . . . 0.0 113.9 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 53.2 mt -88.01 146.19 6.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.973 -0.613 . . . . 0.0 110.155 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 13.6 t -70.27 89.97 0.67 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.291 0.567 . . . . 0.0 109.846 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.7 mm -88.22 -38.33 11.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.245 -179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.698 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.66 154.92 42.63 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.045 179.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' N ' ' CD ' ' A' ' 18' ' ' PRO . 0.3 OUTLIER -69.52 -44.84 25.91 Favored Pre-proline 0 CA--C 1.541 0.603 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.907 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 82.2 Cg_exo -44.0 -52.35 5.63 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 122.683 2.255 . . . . 0.0 114.341 -179.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.1 Cg_exo -65.17 -39.87 21.86 Favored 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.939 1.759 . . . . 0.0 111.447 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.3 t -63.88 -38.4 90.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.003 179.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.567 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -50.94 -62.59 1.52 Allowed 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.581 179.757 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -62.87 -27.25 69.22 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.425 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.81 94.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.421 0.629 . . . . 0.0 109.583 178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.69 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 16.6 m -72.6 -33.97 67.08 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.195 178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.5 mt -66.91 -42.76 89.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.235 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 p -65.98 -36.66 83.91 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.156 0.503 . . . . 0.0 109.691 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.569 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 2.1 mm-40 -82.72 -173.67 4.78 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 177.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.729 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.1 OUTLIER -90.32 69.72 7.05 Favored 'General case' 0 C--N 1.316 -0.855 0 O-C-N 122.088 -0.383 . . . . 0.0 110.932 -179.412 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.569 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 81.3 m-85 -138.91 -144.8 0.18 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.215 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -161.46 -48.57 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.567 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 36.9 t70 -121.71 171.48 8.83 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.69 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.32 153.46 22.99 Favored Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 10.9 p-80 -167.84 -177.47 3.44 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.7 m -87.19 126.88 35.08 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 119.874 -0.731 . . . . 0.0 109.199 179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.718 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 39.8 t -67.29 129.68 40.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.458 -179.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.406 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 7.8 ptmm? -76.46 47.22 0.47 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.64 HG22 ' HG ' ' A' ' 38' ' ' LEU . 3.5 mp -135.28 -44.16 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 107.842 -1.17 . . . . 0.0 107.842 178.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.64 ' HG ' HG22 ' A' ' 37' ' ' ILE . 61.9 mt -135.09 -125.83 0.16 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 63.5 ttt180 -150.99 52.21 0.86 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.566 0.698 . . . . 0.0 110.888 177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -113.6 153.6 28.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.653 178.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.1 t -70.56 103.57 2.53 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.15 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.718 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 20.9 tp -90.78 102.45 15.2 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.546 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.704 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 79.0 m -89.8 151.35 21.84 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.513 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.591 HG22 ' HD3' ' A' ' 4' ' ' LYS . 36.0 p -114.74 128.69 56.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.7 ptpt -114.05 141.48 26.36 Favored Pre-proline 0 C--N 1.329 -0.32 0 C-N-CA 120.272 -0.571 . . . . 0.0 112.384 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -70.88 60.9 2.31 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 123.621 2.881 . . . . 0.0 112.162 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.454 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 7.6 p . . . . . 0 C--N 1.321 -0.648 0 CA-C-N 114.835 -1.075 . . . . 0.0 111.176 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 64.28 54.51 1.57 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 123.968 0.793 . . . . 0.0 112.411 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.524 ' O ' ' HA ' ' A' ' 44' ' ' THR . 40.1 m -86.58 134.02 33.67 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 177.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.21 117.51 25.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.344 0.593 . . . . 0.0 111.247 -177.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 9.3 m -150.74 133.13 15.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.724 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -70.84 138.45 50.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.701 0.286 . . . . 0.0 110.979 -178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.589 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.2 t -65.89 129.4 39.65 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.439 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -80.47 -36.05 33.98 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.38 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.4 p -72.11 -23.83 61.38 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.376 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.616 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 33.5 t80 -59.03 130.9 86.84 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.083 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 27.2 Cg_exo -63.4 51.81 0.14 Allowed 'Trans proline' 0 CA--C 1.537 0.646 0 C-N-CA 124.199 3.266 . . . . 0.0 115.378 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 74.3 -118.35 5.86 Favored Glycine 0 CA--C 1.506 -0.509 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.244 178.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.445 HG23 ' HD2' ' A' ' 39' ' ' ARG . 78.1 mt -52.82 134.37 14.91 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.704 -1.248 . . . . 0.0 111.945 -178.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.616 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 11.9 t -81.51 133.41 35.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.505 -0.771 . . . . 0.0 111.302 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.0 mp -100.12 -52.44 8.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.43 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.599 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -157.63 -170.24 3.14 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.18 0.514 . . . . 0.0 112.001 -179.782 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 44.5 tptt -70.63 -51.65 11.88 Favored Pre-proline 0 CA--C 1.535 0.377 0 CA-C-N 115.354 -0.839 . . . . 0.0 112.223 179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.599 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 59.4 Cg_exo -48.23 -55.61 3.89 Favored 'Trans proline' 0 C--N 1.358 1.061 0 C-N-CA 122.444 2.096 . . . . 0.0 114.268 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.46 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.3 Cg_endo -63.19 -41.01 29.65 Favored 'Trans proline' 0 C--N 1.359 1.112 0 C-N-CA 121.526 1.484 . . . . 0.0 112.009 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.88 -51.57 67.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.926 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.726 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -56.2 -41.31 75.37 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.687 178.958 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.901 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.28 -42.88 96.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.615 -178.693 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.07 -47.22 87.34 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 123.395 0.435 . . . . 0.0 111.017 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.8 m -56.44 -42.56 78.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.283 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.726 HD11 HH11 ' A' ' 21' ' ' ARG . 83.6 mt -67.62 -37.29 78.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.634 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.56 -36.69 84.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.786 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -80.57 -114.51 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.396 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.4 mttm -143.3 46.47 1.52 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-O 121.413 0.625 . . . . 0.0 110.453 -179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.743 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 12.6 m-85 -118.5 -141.55 0.36 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.665 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.9 t -159.05 -45.75 0.06 Allowed 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -133.64 -179.81 5.76 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.482 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.39 167.95 40.89 Favored Glycine 0 N--CA 1.44 -1.048 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.2 p-80 -160.73 151.96 19.07 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 -179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.3 t -86.73 133.05 33.7 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.577 -0.898 . . . . 0.0 108.577 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.524 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.3 t -68.74 133.13 47.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.759 0.314 . . . . 0.0 110.277 -179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -84.08 33.07 0.49 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.087 0.47 . . . . 0.0 110.697 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 26.2 mm -149.34 -46.13 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 35' ' ' SER . 87.9 mt -113.78 139.18 49.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.204 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' HG23 ' A' ' 13' ' ' ILE . 30.0 ptt180 -85.36 63.37 8.05 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.831 0.824 . . . . 0.0 110.608 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -134.13 146.36 50.17 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.111 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 36.7 t -80.26 113.4 18.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.569 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mp -96.89 99.99 11.53 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.589 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 91.5 m -88.84 151.87 22.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.151 0.5 . . . . 0.0 111.755 -179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.524 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 20.2 p -122.41 128.71 51.27 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.743 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 9.3 ptmm? -118.0 143.14 32.15 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -177.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 11.6 Cg_exo -69.47 64.61 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.624 2.883 . . . . 0.0 111.763 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 5.8 p . . . . . 0 C--O 1.253 1.238 0 CA-C-O 118.063 -0.97 . . . . 0.0 110.841 -179.713 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.689 ' HG2' ' HA ' ' A' ' 46' ' ' PRO . 4.4 ttp180 . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.668 ' HG3' ' HB ' ' A' ' 44' ' ' THR . 1.8 mp0 68.49 61.47 0.37 Allowed 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.51 0.672 . . . . 0.0 112.557 178.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.575 ' O ' ' HA ' ' A' ' 44' ' ' THR . 1.3 m -85.33 142.45 29.33 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.016 -1.475 . . . . 0.0 107.016 176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.886 ' HD3' ' HG ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -86.51 119.5 26.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.516 0.674 . . . . 0.0 110.639 -178.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.8 m -134.93 133.72 39.87 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 177.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.6 ' OE2' ' HD3' ' A' ' 40' ' ' ARG . 6.5 tp10 -65.91 133.47 50.97 Favored 'General case' 0 C--N 1.318 -0.786 0 C-N-CA 120.949 -0.301 . . . . 0.0 110.516 -177.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.2 t -71.52 94.4 1.29 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.527 -178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.5 p-10 -71.06 -24.84 62.41 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.43 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.78 -34.95 67.28 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.15 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.646 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 6.4 t80 -71.63 137.19 83.12 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.374 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.28 51.93 1.11 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.174 2.583 . . . . 0.0 114.363 -179.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.17 -124.92 6.75 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.437 -0.887 . . . . 0.0 114.251 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.613 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.1 mp -44.75 128.35 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.837 -178.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.646 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.4 p -68.39 135.26 51.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.681 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.9 mm -91.59 -57.12 4.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -160.31 -172.9 3.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.924 179.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.545 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 51.4 tptt -70.1 -52.8 11.99 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.654 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.595 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 53.2 Cg_exo -49.1 -55.89 3.71 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 122.482 2.121 . . . . 0.0 114.495 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.478 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 32.2 Cg_endo -64.85 -42.77 13.95 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 121.615 1.544 . . . . 0.0 112.473 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -61.36 -46.22 91.11 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 5.0 ttt180 -60.62 -45.08 95.38 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.593 178.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.856 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -61.42 -40.93 96.24 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.757 -178.347 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.07 -46.91 87.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.08 0.466 . . . . 0.0 110.226 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.477 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 28.4 m -62.97 -46.68 86.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.024 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.7 mt -63.67 -34.34 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.499 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 69.6 m -66.91 -35.74 80.67 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.759 0.314 . . . . 0.0 110.65 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.525 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 1.9 mm-40 -84.73 -134.59 0.05 Allowed 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.708 179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.525 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 8.8 mptt -112.66 49.66 0.92 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.825 -179.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.837 ' HA ' ' HB2' ' A' ' 45' ' ' LYS . 68.9 m-85 -129.92 -174.38 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.008 0.432 . . . . 0.0 110.177 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' HD3' ' A' ' 46' ' ' PRO . 1.4 p -124.02 -37.12 2.61 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.003 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -146.3 179.92 7.18 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.556 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.477 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.62 157.67 30.14 Favored Glycine 0 N--CA 1.439 -1.165 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 179.