data_2m7q_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 2m7q _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.414 -2.252 0 CA-C-O 121.266 0.555 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.427 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CZ ' HD21 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.493 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.439 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.449 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.449 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 68.0 m-70 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.416 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.518 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.518 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.576 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.407 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.469 ' O ' HG21 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.576 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 122.016 0.912 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.486 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.507 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.537 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.486 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 40' ' ' CYS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.562 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.427 ' O ' HG21 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.421 -1.911 0 CA-C-O 121.74 0.781 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.419 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.465 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.51 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.513 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.594 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.554 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.568 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.594 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.465 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 68.0 m-70 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.419 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.454 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.454 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.456 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.456 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.419 -1.987 0 CA-C-O 121.871 0.843 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.53 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.517 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.41 HG11 HD22 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.453 ' HB3' HE22 ' A' ' 43' ' ' GLN . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.495 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.472 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.2 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.53 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.523 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 . . . . . 0 N--CA 1.429 -1.501 0 CA-C-O 121.24 0.543 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 29' ' ' HIS . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.675 ' HB2' ' ND1' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.669 ' SG ' ' CE1' ' A' ' 33' ' ' HIS . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.507 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.452 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 11.8 t-160 -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.627 ' HA ' ' CD2' ' A' ' 33' ' ' HIS . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.675 ' ND1' ' HB2' ' A' ' 12' ' ' LEU . 15.0 m-70 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.433 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.412 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.621 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.621 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.473 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.671 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.617 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.671 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.617 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 . . . . . 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.42 HD21 HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.414 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.55 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.506 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 26' ' ' PHE . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.506 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 75.4 m-70 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.472 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HD2' ' N ' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.489 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.457 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.472 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 58' ' ' GLN . 22.6 mm-40 . . . . . 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 . . . . . 0 N--CA 1.424 -1.743 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.425 ' HE3' ' OE1' ' A' ' 23' ' ' GLN . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.491 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.425 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.408 ' HB2' HE22 ' A' ' 43' ' ' GLN . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.46 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.519 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.493 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.519 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 23.2 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.491 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.753 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.468 ' O ' HG21 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.507 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.753 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 25.9 m-70 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.527 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.486 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.527 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.449 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 . . . . . 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.455 ' HB3' ' HG3' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.468 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.45 HD21 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.45 ' CZ ' HD21 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.492 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 26' ' ' PHE . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.532 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.492 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 81.1 m-70 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.498 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.446 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.449 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.455 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.406 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.555 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.555 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 . . . . . 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 . . . . . 0 N--CA 1.442 -0.861 0 CA-C-O 121.33 0.586 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.724 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.658 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.501 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.532 ' O ' HG22 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.658 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.724 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.459 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.418 ' HB3' HD11 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.614 ' CE2' HG11 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.546 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 . . . . . 0 N--CA 1.431 -1.391 0 CA-C-O 122.73 1.253 . . . . 0.0 108.135 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.443 HD23 HG11 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.505 ' CG ' ' HD3' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HD3' ' CG ' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.453 ' O ' HG22 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 26' ' ' PHE . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.525 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.471 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 25.7 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.525 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.548 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 . . . . . 0 N--CA 1.417 -2.122 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.444 HD12 ' HG3' ' A' ' 46' ' ' PRO . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.458 HD21 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' HD21 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 26' ' ' PHE . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.406 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.507 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.482 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.406 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.444 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.597 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.579 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.418 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.597 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.822 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.638 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.471 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.423 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.822 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.504 ' HZ ' ' ND1' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG21 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.77 ' HE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.494 HG21 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.456 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.509 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.9 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.495 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 4.4 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 . . . . . 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.499 ' CD1' ' HG3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.472 ' O ' HG22 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 26' ' ' PHE . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.5 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.434 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.434 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.499 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.485 ' CE2' HG13 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.513 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.485 HG13 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 . . . . . 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.7 m170 . . . . . 0 N--CA 1.422 -1.851 0 CA-C-O 121.381 0.61 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.432 HD21 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.554 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.49 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.472 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.472 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 46.7 m-70 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.46 ' CB ' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.46 ' HB2' ' CB ' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.432 ' HG