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.3 p-80 -160.85 160.79 31.5 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 8.7 t -86.94 142.21 28.15 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -65.42 142.89 58.03 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.562 -179.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 28.4 mtpp -81.46 33.03 0.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 pt -158.95 -42.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.44 0.638 . . . . 0.0 109.315 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.3 mt -111.48 136.43 50.65 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.467 -0.788 . . . . 0.0 108.944 178.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.453 ' HG2' HG23 ' A' ' 13' ' ' ILE . 38.3 ttt85 -85.59 69.46 10.65 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.791 0.805 . . . . 0.0 110.103 -179.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.6 ' HD3' ' OE2' ' A' ' 6' ' ' GLU . 9.0 ptp180 -137.63 148.53 45.87 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.301 -179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 50.3 t -77.49 112.31 14.13 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.471 0.653 . . . . 0.0 111.917 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.886 ' HG ' ' HD3' ' A' ' 4' ' ' LYS . 6.1 mp -97.91 107.98 20.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.573 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 79.8 m -88.41 142.32 27.82 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.121 0.486 . . . . 0.0 111.457 -179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.668 ' HB ' ' HG3' ' A' ' 2' ' ' GLU . 1.5 p -121.48 135.81 55.01 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -145.1 168.31 12.4 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -176.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.689 ' HA ' ' HG2' ' A' ' 1' ' ' ARG . 62.9 Cg_exo -38.82 138.74 0.51 Allowed 'Trans proline' 0 C--N 1.364 1.346 0 C-N-CA 123.723 2.948 . . . . 0.0 112.104 178.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.559 ' N ' ' HA ' ' A' ' 1' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.319 0 CA-C-O 117.053 -1.451 . . . . 0.0 107.841 -177.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.714 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 8.4 ttp85 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 118.297 -0.859 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.654 ' HB2' ' O ' ' A' ' 1' ' ' ARG . 23.0 tp10 158.71 35.52 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 O-C-N 124.467 1.104 . . . . 0.0 112.188 177.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.574 ' HB2' ' HG3' ' A' ' 45' ' ' LYS . 1.3 m -104.61 109.66 21.66 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 176.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmm -87.57 124.18 33.23 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.892 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.512 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 58.0 m -151.85 137.7 18.04 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.28 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.549 ' OE2' ' HB3' ' A' ' 40' ' ' ARG . 38.7 tp10 -61.41 139.56 58.18 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.985 0.421 . . . . 0.0 110.9 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 24.5 t -69.49 122.43 19.0 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.397 -179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 -83.77 -33.93 24.9 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.79 -31.78 69.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.534 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.594 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 4.3 t80 -67.92 122.3 83.22 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-O 120.942 0.401 . . . . 0.0 110.34 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 16.3 Cg_endo -58.09 -45.25 33.02 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 123.814 3.009 . . . . 0.0 115.473 -177.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -157.0 -136.21 2.07 Favored Glycine 0 CA--C 1.506 -0.494 0 C-N-CA 119.032 -1.556 . . . . 0.0 114.711 -177.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.714 HG23 ' HB2' ' A' ' 39' ' ' ARG . 3.5 mp -54.59 133.4 17.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 114.334 -0.933 . . . . 0.0 111.412 -178.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.594 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 13.4 t -70.49 109.63 4.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.724 179.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.0 mm -89.41 -40.38 13.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.915 -179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.732 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -155.46 166.87 32.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.046 0.45 . . . . 0.0 111.696 -179.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.524 ' HD3' ' HB2' ' A' ' 21' ' ' ARG . 1.5 tmtm? -67.63 -50.4 35.85 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.301 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.732 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 72.3 Cg_exo -45.59 -53.75 5.22 Favored 'Trans proline' 0 C--N 1.361 1.19 0 C-N-CA 122.499 2.133 . . . . 0.0 114.247 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.664 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.7 Cg_exo -64.66 -41.41 19.19 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.096 1.864 . . . . 0.0 112.018 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.0 t -66.81 -41.07 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.0 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HB2' ' HD3' ' A' ' 17' ' ' LYS . 3.5 ttt85 -56.46 -54.77 41.79 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -178.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.539 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.17 -27.86 69.66 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.68 -43.71 98.11 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 121.632 0.73 . . . . 0.0 109.101 178.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.689 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 14.3 m -68.32 -36.26 79.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.176 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' A' ' 22' ' ' LYS . 83.6 mt -65.52 -42.48 93.23 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.044 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 11.7 p -66.16 -30.16 70.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.89 0.376 . . . . 0.0 110.319 179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.504 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -85.92 -153.29 0.18 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.795 178.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm -103.71 55.96 0.74 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 122.107 -0.37 . . . . 0.0 111.495 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.652 ' HA ' ' CB ' ' A' ' 45' ' ' LYS . 59.3 m-85 -129.04 -128.54 0.22 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.0 t -178.26 -33.38 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.349 0.595 . . . . 0.0 109.943 179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.438 ' CG ' ' HZ1' ' A' ' 17' ' ' LYS . 37.9 t70 -147.91 159.18 44.14 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.494 179.093 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.689 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -153.06 166.63 31.56 Favored Glycine 0 N--CA 1.44 -1.062 0 N-CA-C 110.517 -1.033 . . . . 0.0 110.517 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -164.47 174.69 10.67 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 55.8 m -85.92 125.82 33.63 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -69.32 123.95 22.56 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 pttp -77.22 47.65 0.57 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.397 0.618 . . . . 0.0 111.446 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 43.4 mm -133.95 -40.69 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 179.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 74.9 mt -135.96 -123.63 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.012 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.714 ' HB2' HG23 ' A' ' 13' ' ' ILE . 28.0 ptt180 -151.21 48.96 0.84 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.227 0.536 . . . . 0.0 110.561 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' HB3' ' OE2' ' A' ' 6' ' ' GLU . 14.7 mmm180 -121.44 160.33 24.37 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.015 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.6 t -80.28 97.45 6.98 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.013 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.756 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.6 tp -80.53 104.48 11.09 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.488 179.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 63.3 m -88.56 145.31 25.79 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.385 0.612 . . . . 0.0 111.587 -179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -118.42 117.32 28.74 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.665 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 45.4 pttt -107.69 165.24 13.14 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.714 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 24.6 Cg_exo -62.95 131.83 34.45 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.969 2.446 . . . . 0.0 111.561 179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.317 -0.816 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 64.43 55.88 1.33 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.908 0.861 . . . . 0.0 110.895 -178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.544 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 53.4 m -85.96 141.08 29.78 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.707 -1.133 . . . . 0.0 108.415 178.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 mtmt -86.22 127.01 34.68 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.049 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.592 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 6.8 m -150.4 145.73 26.26 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.096 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -61.46 135.04 57.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.402 -179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 45.9 p -66.48 102.36 0.88 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.828 -178.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -91.28 46.22 1.29 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.71 -34.67 0.1 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.298 -178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.514 ' CD1' ' HD2' ' A' ' 11' ' ' PRO . 4.6 t80 -67.28 135.67 93.48 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.107 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 12.1 Cg_endo -56.56 -35.97 97.45 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.34 2.693 . . . . 0.0 114.415 -178.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 177.83 -130.1 1.54 Allowed Glycine 0 CA--C 1.506 -0.518 0 C-N-CA 119.621 -1.276 . . . . 0.0 113.684 -178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.9 mm -56.13 140.14 14.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 114.331 -0.935 . . . . 0.0 111.088 -179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.544 ' HB3' ' HG2' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -60.64 130.99 49.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.844 -179.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.9 mm -107.95 -49.23 7.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.108 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.747 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -161.41 171.78 17.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.613 179.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 1.03 ' HE2' ' HG2' ' A' ' 21' ' ' ARG . 0.4 OUTLIER -69.65 -48.61 23.18 Favored Pre-proline 0 CA--C 1.541 0.617 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.621 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.747 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 81.0 Cg_exo -43.72 -52.42 5.34 Favored 'Trans proline' 0 C--N 1.362 1.261 0 C-N-CA 122.72 2.28 . . . . 0.0 114.383 -179.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.632 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 27.6 Cg_exo -63.01 -40.02 36.63 Favored 'Trans proline' 0 C--N 1.358 1.073 0 C-N-CA 121.967 1.778 . . . . 0.0 111.726 179.518 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 43.7 t -64.7 -37.04 86.22 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.367 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 1.03 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 0.0 OUTLIER -54.05 -61.87 2.03 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.895 -179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.438 ' HG2' ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -62.78 -30.43 71.46 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 112.184 -178.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.438 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -62.07 -47.57 84.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.229 0.538 . . . . 0.0 109.978 179.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.471 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 54.6 m -64.57 -36.35 83.94 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.848 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.7 mt -68.65 -34.38 64.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.651 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.3 m -63.74 -38.69 92.05 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.554 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -88.94 179.34 6.2 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.774 178.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -74.1 54.86 0.55 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.769 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 80.4 m-85 -128.33 -136.3 0.23 Allowed 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.6 t -169.53 -42.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.051 0.453 . . . . 0.0 110.284 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -138.76 179.11 6.67 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.471 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -165.34 -176.06 36.54 Favored Glycine 0 N--CA 1.437 -1.27 0 N-CA-C 111.209 -0.756 . . . . 0.0 111.209 179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 179.44 160.68 0.77 Allowed 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.4 m -86.81 127.03 35.0 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.506 ' HB2' HD22 ' A' ' 42' ' ' LEU . 9.7 t -68.28 137.07 54.41 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.243 -177.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.92 44.66 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.147 0.499 . . . . 0.0 110.925 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 29.7 mm -146.71 -46.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 90.8 mt -126.91 136.45 52.32 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 177.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.544 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.7 ttt85 -83.83 68.07 9.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 121.642 0.734 . . . . 0.0 110.822 -177.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 53.5 mtm180 -139.86 154.82 47.4 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.433 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.12 115.3 6.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.344 -179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD22 ' HB2' ' A' ' 35' ' ' SER . 14.3 tp -104.69 106.09 16.44 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.7 m -88.77 147.38 24.48 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.531 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 8.8 p -113.8 129.8 56.54 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.769 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 5.2 ptmm? -115.37 141.92 27.94 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.894 -178.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 10.6 Cg_exo -69.63 65.63 1.71 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.543 2.829 . . . . 0.0 111.724 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.7 p . . . . . 0 C--O 1.246 0.871 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.098 -179.861 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 3.6 ptm180 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.559 ' HB2' ' NH1' ' A' ' 1' ' ' ARG . 3.6 tp10 63.52 50.07 2.92 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 122.149 0.976 . . . . 0.0 110.057 -179.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.523 ' O ' ' HA ' ' A' ' 44' ' ' THR . 3.3 m -87.13 139.52 30.49 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.471 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -89.19 128.57 35.82 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 39.8 m -152.47 131.68 12.76 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.237 179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -67.46 134.02 50.61 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.967 179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.64 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 15.8 t -73.57 115.39 12.9 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.914 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -74.83 -27.81 60.43 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -66.32 -30.41 70.82 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.54 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.56 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 16.2 t80 -65.11 127.51 92.9 Favored Pre-proline 0 C--O 1.234 0.239 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.459 ' HD2' ' HA ' ' A' ' 10' ' ' PHE . 2.5 Cg_endo -42.01 -44.13 7.21 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 124.573 3.515 . . . . 0.0 115.034 -178.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.4 -127.27 1.04 Allowed Glycine 0 CA--C 1.501 -0.801 0 C-N-CA 119.535 -1.317 . . . . 0.0 113.411 -178.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.432 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.7 mp -55.16 131.95 18.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 CA-C-N 113.977 -1.111 . . . . 0.0 111.101 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 12.8 t -74.57 128.42 35.5 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.018 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.6 mm -123.29 -43.26 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.904 0.383 . . . . 0.0 111.092 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.567 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.8 OUTLIER -136.81 151.58 49.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.02 0.438 . . . . 0.0 111.944 -179.363 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.3 tmtp? -68.21 -47.61 38.58 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.777 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.657 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 74.0 Cg_exo -46.39 -55.07 4.04 Favored 'Trans proline' 0 C--N 1.36 1.148 0 C-N-CA 122.263 1.975 . . . . 0.0 114.151 -179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.657 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 16.9 Cg_exo -67.59 -35.61 22.04 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 121.87 1.714 . . . . 0.0 111.234 179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.7 t -61.46 -48.7 79.94 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 178.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.518 HH11 HD11 ' A' ' 25' ' ' ILE . 7.9 ttt-85 -58.85 -36.36 74.46 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.61 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -61.89 -42.65 99.32 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.462 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.97 92.98 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.769 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.419 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 31.7 m -59.62 -44.21 93.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.817 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.518 HD11 HH11 ' A' ' 21' ' ' ARG . 87.1 mt -67.45 -38.67 81.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.955 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 32.6 m -63.47 -28.93 70.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.889 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -89.51 -125.85 0.06 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.688 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 35.2 mtmm -134.62 52.74 2.03 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.906 0.384 . . . . 0.0 110.584 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.785 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 73.2 m-85 -122.48 -146.04 0.36 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.901 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.5 t -152.65 -44.33 0.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -135.41 -173.72 3.42 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.419 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -177.0 170.39 43.07 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.588 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 37.4 p-80 -175.96 176.6 1.76 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 58.9 m -86.86 133.24 33.64 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 178.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 40.0 t -72.44 141.03 48.63 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 111.259 -178.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.554 ' HD3' HG12 ' A' ' 37' ' ' ILE . 0.0 OUTLIER -85.92 31.01 0.63 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 121.357 0.599 . . . . 0.0 111.109 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.554 HG12 ' HD3' ' A' ' 36' ' ' LYS . 28.8 mm -142.96 -50.9 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 35' ' ' SER . 96.2 mt -115.25 140.97 48.65 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 107.756 -1.202 . . . . 0.0 107.756 177.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.432 ' HG2' HG23 ' A' ' 13' ' ' ILE . 26.2 ttm180 -85.31 52.26 2.4 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.868 0.842 . . . . 0.0 110.348 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.3 mmt180 -119.03 161.76 19.71 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.735 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 24.6 t -76.08 98.81 4.44 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.661 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 13.3 tp -79.88 97.09 6.55 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.714 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 97.7 m -87.93 142.93 27.41 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.013 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.581 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 23.1 p -107.55 130.58 54.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.867 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.785 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -133.22 144.04 50.85 Favored Pre-proline 0 C--N 1.329 -0.296 0 C-N-CA 120.922 -0.311 . . . . 0.0 111.268 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.719 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 56.1 Cg_endo -70.72 60.51 2.19 Favored 'Trans proline' 0 CA--C 1.528 0.18 0 C-N-CA 123.237 2.624 . . . . 0.0 112.867 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.242 0.679 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.528 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.7 mtp180 . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 111.196 0.073 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 17.5 mp0 61.59 53.41 3.31 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 124.064 0.852 . . . . 0.0 111.864 178.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 m -86.4 139.13 31.23 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -87.05 128.91 35.09 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.244 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.584 ' HB ' ' CE1' ' A' ' 29' ' ' PHE . 16.7 m -151.21 140.0 20.83 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.7 pm0 -66.05 132.17 47.91 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.034 0.445 . . . . 0.0 109.996 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.439 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 9.2 t -69.76 95.59 0.9 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.931 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -77.81 -18.19 56.64 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.947 -0.761 . . . . 0.0 108.947 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.453 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 2.1 p -76.53 -29.23 56.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.495 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.557 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 8.0 t80 -76.42 110.09 10.42 Favored Pre-proline 0 N--CA 1.464 0.227 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' ' 9' ' ' THR . 95.9 Cg_endo -86.73 52.52 2.69 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.917 2.412 . . . . 0.0 114.083 -178.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.36 -174.06 46.59 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 119.67 -1.252 . . . . 0.0 113.58 179.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.46 HG23 ' HB2' ' A' ' 39' ' ' ARG . 77.3 mt -78.03 136.32 24.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.2 t -70.05 120.92 16.48 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 121.0 -0.28 . . . . 0.0 110.266 -179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.7 mm -138.11 -44.62 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.794 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -112.24 142.66 44.45 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.935 -0.575 . . . . 0.0 112.392 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.502 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 44.2 tptt -66.91 -52.25 33.18 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.735 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.666 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 68.9 Cg_exo -47.3 -54.44 5.05 Favored 'Trans proline' 0 CA--C 1.546 1.084 0 C-N-CA 122.572 2.181 . . . . 0.0 114.4 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.666 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.4 Cg_exo -63.75 -46.57 8.63 Favored 'Trans proline' 0 C--N 1.359 1.085 0 C-N-CA 122.106 1.871 . . . . 0.0 112.4 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 t -61.53 -43.13 99.42 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.326 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.439 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.7 ttt180 -59.79 -52.2 66.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.588 ' HD2' ' O ' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -63.97 -27.86 69.42 Favored 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.287 -178.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.03 -41.61 97.36 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 177.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.642 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.6 m -63.99 -42.69 97.11 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.245 178.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 21' ' ' ARG . 73.7 mt -62.59 -31.56 52.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.617 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.2 m -64.01 -38.38 90.85 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.805 179.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.572 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -85.27 -152.85 0.16 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 178.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 22.9 tptp -95.21 24.31 5.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.458 0.647 . . . . 0.0 110.606 179.754 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 85.3 m-85 -88.51 -143.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.992 0.425 . . . . 0.0 110.67 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.9 t -170.88 -33.31 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.277 179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -143.86 169.56 17.56 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.468 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.642 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.27 164.77 36.86 Favored Glycine 0 N--CA 1.444 -0.78 0 N-CA-C 110.624 -0.991 . . . . 0.0 110.624 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.7 p-80 -165.87 166.62 17.46 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 120.673 0.273 . . . . 0.0 110.555 -178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.6 m -86.69 138.69 31.44 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.526 ' HB2' HD13 ' A' ' 42' ' ' LEU . 37.5 t -74.94 140.22 43.57 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.86 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 63.6 pttt -81.92 23.99 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 111.113 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 31.5 mm -145.75 -49.43 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.491 ' O ' ' HB3' ' A' ' 35' ' ' SER . 2.8 mm? -101.57 138.52 38.45 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.248 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.46 ' HB2' HG23 ' A' ' 13' ' ' ILE . 33.0 ptt180 -85.97 52.38 2.46 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.788 0.804 . . . . 0.0 110.818 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 -130.28 154.41 47.64 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.339 179.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 13.0 t -79.94 112.23 17.03 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.674 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 35' ' ' SER . 8.4 mp -93.93 102.88 14.99 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.487 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 95.1 m -89.48 143.94 26.43 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.51 -178.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -109.27 121.06 44.34 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.059 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.715 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 17.7 ptpt -110.82 136.37 20.73 Favored Pre-proline 0 CA--C 1.517 -0.309 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -178.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.87 68.66 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.305 2.67 . . . . 0.0 110.703 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.254 1.335 0 CA-C-N 114.599 -1.182 . . . . 0.0 110.462 -179.107 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 67.4 55.43 0.65 Allowed 'General case' 0 CA--C 1.53 0.185 0 O-C-N 123.805 0.691 . . . . 0.0 111.12 -179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.591 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 60.9 m -86.91 138.93 31.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 177.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.769 ' HE2' HG22 ' A' ' 44' ' ' THR . 1.9 mmpp? -88.06 120.41 29.38 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.78 0.324 . . . . 0.0 111.128 -177.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.528 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 14.1 m -151.67 127.88 10.52 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 10.6 pt-20 -71.84 135.08 46.49 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.989 0.423 . . . . 0.0 111.173 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.617 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 25.2 t -76.7 119.24 20.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -79.31 -25.44 42.37 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.9 m -70.92 -23.66 62.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.929 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.629 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 55.7 t80 -64.48 121.17 71.14 Favored Pre-proline 0 C--N 1.333 -0.136 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.076 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -74.35 130.62 14.18 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.505 2.137 . . . . 0.0 113.708 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.29 -154.46 42.61 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.399 -0.819 . . . . 0.0 114.191 178.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.0 mp -100.34 143.48 13.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.103 -0.548 . . . . 0.0 110.016 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.53 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.3 t -61.71 121.97 14.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.694 0.283 . . . . 0.0 110.409 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 36.8 mm -138.16 -47.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.337 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -112.68 147.33 37.01 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.489 ' HE3' ' HG3' ' A' ' 21' ' ' ARG . 42.8 tptt -67.18 -51.36 35.81 Favored Pre-proline 0 CA--C 1.538 0.502 0 CA-C-N 115.067 -0.97 . . . . 0.0 112.076 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.639 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.0 Cg_exo -46.64 -54.82 4.38 Favored 'Trans proline' 0 C--N 1.358 1.047 0 C-N-CA 122.594 2.196 . . . . 0.0 114.671 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.639 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.3 Cg_exo -67.85 -40.48 9.49 Favored 'Trans proline' 0 C--N 1.357 0.997 0 C-N-CA 121.87 1.713 . . . . 0.0 112.154 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 41.7 t -60.92 -48.14 83.16 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.716 HH11 HD11 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -57.97 -39.94 79.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.122 178.14 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -63.73 -43.38 96.68 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.6 -40.83 97.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.227 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.72 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 46.4 m -63.13 -38.08 89.75 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.757 179.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.716 HD11 HH11 ' A' ' 21' ' ' ARG . 91.1 mt -68.99 -38.41 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.295 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -64.23 -40.23 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.488 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -80.71 -175.01 5.05 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.574 178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -89.49 57.3 3.91 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.081 -0.387 . . . . 0.0 111.856 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.725 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 95.3 m-85 -122.04 -136.16 0.31 Allowed 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 44' ' ' THR . 9.3 t -164.95 -35.53 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -148.93 179.89 7.52 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.72 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.15 172.96 42.95 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.624 -0.798 . . . . 0.0 112.597 -179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 p-80 -175.3 168.74 3.3 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 -179.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 62.1 m -86.05 130.53 34.51 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 44.0 t -69.05 141.25 54.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.98 0.419 . . . . 0.0 111.252 -178.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -85.54 34.52 0.58 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.172 0.51 . . . . 0.0 110.727 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 78.5 mt -146.59 -48.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 107.905 -1.146 . . . . 0.0 107.905 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 35' ' ' SER . 88.9 mt -118.62 137.64 53.13 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 177.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 25.4 ttm180 -84.93 53.4 2.72 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 122.157 0.979 . . . . 0.0 110.18 -178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmt85 -117.17 152.66 34.3 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.133 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 42.5 t -71.49 89.18 0.94 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.223 0.535 . . . . 0.0 109.682 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 14.9 tp -73.77 98.12 2.87 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.929 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 92.4 m -88.31 150.08 23.43 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.866 -179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.769 HG22 ' HE2' ' A' ' 4' ' ' LYS . 42.9 p -108.27 121.44 44.9 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.725 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 3.0 ptmm? -110.05 139.94 21.86 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -178.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -73.23 56.47 3.19 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.392 2.728 . . . . 0.0 111.915 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.93 179.926 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.72 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 24.2 ptt180 . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.252 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.503 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 0.0 OUTLIER 172.65 34.32 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.7 ' HB2' ' CG ' ' A' ' 45' ' ' LYS . 56.2 m -117.64 123.45 46.17 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 176.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -88.97 122.52 32.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.777 -177.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.549 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 21.9 m -154.08 131.81 11.5 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.3 pm0 -64.63 145.99 55.35 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.843 0.354 . . . . 0.0 110.963 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.666 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 41.5 t -69.07 135.03 50.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.761 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -87.65 -31.58 19.7 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.673 179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 22.4 p -76.68 -34.52 58.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.683 -179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.59 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 28.2 t80 -63.83 116.71 28.89 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.827 0.346 . . . . 0.0 110.311 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -91.25 135.25 1.77 Allowed 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.78 2.32 . . . . 0.0 114.049 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.24 -152.56 32.77 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.429 -0.805 . . . . 0.0 114.594 178.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 44.8 mm -88.63 150.3 3.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 114.729 -0.735 . . . . 0.0 110.783 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.59 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 1.2 t -56.62 128.53 36.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.085 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -103.47 -57.84 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.567 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.546 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -158.27 178.75 9.84 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.386 -179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.463 ' N ' ' HD2' ' A' ' 18' ' ' PRO . 44.8 tptt -64.7 -54.0 39.52 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-N 115.8 -0.636 . . . . 0.0 112.384 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.562 ' HG2' ' HD3' ' A' ' 19' ' ' PRO . 1.8 Cg_endo -47.73 -52.8 7.5 Favored 'Trans proline' 0 CA--C 1.547 1.128 0 C-N-CA 122.446 2.097 . . . . 0.0 114.847 -178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.562 ' HD3' ' HG2' ' A' ' 18' ' ' PRO . 21.2 Cg_exo -66.36 -41.82 11.38 Favored 'Trans proline' 0 C--N 1.359 1.105 0 C-N-CA 121.944 1.763 . . . . 0.0 112.279 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.9 t -65.82 -41.49 91.77 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.191 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 25' ' ' ILE . 1.9 ttt-85 -55.78 -54.96 38.05 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -178.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.665 ' HA ' HD12 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -63.08 -30.74 71.84 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -177.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.442 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -61.51 -45.6 93.53 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.469 0.652 . . . . 0.0 109.796 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.595 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 10.7 m -62.41 -35.2 78.47 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.332 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' A' ' 22' ' ' LYS . 72.6 mt -67.6 -44.16 86.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.469 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.4 p -64.57 -30.03 71.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.673 0.273 . . . . 0.0 111.49 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 52.9 mt-10 -85.63 -138.71 0.08 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.989 0.423 . . . . 0.0 110.942 179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.432 ' H ' ' HB3' ' A' ' 27' ' ' GLU . 52.8 mtpt -117.3 62.6 0.74 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.009 0.433 . . . . 0.0 110.959 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.634 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 82.5 m-85 -134.16 -128.09 0.17 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.498 -0.774 . . . . 0.0 108.978 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.1 t -178.13 -31.88 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.43 0.633 . . . . 0.0 109.622 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -154.5 168.32 27.1 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.595 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -151.12 174.49 30.36 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.743 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.589 ' HE1' HG23 ' A' ' 44' ' ' THR . 36.9 p-80 -166.9 159.41 13.44 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.801 0.334 . . . . 0.0 110.393 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -86.57 118.83 26.24 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 178.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.414 ' HB2' HD22 ' A' ' 42' ' ' LEU . 36.6 t -55.79 141.5 38.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.444 0.64 . . . . 0.0 112.233 -177.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.1 mmtm -91.57 38.02 0.97 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 110.942 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 76.8 mt -142.64 -45.67 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 95.6 mt -131.56 147.31 52.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 14' ' ' CYS . 50.3 ttt85 -85.01 65.86 9.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.933 0.873 . . . . 0.0 110.472 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.8 ptm85 -127.85 145.23 51.0 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.751 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.59 95.43 0.48 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.233 0.54 . . . . 0.0 109.966 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 42' ' ' LEU . 14.7 tp -88.08 104.55 16.78 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.998 -179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 99.9 m -88.27 150.35 23.31 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.463 0.649 . . . . 0.0 112.094 -178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.589 HG23 ' HE1' ' A' ' 33' ' ' HIS . 0.4 OUTLIER -113.39 116.8 30.22 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.467 178.587 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.731 ' HB2' ' HD2' ' A' ' 46' ' ' PRO . 14.1 ptpt -100.15 164.48 16.3 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -178.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.731 ' HD2' ' HB2' ' A' ' 45' ' ' LYS . 20.8 Cg_endo -60.92 119.55 6.78 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 123.067 2.511 . . . . 0.0 112.124 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.584 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 62.3 m . . . . . 0 C--O 1.26 1.657 0 CA-C-O 116.703 -1.617 . . . . 0.0 106.802 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.498 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 17.2 ptm180 . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.702 -0.11 . . . . 0.0 110.702 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.441 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 0.5 OUTLIER 63.11 50.21 3.14 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 123.817 0.698 . . . . 0.0 111.584 179.713 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.627 ' HB2' ' HG2' ' A' ' 45' ' ' LYS . 82.6 m -83.99 137.79 33.44 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.6 131.24 35.04 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.859 0.362 . . . . 0.0 111.749 -177.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.591 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 16.5 m -152.23 135.36 15.76 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 2.0 pm0 -66.56 133.74 50.95 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.092 0.473 . . . . 0.0 110.298 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.1 t -80.33 96.92 6.8 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.366 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -66.88 -32.62 74.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.118 0.485 . . . . 0.0 110.241 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.7 m -67.91 -26.4 65.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.311 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.608 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 26.2 t80 -69.06 138.26 89.82 Favored Pre-proline 0 CA--C 1.531 0.226 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 10' ' ' PHE . 39.3 Cg_endo -66.69 52.4 0.37 Allowed 'Trans proline' 0 CA--C 1.539 0.741 0 C-N-CA 123.454 2.769 . . . . 0.0 115.054 -178.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.76 -124.58 6.67 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.536 -0.84 . . . . 0.0 114.577 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 ' HG2' ' A' ' 39' ' ' ARG . 2.8 mp -50.88 132.47 11.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 113.85 -1.175 . . . . 0.0 111.518 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.608 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 11.7 p -68.31 131.72 45.84 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.712 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.1 mm -89.73 -51.63 11.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.614 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -158.46 -176.2 5.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.165 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 9.4 tmtt? -74.01 -53.21 4.08 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.445 -179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.614 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 50.1 Cg_exo -50.87 -52.33 9.29 Favored 'Trans proline' 0 CA--C 1.546 1.079 0 C-N-CA 122.389 2.06 . . . . 0.0 114.581 -178.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.542 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.2 Cg_exo -63.31 -39.12 39.53 Favored 'Trans proline' 0 C--N 1.361 1.188 0 C-N-CA 121.918 1.745 . . . . 0.0 111.716 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -61.64 -46.35 90.17 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.619 HH11 HD11 ' A' ' 25' ' ' ILE . 1.3 tmt_? -58.53 -40.4 82.85 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.167 178.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -62.46 -44.18 97.01 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 114.941 -1.027 . . . . 0.0 111.49 -178.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.64 -40.6 95.46 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.143 0.497 . . . . 0.0 110.212 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 35.2 m -62.93 -35.79 81.26 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.933 179.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.619 HD11 HH11 ' A' ' 21' ' ' ARG . 77.2 mt -67.59 -42.75 87.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.331 179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.1 m -67.95 -28.81 67.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.505 ' HB3' ' H ' ' A' ' 28' ' ' LYS . 25.8 mm-40 -80.46 -135.68 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.581 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.7 mptt -128.57 57.97 1.58 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.573 -0.528 . . . . 0.0 109.573 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.591 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 57.0 m-85 -137.5 -133.78 0.14 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.415 -178.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -165.7 -38.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -137.69 175.08 9.91 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.082 -0.711 . . . . 0.0 109.082 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -169.07 160.74 34.27 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.929 -0.868 . . . . 0.0 110.929 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -163.79 165.14 23.32 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.422 ' SG ' ' HA ' ' A' ' 39' ' ' ARG . 10.0 t -87.39 145.63 26.22 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.568 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 31.7 t -68.88 147.27 51.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.561 -179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.2 21.29 0.46 Allowed 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 38' ' ' LEU . 0.0 OUTLIER -153.32 -46.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 178.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.568 ' O ' ' HB3' ' A' ' 35' ' ' SER . 91.1 mt -96.41 128.66 43.55 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' HG2' HG23 ' A' ' 13' ' ' ILE . 37.3 ttt85 -85.43 63.17 7.93 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 121.805 0.812 . . . . 0.0 110.567 -178.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.469 ' HD2' ' O ' ' A' ' 39' ' ' ARG . 10.2 mpt_? -133.8 159.74 39.71 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.584 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 53.0 t -82.95 116.07 22.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.443 -179.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -104.43 108.64 20.16 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.489 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 96.2 m -89.39 149.57 22.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.8 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.598 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.5 p -119.26 117.02 27.47 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.278 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.627 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 18.1 ptpt -99.41 137.71 20.37 Favored Pre-proline 0 N--CA 1.464 0.266 0 CA-C-O 120.578 0.227 . . . . 0.0 111.29 -179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.428 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 71.6 Cg_endo -74.66 64.43 5.73 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.175 2.583 . . . . 0.0 112.946 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.604 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 66.7 m . . . . . 0 C--O 1.255 1.387 0 CA-C-O 117.764 -1.112 . . . . 0.0 110.659 179.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.483 ' HA ' ' HA ' ' A' ' 46' ' ' PRO . 8.3 mtp180 . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.435 ' O ' ' HE3' ' A' ' 4' ' ' LYS . 2.9 mp0 56.28 48.95 16.16 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 122.501 1.143 . . . . 0.0 109.59 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.9 m -85.65 139.95 30.97 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.256 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 2' ' ' GLU . 17.6 mmtp -88.03 124.04 33.35 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.248 0.547 . . . . 0.0 112.213 -176.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.565 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 26.4 m -152.52 133.39 14.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 178.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -72.41 137.45 46.5 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.702 0.286 . . . . 0.0 110.624 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.566 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.1 t -66.64 137.15 56.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.191 -179.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -87.77 -38.74 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.376 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.9 p -70.48 -27.4 64.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.786 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.644 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 27.0 t80 -61.25 135.51 93.63 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.334 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 49.7 Cg_endo -68.55 50.09 0.53 Allowed 'Trans proline' 0 CA--C 1.537 0.631 0 C-N-CA 123.381 2.721 . . . . 0.0 114.785 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 75.75 -115.88 4.68 Favored Glycine 0 CA--C 1.507 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 114.447 178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.881 HG23 ' HG2' ' A' ' 39' ' ' ARG . 45.9 mm -47.45 127.16 2.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 113.581 -1.309 . . . . 0.0 112.454 -178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.2 t -79.24 124.82 28.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.474 -0.784 . . . . 0.0 110.313 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.1 mp -88.7 -54.17 8.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.122 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.595 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.6 OUTLIER -159.77 -170.34 2.86 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.198 0.523 . . . . 0.0 111.7 179.595 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.609 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 45.8 tptt -67.32 -54.05 21.01 Favored Pre-proline 0 CA--C 1.534 0.357 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.759 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.609 ' HD3' ' HB3' ' A' ' 17' ' ' LYS . 52.5 Cg_exo -50.33 -53.16 7.57 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 122.387 2.058 . . . . 0.0 114.239 -179.239 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.587 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.7 Cg_exo -63.49 -44.31 14.75 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 122.135 1.89 . . . . 0.0 112.545 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 40.4 t -65.99 -43.19 88.5 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.092 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.438 ' O ' HG13 ' A' ' 25' ' ' ILE . 10.9 ttt180 -54.95 -54.42 43.01 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.513 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -62.35 -29.53 70.53 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.849 -0.34 . . . . 0.0 111.866 -178.106 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.41 ' N ' ' HG2' ' A' ' 22' ' ' LYS . . . -64.97 -45.72 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.1 m -61.69 -41.22 97.29 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.628 179.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 21' ' ' ARG . 75.8 mt -65.57 -35.01 74.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.793 -179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m -65.94 -36.05 82.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.769 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.409 ' OE1' ' HE1' ' A' ' 29' ' ' PHE . 74.8 mt-10 -86.33 -145.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.837 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -106.83 61.38 0.63 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.949 0.404 . . . . 0.0 111.281 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.624 ' CE2' ' HE3' ' A' ' 45' ' ' LYS . 91.4 m-85 -130.76 -135.28 0.21 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.307 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -168.53 -31.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -156.13 177.78 11.04 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.61 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.59 -173.81 33.65 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.557 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.1 p-80 -179.42 164.84 1.36 Allowed 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 83.9 m -85.99 122.36 29.93 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 178.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.665 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 35.3 t -70.63 119.76 15.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.97 -0.382 . . . . 0.0 109.97 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -69.13 4.89 1.38 Allowed 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 51.1 mm -80.68 -34.39 14.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 67.3 mt -146.77 -118.52 0.07 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.746 -1.115 . . . . 0.0 109.019 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.881 ' HG2' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -150.9 45.86 0.84 Allowed 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.655 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -115.02 150.2 36.23 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.935 0.398 . . . . 0.0 111.511 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 40.5 t -74.81 95.87 2.99 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.642 178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 17.8 tp -84.12 99.88 10.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.578 -179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 78.0 m -89.78 151.35 21.85 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.232 -178.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 2.5 p -111.98 121.87 46.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.83 178.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.624 ' HE3' ' CE2' ' A' ' 29' ' ' PHE . 14.9 ptpt -113.17 137.61 22.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 111.705 0.261 . . . . 0.0 111.705 -178.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 74.4 Cg_endo -75.34 58.64 5.18 Favored 'Trans proline' 0 N--CA 1.463 -0.275 0 C-N-CA 122.54 2.16 . . . . 0.0 111.325 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.735 -178.991 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.53 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 51.4 ttm-85 . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 110.162 -0.311 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' OE1' ' HG2' ' A' ' 1' ' ' ARG . 2.9 mt-10 64.57 56.24 1.23 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.577 0.703 . . . . 0.0 110.944 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 92.3 m -82.07 138.68 34.77 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 107.313 -1.365 . . . . 0.0 107.313 178.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.16 121.02 30.08 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.375 0.607 . . . . 0.0 112.559 -176.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.516 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 45.3 m -152.94 127.82 9.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.488 ' HA ' ' O ' ' A' ' 41' ' ' CYS . 21.0 pt-20 -71.43 129.51 38.97 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 120.646 -0.422 . . . . 0.0 111.124 -178.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.498 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 33.1 t -35.52 132.26 0.44 Allowed 'General case' 0 N--CA 1.466 0.353 0 O-C-N 124.558 1.161 . . . . 0.0 113.075 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -82.13 -34.12 29.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.694 178.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 35.2 p -79.94 -44.97 19.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.564 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.534 ' HB2' ' CB ' ' A' ' 23' ' ' ALA . 12.1 t80 -75.2 125.89 88.55 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.437 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 70.0 Cg_exo -51.21 147.31 21.1 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.777 2.318 . . . . 0.0 112.414 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.26 42.28 0.51 Allowed Glycine 0 CA--C 1.522 0.473 0 CA-C-N 116.117 -0.492 . . . . 0.0 113.468 -179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.4 mt -139.58 99.47 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' HB3' ' C ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -66.27 132.8 49.22 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.177 -179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 48.0 mm -124.44 -47.91 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.163 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.5 OUTLIER -156.38 164.65 38.03 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.395 -179.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.412 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 47.1 tptt -67.78 -49.95 36.27 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.77 179.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 83.0 Cg_exo -44.85 -54.15 4.47 Favored 'Trans proline' 0 C--N 1.359 1.12 0 C-N-CA 122.621 2.214 . . . . 0.0 114.625 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.673 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.6 Cg_exo -67.43 -44.38 4.73 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 122.004 1.803 . . . . 0.0 112.192 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 18.9 t -60.1 -42.13 94.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.24 179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.42 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.87 -65.18 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.916 179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.425 ' HE2' ' HB3' ' A' ' 22' ' ' LYS . 14.1 ptpt -60.33 -29.77 69.09 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.963 -178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 10' ' ' PHE . . . -60.91 -49.31 77.98 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.077 0.465 . . . . 0.0 110.3 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.629 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.8 m -63.41 -37.67 88.18 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.343 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 77.3 mt -63.65 -42.56 96.47 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.143 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.757 179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.8 m -59.69 -40.34 87.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.462 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 52.8 mt-10 -77.78 -143.69 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.305 178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.505 ' HA ' ' CE ' ' A' ' 28' ' ' LYS . 6.9 mmmt -111.7 49.35 0.9 Allowed 'General case' 0 C--N 1.326 -0.437 0 O-C-N 121.634 -0.666 . . . . 0.0 111.331 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.76 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 59.5 m-85 -119.28 -139.76 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -163.67 -32.72 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.014 0.435 . . . . 0.0 110.032 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -148.75 171.07 16.83 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.629 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -164.11 152.48 22.33 Favored Glycine 0 N--CA 1.437 -1.252 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.5 p-80 -156.42 160.09 39.3 Favored 'General case' 0 C--N 1.303 -1.436 0 CA-C-O 121.032 0.444 . . . . 0.0 111.105 -178.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 36.1 t -86.24 133.34 33.84 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.781 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.504 ' HB3' ' O ' ' A' ' 38' ' ' LEU . 41.0 t -70.7 141.65 51.56 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.119 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -84.67 28.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.975 0.417 . . . . 0.0 110.901 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 27.9 mm -146.79 -47.05 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.504 ' O ' ' HB3' ' A' ' 35' ' ' SER . 90.4 mt -111.54 138.0 48.64 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.153 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 45.4 ttp180 -85.23 59.68 5.78 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.725 0.774 . . . . 0.0 109.751 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 15.0 mmm180 -125.34 151.04 46.58 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 114.844 -1.071 . . . . 0.0 109.623 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.488 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 26.6 t -87.08 93.15 9.28 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.01 0.433 . . . . 0.0 110.293 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mp -77.41 102.36 6.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.61 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.522 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 79.0 m -89.73 146.38 24.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.407 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.498 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -108.98 126.09 52.74 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 177.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.76 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 44.4 pttt -120.55 151.72 54.43 Favored Pre-proline 0 CA--C 1.513 -0.469 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -60.99 130.29 32.12 Favored 'Trans proline' 0 N--CA 1.456 -0.682 0 C-N-CA 122.32 2.014 . . . . 0.0 108.623 176.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.53 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 26.4 p . . . . . 0 C--N 1.313 -0.982 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -177.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.507 ' HG3' ' HA ' ' A' ' 46' ' ' PRO . 1.4 ttm180 . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 66.66 59.61 0.59 Allowed 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.723 0.773 . . . . 0.0 110.625 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 44' ' ' THR . 68.4 m -85.17 123.78 31.08 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HD3' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -87.36 111.35 21.0 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.578 -177.864 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -138.37 141.08 39.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.154 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -66.5 139.43 57.95 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.431 ' HB3' ' HB2' ' A' ' 10' ' ' PHE . 8.0 t -67.2 114.69 6.13 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.347 -178.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.36 -27.95 31.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.447 179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -22.3 59.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.438 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.574 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 5.9 t80 -65.68 131.38 94.73 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.873 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.474 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 9.3 Cg_endo -53.31 -34.22 69.37 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 123.763 2.975 . . . . 0.0 114.74 -178.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 176.03 -128.14 1.33 Allowed Glycine 0 CA--C 1.504 -0.611 0 C-N-CA 119.651 -1.262 . . . . 0.0 113.664 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 48.3 mm -58.41 136.26 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.914 0 CA-C-N 114.269 -0.966 . . . . 0.0 111.068 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.574 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 16.3 t -68.95 132.43 46.68 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.997 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.9 mm -119.95 -45.0 2.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.433 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.678 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.93 161.91 40.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.152 -179.668 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.92 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.1 tmtp? -69.45 -48.08 25.48 Favored Pre-proline 0 CA--C 1.539 0.555 0 CA-C-O 119.038 -0.506 . . . . 0.0 111.826 -179.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.678 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 78.6 Cg_exo -44.32 -54.71 3.73 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 122.451 2.101 . . . . 0.0 114.319 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.654 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 17.1 Cg_exo -66.83 -35.5 27.02 Favored 'Trans proline' 0 C--N 1.359 1.088 0 C-N-CA 121.75 1.633 . . . . 0.0 111.044 179.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.8 t -60.75 -47.11 87.78 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.221 178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.92 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 6.4 ttt180 -61.76 -38.1 86.75 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.431 178.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -61.33 -42.73 99.17 Favored 'General case' 0 N--CA 1.433 -1.291 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.598 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.67 87.8 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.182 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 29' ' ' PHE . 60.5 m -61.53 -44.4 97.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.277 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 21' ' ' ARG . 83.6 mt -66.24 -43.54 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.738 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -34.09 72.49 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.492 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 1.2 tm-20 -74.94 -83.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 4.2 mtmm 178.63 40.75 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.449 0 O-C-N 123.672 0.608 . . . . 0.0 110.595 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.583 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 42.6 m-85 -109.06 -172.23 2.01 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 179.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.93 ' HB ' ' HG3' ' A' ' 46' ' ' PRO . 15.3 t -121.39 -29.72 4.4 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.088 0.47 . . . . 0.0 109.94 179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -157.98 -163.97 1.42 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.473 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.12 -168.0 34.43 Favored Glycine 0 N--CA 1.438 -1.188 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 p-80 -176.36 149.44 0.83 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 9.0 t -87.27 135.2 33.4 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.5 t -63.12 124.91 22.36 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 -179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -84.62 28.71 0.65 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.132 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.462 ' HB ' HD22 ' A' ' 38' ' ' LEU . 37.1 mm -138.07 -47.88 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.462 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.8 mm? -104.24 -141.51 0.36 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 26.9 ptt180 -151.97 53.65 0.82 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.364 0.602 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.514 ' HG3' HH11 ' A' ' 40' ' ' ARG . 36.7 mmm-85 -126.1 153.99 43.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.966 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 17.0 t -85.12 111.58 19.91 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.533 ' HB3' ' HD3' ' A' ' 4' ' ' LYS . 9.4 mp -95.89 103.53 15.42 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 90.5 m -89.11 152.16 21.8 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.261 0.553 . . . . 0.0 112.29 -179.023 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.499 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.2 p -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.679 179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.63 144.14 28.44 Favored Pre-proline 0 N--CA 1.466 0.334 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.93 ' HG3' ' HB ' ' A' ' 30' ' ' THR . 6.6 Cg_exo -71.15 60.98 2.49 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 123.667 2.911 . . . . 0.0 112.514 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 8.5 p . . . . . 0 C--O 1.25 1.084 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.981 179.479 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 110.675 -0.12 . . . . 0.0 110.675 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 70.56 54.69 0.28 Allowed 'General case' 0 C--N 1.341 0.2 0 O-C-N 123.769 0.668 . . . . 0.0 111.619 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.59 ' O ' ' HA ' ' A' ' 44' ' ' THR . 65.9 m -85.86 137.72 32.56 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.9 mmtt -87.54 125.35 34.28 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.966 0.413 . . . . 0.0 110.804 -177.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 62.4 m -152.04 138.02 18.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.668 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.8 tt0 -66.2 133.88 51.55 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.046 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 39.8 t -64.04 133.02 52.29 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.193 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -85.32 -36.08 21.04 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.394 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 40.0 p -74.59 -33.42 62.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.007 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.669 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 12.6 t80 -66.56 135.31 94.54 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.418 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -69.26 49.53 0.62 Allowed 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 123.32 2.68 . . . . 0.0 114.582 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 78.41 -120.47 5.4 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.411 -0.899 . . . . 0.0 114.562 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.672 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.5 mp -44.75 129.99 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 113.56 -1.32 . . . . 0.0 112.259 -178.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.604 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 14.0 p -70.91 124.35 24.15 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.427 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 49.0 mm -99.6 -50.85 10.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.142 -179.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.645 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.6 164.37 34.47 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.366 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 2.9 tmtp? -69.8 -48.92 21.69 Favored Pre-proline 0 CA--C 1.54 0.561 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.911 -179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.698 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.2 Cg_exo -45.65 -54.8 4.11 Favored 'Trans proline' 0 C--N 1.36 1.155 0 C-N-CA 122.526 2.151 . . . . 0.0 114.243 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.698 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 26.0 Cg_exo -63.41 -38.47 42.71 Favored 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 121.851 1.701 . . . . 0.0 111.699 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.5 t -61.51 -43.02 99.61 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.434 ' O ' HG13 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -57.97 -45.23 87.05 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.103 178.276 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.833 ' HA ' ' HE3' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -65.76 -42.72 90.56 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 114.887 -1.051 . . . . 0.0 112.099 -178.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.65 -48.05 82.36 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.988 0.423 . . . . 0.0 110.992 -179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.803 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 37.4 m -60.68 -39.09 87.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.51 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 21' ' ' ARG . 91.9 mt -69.9 -34.51 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 16.8 m -66.6 -37.24 84.47 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.196 0.522 . . . . 0.0 109.874 179.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -88.75 -175.38 4.88 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.089 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -84.29 66.0 9.14 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.966 0.412 . . . . 0.0 111.525 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.598 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 89.6 m-85 -134.5 -143.37 0.2 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -166.03 -41.74 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.777 0.323 . . . . 0.0 110.256 179.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.658 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 33.1 t70 -126.09 168.87 13.4 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.803 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -168.08 154.36 24.27 Favored Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 11.8 p-80 -168.5 174.4 6.88 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -177.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 8.4 t -86.67 133.7 33.67 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.454 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 48.2 t -70.11 140.77 52.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.982 0.42 . . . . 0.0 111.438 -178.288 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -82.77 35.99 0.48 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.27 0.557 . . . . 0.0 110.611 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 83.1 mt -148.87 -47.57 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 97.4 mt -119.97 136.91 54.36 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 114.931 -1.032 . . . . 0.0 108.512 178.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.63 ' O ' ' HA ' ' A' ' 13' ' ' ILE . 47.9 ttt85 -84.79 68.45 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.681 0.753 . . . . 0.0 110.382 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -141.63 161.32 38.21 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.916 179.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 48.7 t -71.94 104.04 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.418 0.628 . . . . 0.0 110.33 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 27.3 tp -90.37 100.34 13.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.212 -0.904 . . . . 0.0 108.928 179.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 72.7 m -89.09 148.4 23.71 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.278 -179.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.658 ' OG1' ' HB3' ' A' ' 31' ' ' ASP . 19.2 p -113.89 126.11 54.8 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 178.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 32.7 pttt -107.39 146.41 33.22 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 -177.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 6.6 Cg_exo -72.4 61.3 3.43 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 123.939 3.093 . . . . 0.0 111.561 178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.319 -0.753 0 CA-C-N 114.86 -1.064 . . . . 0.0 110.652 -179.787 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.504 ' HB3' ' OE1' ' A' ' 2' ' ' GLU . 9.9 mtp180 . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 111.442 0.164 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.504 ' OE1' ' HB3' ' A' ' 1' ' ' ARG . 15.4 mp0 61.58 52.9 3.47 Favored 'General case' 0 C--O 1.236 0.377 0 O-C-N 123.844 0.715 . . . . 0.0 111.61 178.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 44' ' ' THR . 32.7 m -85.8 139.47 31.28 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -87.34 129.94 34.82 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.553 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 22.4 m -149.1 141.94 24.65 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.724 -179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -64.51 139.3 58.75 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.735 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.516 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 29.3 p -61.48 110.01 1.34 Allowed 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.852 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -88.03 -43.9 11.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.03 179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.436 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 0.9 OUTLIER -73.74 -30.06 62.6 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.315 -179.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.505 ' HE1' ' HB2' ' A' ' 19' ' ' PRO . 11.9 t80 -72.68 109.67 6.58 Favored Pre-proline 0 N--CA 1.463 0.219 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.436 ' HD3' ' O ' ' A' ' 9' ' ' THR . 83.2 Cg_endo -92.7 55.24 0.54 Allowed 'Trans proline' 0 N--CA 1.456 -0.723 0 C-N-CA 123.101 2.534 . . . . 0.0 113.299 -178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -177.21 166.76 37.55 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.026 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 43.5 mm -70.87 149.22 10.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.2 t -61.97 116.03 4.56 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.005 0.431 . . . . 0.0 111.25 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.3 mp -131.05 -40.57 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.592 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.88 144.64 45.69 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.038 0.447 . . . . 0.0 111.663 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.508 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 0.0 OUTLIER -70.41 -49.52 16.46 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.715 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.714 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 76.2 Cg_exo -45.75 -55.53 3.52 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 122.584 2.19 . . . . 0.0 114.546 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.714 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.6 Cg_exo -64.24 -42.14 18.97 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 121.825 1.684 . . . . 0.0 111.893 179.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -58.88 -44.21 91.06 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.443 178.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.578 ' O ' HG13 ' A' ' 25' ' ' ILE . 31.7 ttt-85 -64.15 -48.69 75.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.568 178.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.841 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -59.86 -45.68 91.7 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.991 -177.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.87 96.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 110.723 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 91.2 m -65.81 -35.58 81.1 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.99 -179.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.578 HG13 ' O ' ' A' ' 21' ' ' ARG . 88.5 mt -60.9 -36.91 75.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 33.3 m -68.06 -34.28 76.14 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.725 178.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 4.3 tm-20 -67.29 -77.48 0.07 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 27' ' ' GLU . 3.6 mtmm 179.1 34.69 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.401 0 O-C-N 123.814 0.696 . . . . 0.0 110.478 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 71.8 m-85 -105.93 -139.27 0.37 Allowed 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.7 t -166.87 -38.68 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -141.65 173.07 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -168.56 167.28 40.2 Favored Glycine 0 N--CA 1.442 -0.901 0 N-CA-C 111.476 -0.65 . . . . 0.0 111.476 179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -167.47 -176.61 3.27 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.16 135.02 33.79 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 177.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.507 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 40.7 t -70.11 135.7 49.46 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.825 0.345 . . . . 0.0 110.429 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' HD3' HG13 ' A' ' 37' ' ' ILE . 0.1 OUTLIER -79.6 40.3 0.44 Allowed 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.957 0.408 . . . . 0.0 111.804 -179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.501 HG13 ' HD3' ' A' ' 36' ' ' LYS . 80.4 mt -146.39 -42.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.415 ' HB3' ' HD3' ' A' ' 40' ' ' ARG . 96.1 mt -136.86 151.0 48.6 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.063 -0.971 . . . . 0.0 108.47 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -83.92 70.68 10.47 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.973 0.892 . . . . 0.0 110.577 -178.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.415 ' HD3' ' HB3' ' A' ' 38' ' ' LEU . 0.1 OUTLIER -135.98 151.33 49.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.074 178.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 7' ' ' SER . 10.8 t -70.23 111.03 5.55 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.659 0.743 . . . . 0.0 110.789 -179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.507 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 16.7 tp -105.92 105.71 15.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.247 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.606 ' HA ' ' HA2' ' A' ' 32' ' ' GLY . 87.2 m -101.39 160.59 14.29 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -177.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.533 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.2 p -117.58 123.37 46.05 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.777 -1.102 . . . . 0.0 110.392 179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 29' ' ' PHE . 17.2 ptpt -111.5 143.47 28.59 Favored Pre-proline 0 C--N 1.33 -0.271 0 C-N-CA 121.024 -0.27 . . . . 0.0 111.523 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 12.2 Cg_exo -70.04 61.49 1.89 Allowed 'Trans proline' 0 C--N 1.347 0.5 0 C-N-CA 123.848 3.032 . . . . 0.0 112.213 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 13.5 p . . . . . 0 C--O 1.254 1.291 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.967 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? . . . . . 0 N--CA 1.481 1.087 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 72.09 49.79 0.23 Allowed 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 122.178 0.989 . . . . 0.0 110.25 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.521 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.4 m -89.05 136.11 33.19 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.321 -0.854 . . . . 0.0 108.714 178.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mppt? -87.46 122.21 30.89 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.013 0.435 . . . . 0.0 110.653 -179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.524 ' HB ' ' HE1' ' A' ' 29' ' ' PHE . 10.7 m -150.78 139.98 21.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.355 -179.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' HB2' HH21 ' A' ' 40' ' ' ARG . 35.6 tp10 -70.08 138.62 52.19 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.65 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 45.7 t -70.58 129.51 39.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.941 0.401 . . . . 0.0 110.767 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -83.71 -30.12 26.99 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.869 179.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 39.7 p -79.93 -23.31 41.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.83 -179.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.713 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 39.1 t80 -61.89 125.52 85.19 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.929 0.395 . . . . 0.0 110.671 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -83.08 119.84 2.88 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.518 2.145 . . . . 0.0 114.126 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 65.15 -152.3 51.22 Favored Glycine 0 N--CA 1.452 -0.265 0 CA-C-N 115.341 -0.845 . . . . 0.0 115.057 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 45.8 mm -77.67 146.63 8.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 114.628 -0.786 . . . . 0.0 110.983 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.713 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 5.7 t -55.28 118.45 4.41 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.142 179.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -89.85 -50.2 13.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.294 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.737 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -154.93 178.96 9.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.56 179.881 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.2 tmmm? -71.79 -48.95 11.16 Favored Pre-proline 0 CA--C 1.54 0.578 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.859 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.737 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 71.2 Cg_exo -46.61 -53.56 5.94 Favored 'Trans proline' 0 C--N 1.36 1.157 0 C-N-CA 122.533 2.155 . . . . 0.0 114.447 -179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.64 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 24.2 Cg_exo -63.76 -39.62 33.24 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.737 1.625 . . . . 0.0 111.713 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 47.2 t -61.58 -42.79 99.36 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.257 -0.645 . . . . 0.0 109.257 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.591 HH11 ' HG2' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -54.14 -45.92 72.09 Favored 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.665 0.745 . . . . 0.0 109.863 178.278 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.86 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.7 OUTLIER -64.51 -44.18 91.72 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.528 -1.214 . . . . 0.0 112.16 -178.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.419 ' HB1' ' OG ' ' A' ' 7' ' ' SER . . . -58.22 -49.48 76.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 123.476 0.485 . . . . 0.0 111.343 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.809 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 15.0 m -58.35 -41.97 85.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.253 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 21' ' ' ARG . 95.4 mt -65.98 -37.47 79.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.207 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.2 m -62.73 -43.85 97.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.879 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' C ' ' HD2' ' A' ' 28' ' ' LYS . 49.2 mt-10 -79.65 -149.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.186 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.568 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 6.8 mmmt -108.13 55.46 0.64 Allowed 'General case' 0 C--O 1.237 0.396 0 O-C-N 121.798 -0.564 . . . . 0.0 112.067 -178.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.794 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 95.4 m-85 -115.76 -144.8 0.39 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -162.01 -34.4 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.5 ' HB3' ' OG1' ' A' ' 44' ' ' THR . 6.6 t70 -139.51 171.83 13.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.809 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -173.31 156.38 24.28 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -167.08 165.72 15.49 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.336 -0.432 . . . . 0.0 110.175 -178.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.8 t -85.81 124.6 32.48 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 107.351 -1.352 . . . . 0.0 107.351 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.436 ' HB2' ' HB2' ' A' ' 42' ' ' LEU . 16.4 t -64.78 120.61 12.8 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.941 0.401 . . . . 0.0 110.524 -177.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.513 ' H ' ' HD3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -74.29 46.88 0.27 Allowed 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 115.515 -0.766 . . . . 0.0 113.0 -177.875 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.8 pt -152.64 11.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.674 0.75 . . . . 0.0 109.469 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.544 ' HG ' ' H ' ' A' ' 39' ' ' ARG . 16.0 tp -174.96 -137.53 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.253 -1.339 . . . . 0.0 108.301 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.544 ' H ' ' HG ' ' A' ' 38' ' ' LEU . 34.8 ttt85 -151.5 56.45 0.87 Allowed 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.567 HH21 ' HB2' ' A' ' 6' ' ' GLU . 16.9 ptm180 -121.47 150.96 40.81 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.83 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.4 t -81.41 85.42 6.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.544 0.688 . . . . 0.0 110.088 179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 35' ' ' SER . 13.4 tp -77.54 95.56 4.55 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.744 -179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.65 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 96.3 m -88.86 147.43 24.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 47.0 p -117.04 124.59 49.66 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 178.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.794 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 6.7 ptmm? -111.57 145.73 33.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.85 57.28 4.42 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.282 2.655 . . . . 0.0 111.683 179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 4.4 p . . . . . 0 C--N 1.321 -0.635 0 CA-C-N 114.637 -1.165 . . . . 0.0 111.105 -179.771 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.585 ' HA ' ' N ' ' A' ' 47' ' ' CYS . 16.4 ptm180 . . . . . 0 N--CA 1.478 0.972 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 66.5 51.0 1.18 Allowed 'General case' 0 N--CA 1.454 -0.256 0 O-C-N 124.027 0.829 . . . . 0.0 111.264 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.664 ' O ' ' HA ' ' A' ' 44' ' ' THR . 77.2 m -86.21 127.43 34.74 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 177.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -86.49 125.59 33.84 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.278 0.561 . . . . 0.0 111.357 -177.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.475 ' HB ' ' HE2' ' A' ' 29' ' ' PHE . 22.9 m -150.37 130.81 13.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.119 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.96 134.29 54.79 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.782 0.325 . . . . 0.0 110.343 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.653 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 17.2 t -73.0 110.97 7.69 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.684 -179.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -81.35 -35.0 31.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.475 0.655 . . . . 0.0 109.256 179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -22.27 66.19 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.822 -1.081 . . . . 0.0 111.736 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.58 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 50.3 t80 -63.0 132.17 94.96 Favored Pre-proline 0 CA--C 1.534 0.357 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 10' ' ' PHE . 45.0 Cg_exo -37.41 -40.95 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.662 3.575 . . . . 0.0 115.944 -177.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.9 -129.59 1.82 Allowed Glycine 0 CA--C 1.5 -0.845 0 C-N-CA 119.912 -1.137 . . . . 0.0 112.631 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 68.1 mt -59.97 128.7 21.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 114.79 -0.705 . . . . 0.0 109.391 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.58 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 8.8 t -67.57 118.99 11.62 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.98 0.419 . . . . 0.0 111.221 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -93.47 -46.24 13.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.784 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.718 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.39 166.52 25.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.634 179.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 32' ' ' GLY . 1.5 tmtp? -70.51 -48.04 17.77 Favored Pre-proline 0 CA--C 1.539 0.554 0 CA-C-N 115.828 -0.623 . . . . 0.0 112.194 -179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.718 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 85.7 Cg_exo -45.17 -52.63 6.24 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 122.625 2.216 . . . . 0.0 114.286 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.641 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 33.5 Cg_exo -60.68 -40.94 50.95 Favored 'Trans proline' 0 C--N 1.361 1.216 0 C-N-CA 122.045 1.83 . . . . 0.0 111.678 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.0 t -63.55 -42.44 98.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.004 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.677 HH11 HD11 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -54.7 -55.89 25.0 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 0.0 112.118 -179.228 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.426 ' HB3' ' HE2' ' A' ' 22' ' ' LYS . 0.0 OUTLIER -67.16 -26.09 66.48 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -178.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.61 -44.39 96.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.332 0.587 . . . . 0.0 109.559 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.63 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 19.9 m -66.06 -39.94 90.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.989 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.677 HD11 HH11 ' A' ' 21' ' ' ARG . 62.5 mt -65.77 -43.49 93.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.253 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.6 m -63.94 -32.42 73.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.551 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.522 ' HA ' ' OE1' ' A' ' 27' ' ' GLU . 3.0 mm-40 -82.37 -132.7 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.266 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.514 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 6.6 mptt -121.98 60.02 0.98 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.098 0.475 . . . . 0.0 110.468 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 45' ' ' LYS . 64.0 m-85 -141.25 -140.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -164.03 -37.75 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -132.66 169.92 15.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 178.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.63 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -167.01 155.41 26.53 Favored Glycine 0 N--CA 1.437 -1.29 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -158.84 152.82 23.52 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.023 0.44 . . . . 0.0 111.102 -178.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -86.93 135.32 33.35 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.0 t -68.86 123.46 21.03 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 -179.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -78.05 46.76 0.61 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.2 0.524 . . . . 0.0 111.171 -179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 32.5 mm -144.37 -44.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 51.7 mt -124.38 -133.84 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.119 -0.946 . . . . 0.0 108.93 178.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.404 ' C ' ' HB3' ' A' ' 14' ' ' CYS . 41.7 mtt-85 -150.82 65.68 0.92 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.412 0.625 . . . . 0.0 111.114 179.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -129.5 150.59 50.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.454 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 41.6 t -87.46 106.64 18.11 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.149 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.2 mp -94.54 101.31 13.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.718 179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 86.5 m -89.19 152.99 21.29 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.033 -179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.664 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 1.9 p -128.65 121.52 28.78 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.01 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HG2' ' HB2' ' A' ' 3' ' ' CYS . 19.2 ptpt -101.59 142.09 23.89 Favored Pre-proline 0 N--CA 1.466 0.356 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.984 -178.185 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -76.91 64.27 7.66 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 123.111 2.54 . . . . 0.0 112.836 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.588 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 67.8 m . . . . . 0 C--O 1.24 0.597 0 CA-C-O 118.74 -0.648 . . . . 0.0 110.811 179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.576 ' HA ' ' H ' ' A' ' 47' ' ' CYS . 12.6 ptm180 . . . . . 0 N--CA 1.48 1.066 0 N-CA-C 110.582 -0.155 . . . . 0.0 110.582 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.404 ' CD ' ' HE ' ' A' ' 1' ' ' ARG . 11.8 mp0 69.04 52.21 0.51 Allowed 'General case' 0 C--O 1.233 0.197 0 O-C-N 123.882 0.738 . . . . 0.0 110.382 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HA ' ' A' ' 44' ' ' THR . 56.2 m -83.9 136.57 34.04 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.76 116.7 26.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.696 -177.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.546 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 15.9 m -151.92 126.97 9.74 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.666 ' HG3' ' HD3' ' A' ' 40' ' ' ARG . 17.2 pm0 -72.61 123.47 23.29 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 121.185 -0.206 . . . . 0.0 111.27 -178.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.535 ' HB2' ' SG ' ' A' ' 43' ' ' CYS . 43.5 t -35.96 127.87 0.7 Allowed 'General case' 0 C--O 1.237 0.418 0 O-C-N 124.097 0.873 . . . . 0.0 111.947 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -80.9 -32.53 34.77 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.366 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 28.4 p -76.39 -43.69 39.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.867 -179.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.611 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 19.2 t80 -35.1 113.01 0.46 Allowed Pre-proline 0 N--CA 1.472 0.648 0 O-C-N 124.147 0.905 . . . . 0.0 111.999 -179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -87.34 135.62 3.76 Favored 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.781 2.321 . . . . 0.0 114.526 -178.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 71.21 -152.67 50.15 Favored Glycine 0 N--CA 1.451 -0.328 0 CA-C-N 115.169 -0.923 . . . . 0.0 114.824 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.7 143.79 10.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 114.699 -0.751 . . . . 0.0 110.211 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.611 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 35.1 t -64.82 131.1 45.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.162 179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.8 mm -111.19 -49.91 6.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.769 -179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.652 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.9 OUTLIER -145.4 -178.74 6.23 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -178.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 40.7 tptt -72.99 -52.24 5.75 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 114.811 -1.086 . . . . 0.0 112.514 -179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.661 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 54.4 Cg_exo -49.31 -54.96 4.63 Favored 'Trans proline' 0 C--N 1.357 1.023 0 C-N-CA 122.505 2.137 . . . . 0.0 114.465 -178.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.661 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 29.2 Cg_exo -62.48 -40.02 41.7 Favored 'Trans proline' 0 C--N 1.36 1.169 0 C-N-CA 121.782 1.655 . . . . 0.0 111.874 179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -60.92 -65.12 0.74 Allowed 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.43 ' O ' HG13 ' A' ' 25' ' ' ILE . 3.4 ttt180 -38.96 -50.44 1.76 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.182 177.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.851 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -58.21 -46.04 86.57 Favored 'General case' 0 N--CA 1.434 -1.227 0 CA-C-N 114.432 -1.258 . . . . 0.0 112.757 -177.397 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.07 91.84 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.347 0.405 . . . . 0.0 110.453 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.479 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 4.2 m -57.36 -46.35 83.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.003 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 21' ' ' ARG . 82.4 mt -64.25 -40.31 88.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.27 -179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.6 m -61.24 -42.14 98.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -67.24 -90.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.182 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.414 ' H ' ' HD1' ' A' ' 29' ' ' PHE . 1.5 tppt? -169.65 43.48 0.03 OUTLIER 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.807 0.813 . . . . 0.0 110.018 179.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.844 ' CD2' ' HB3' ' A' ' 45' ' ' LYS . 9.1 m-85 -114.66 -139.1 0.37 Allowed 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.642 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -160.98 -31.13 0.05 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.02 0.438 . . . . 0.0 110.057 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -150.09 172.02 15.93 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 179.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.513 ' HA2' ' HA ' ' A' ' 43' ' ' CYS . . . -166.63 158.75 31.85 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -158.96 156.67 29.88 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-O 121.051 0.453 . . . . 0.0 110.877 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -86.24 129.57 34.8 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.772 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.5 t -60.49 135.78 57.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.611 -179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 2.4 mptp? -86.71 30.38 0.74 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 111.518 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.459 ' HB ' HD22 ' A' ' 38' ' ' LEU . 38.1 mm -140.68 -54.22 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 N-CA-C 108.023 -1.102 . . . . 0.0 108.023 178.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.459 HD22 ' HB ' ' A' ' 37' ' ' ILE . 1.6 mm? -95.71 -148.44 0.29 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 178.079 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.49 55.83 0.86 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.027 0.918 . . . . 0.0 109.532 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HD3' ' HG3' ' A' ' 6' ' ' GLU . 30.0 ttm-85 -130.28 148.38 52.1 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.604 -1.18 . . . . 0.0 109.975 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 6' ' ' GLU . 30.2 t -77.2 104.64 7.82 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.741 -179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mp -89.51 101.97 14.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.535 ' SG ' ' HB2' ' A' ' 7' ' ' SER . 69.7 m -91.03 150.05 21.59 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.266 0.555 . . . . 0.0 112.235 -178.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.495 ' O ' ' HB3' ' A' ' 29' ' ' PHE . 1.9 p -116.62 128.1 55.08 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.844 ' HB3' ' CD2' ' A' ' 29' ' ' PHE . 10.9 ptmm? -125.77 151.96 71.71 Favored Pre-proline 0 CA--C 1.515 -0.371 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -176.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -60.67 136.39 66.48 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.359 2.039 . . . . 0.0 108.083 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.576 ' H ' ' HA ' ' A' ' 1' ' ' ARG . 23.9 p . . . . . 0 C--O 1.254 1.318 0 CA-C-O 117.422 -1.275 . . . . 0.0 109.037 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 . . . . . 0 N--CA 1.486 1.333 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.778 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 11.0 mp0 -120.33 17.44 12.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.762 0.791 . . . . 0.0 111.564 -177.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 44' ' ' THR . 2.0 m -150.86 115.2 5.11 Favored 'General case' 0 C--N 1.305 -1.351 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.185 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.6 tmmm? -91.4 121.87 33.5 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.415 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 12.0 m -145.46 139.59 26.96 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 -179.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -66.14 137.1 56.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.3 t -75.39 79.78 2.45 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.955 0.407 . . . . 0.0 110.174 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -63.43 -29.75 70.99 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.417 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -27.07 68.16 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.579 178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.653 ' CE2' ' HA ' ' A' ' 14' ' ' CYS . 42.7 t80 -70.54 133.98 86.7 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.325 179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 10' ' ' PHE . 30.8 Cg_exo -62.22 56.97 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 124.29 3.327 . . . . 0.0 115.333 -178.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 82.74 -132.75 11.33 Favored Glycine 0 N--CA 1.452 -0.284 0 N-CA-C 115.077 0.791 . . . . 0.0 115.077 177.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.551 HG23 ' HB2' ' A' ' 39' ' ' ARG . 81.7 mt -55.34 137.23 16.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 113.974 -1.113 . . . . 0.0 112.114 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.653 ' HA ' ' CE2' ' A' ' 10' ' ' PHE . 7.8 p -71.79 123.0 21.67 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.074 0.464 . . . . 0.0 109.887 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 50.4 mm -98.44 -47.7 12.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.074 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.742 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -150.52 174.01 13.44 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.31 -179.551 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HB3' ' HD3' ' A' ' 18' ' ' PRO . 1.4 tmmt? -69.68 -49.68 20.47 Favored Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.131 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.742 ' HD2' ' HB ' ' A' ' 16' ' ' THR . 77.4 Cg_exo -46.69 -54.64 4.62 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 122.389 2.059 . . . . 0.0 114.16 -179.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.67 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 23.9 Cg_exo -64.27 -40.17 26.72 Favored 'Trans proline' 0 C--N 1.357 1.002 0 C-N-CA 121.892 1.728 . . . . 0.0 112.166 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.5 t -60.15 -47.46 85.83 Favored 'General case' 0 N--CA 1.463 0.193 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.573 ' NH1' ' HA ' ' A' ' 31' ' ' ASP . 10.3 mmt180 -61.1 -43.29 99.11 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.87 178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.895 ' HE2' ' HA ' ' A' ' 22' ' ' LYS . 0.6 OUTLIER -64.13 -40.71 96.76 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.593 -178.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.53 -45.43 91.8 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 123.382 0.426 . . . . 0.0 110.546 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.605 ' SG ' ' HA3' ' A' ' 32' ' ' GLY . 57.2 m -60.86 -43.06 98.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.703 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 21' ' ' ARG . 76.8 mt -68.14 -33.31 60.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.309 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 m -64.09 -37.84 88.91 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.076 0.465 . . . . 0.0 110.231 179.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.625 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 0.1 OUTLIER -83.91 -149.52 0.1 Allowed 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.417 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.621 ' HG2' ' OE1' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -105.48 32.21 4.44 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 121.784 -0.573 . . . . 0.0 110.707 -179.206 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 27' ' ' GLU . 75.9 m-85 -95.27 -139.95 0.25 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.7 t -179.84 -41.39 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.573 ' HA ' ' NH1' ' A' ' 21' ' ' ARG . 34.3 m-20 -118.75 153.72 33.96 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.516 179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.605 ' HA3' ' SG ' ' A' ' 24' ' ' CYS . . . -163.68 164.05 36.1 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.465 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 26.2 p-80 -171.43 149.83 2.76 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.3 t -86.71 135.11 33.5 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.2 t -60.76 145.93 47.87 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.262 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.14 30.49 1.09 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.338 0.59 . . . . 0.0 110.333 179.308 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.3 mm -149.16 -51.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 178.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 92.3 mt -96.9 132.91 42.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.802 178.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.551 ' HB2' HG23 ' A' ' 13' ' ' ILE . 26.0 ptt180 -86.2 60.41 6.21 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-O 121.776 0.798 . . . . 0.0 110.644 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.444 ' HG3' HH11 ' A' ' 40' ' ' ARG . 28.2 mmm-85 -139.26 152.47 47.31 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.885 -1.052 . . . . 0.0 109.697 179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 51.3 t -78.99 118.56 21.1 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.777 179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 11.2 mp -99.56 103.18 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -89.57 152.34 21.46 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.083 -179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.545 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 25.3 p -131.59 118.91 20.73 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 178.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.618 ' CB ' ' HA ' ' A' ' 29' ' ' PHE . 18.1 ptpt -106.01 160.57 25.69 Favored Pre-proline 0 C--N 1.326 -0.414 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -177.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.778 ' HA ' ' OE1' ' A' ' 2' ' ' GLU . 48.3 Cg_endo -68.45 140.99 49.6 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.53 2.154 . . . . 0.0 110.186 178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.849 -178.991 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.551 ' HD2' ' O ' ' A' ' 47' ' ' CYS . 6.6 mpt_? . . . . . 0 N--CA 1.483 1.192 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.434 ' HA ' ' HB ' ' A' ' 44' ' ' THR . 22.4 tt0 66.02 55.71 0.9 Allowed 'General case' 0 CA--C 1.531 0.221 0 O-C-N 123.782 0.676 . . . . 0.0 111.781 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.702 ' O ' ' HA ' ' A' ' 44' ' ' THR . 79.9 m -87.55 135.99 33.13 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.653 ' HD3' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -85.57 125.1 32.84 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.47 0.653 . . . . 0.0 111.348 -177.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.637 ' HB ' ' CE2' ' A' ' 29' ' ' PHE . 8.7 m -146.61 148.1 31.75 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.354 -0.839 . . . . 0.0 108.794 178.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.3 138.04 58.24 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.626 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.1 p -65.5 110.14 2.59 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 121.037 0.446 . . . . 0.0 110.892 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -90.05 41.41 1.05 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.678 0.752 . . . . 0.0 109.119 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -155.47 -41.4 0.08 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.637 -178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.575 ' HE2' ' HA ' ' A' ' 14' ' ' CYS . 1.2 t80 -69.52 126.15 92.42 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.742 0.306 . . . . 0.0 110.544 -179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -58.79 -37.37 94.25 Favored 'Trans proline' 0 N--CA 1.474 0.371 0 C-N-CA 123.697 2.931 . . . . 0.0 114.791 -178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -168.72 -128.36 0.99 Allowed Glycine 0 CA--C 1.505 -0.537 0 C-N-CA 119.572 -1.299 . . . . 0.0 113.802 -178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.2 mm -54.64 140.44 12.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 114.266 -0.967 . . . . 0.0 110.883 -179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.575 ' HA ' ' HE2' ' A' ' 10' ' ' PHE . 10.8 t -77.1 116.4 17.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.889 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 mp -87.18 -46.43 16.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.644 ' HB ' ' HD2' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -148.51 162.3 39.92 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.461 179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.889 ' HE2' ' HG3' ' A' ' 21' ' ' ARG . 1.6 tmtp? -66.74 -50.04 46.66 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-O 119.253 -0.403 . . . . 0.0 111.775 -179.278 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.646 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 71.3 Cg_exo -44.73 -54.24 4.33 Favored 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.521 2.147 . . . . 0.0 114.276 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 18' ' ' PRO . 20.0 Cg_exo -66.52 -39.28 16.72 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.949 1.766 . . . . 0.0 111.753 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 42.2 t -61.43 -45.76 92.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.889 ' HG3' ' HE2' ' A' ' 17' ' ' LYS . 10.0 ttt180 -60.74 -40.85 93.96 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.02 178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -60.37 -43.02 96.96 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.671 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -64.3 -40.78 96.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.195 178.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 63.5 m -65.12 -41.44 94.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.02 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 21' ' ' ARG . 92.0 mt -66.45 -35.67 75.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.398 179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.8 m -64.63 -35.03 79.69 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.223 0.535 . . . . 0.0 110.098 179.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CD1' ' A' ' 29' ' ' PHE . 1.6 tm-20 -86.32 -158.82 0.43 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.24 179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.455 ' HZ2' ' HB2' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -97.49 64.52 1.85 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.005 0.431 . . . . 0.0 110.849 179.639 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.637 ' CE2' ' HB ' ' A' ' 5' ' ' THR . 88.5 m-85 -138.49 -139.08 0.14 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.842 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.8 t -169.62 -32.88 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 179.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -147.35 -172.7 4.08 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.81 -161.65 24.95 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.0 p-80 -178.98 162.68 1.28 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.867 0.334 . . . . 0.0 110.559 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.8 m -86.8 51.5 2.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.611 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.543 ' HB3' HD23 ' A' ' 42' ' ' LEU . 58.5 p 54.46 137.39 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.965 1.306 . . . . 0.0 114.097 177.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -92.05 41.64 1.08 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 121.836 -0.54 . . . . 0.0 110.268 178.592 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 pt -158.0 -48.78 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.269 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 79.4 mt -122.77 -119.95 0.29 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 -179.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -150.86 56.2 0.9 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.326 0.584 . . . . 0.0 110.906 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -116.37 152.15 34.51 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.341 0.591 . . . . 0.0 110.814 179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 42.2 t -80.01 106.63 12.18 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.065 179.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.653 HD12 ' HD3' ' A' ' 4' ' ' LYS . 3.1 mm? -108.19 115.1 29.5 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 179.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . 0.42 ' HB3' ' CG ' ' A' ' 29' ' ' PHE . 91.9 m -89.48 146.62 24.5 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.13 -178.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.702 ' HA ' ' O ' ' A' ' 3' ' ' CYS . 5.0 p -122.83 122.01 37.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.454 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.65 ' HG3' ' SG ' ' A' ' 47' ' ' CYS . 16.3 ptpt -97.48 144.3 27.71 Favored Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.988 -178.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 1' ' ' ARG . 92.0 Cg_endo -79.02 61.83 8.29 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.989 2.459 . . . . 0.0 113.015 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.65 ' SG ' ' HG3' ' A' ' 45' ' ' LYS . 60.6 m . . . . . 0 C--O 1.253 1.252 0 CA-C-O 117.811 -1.09 . . . . 0.0 110.447 179.482 . . . . . . . . 1 1 . 1 stop_ save_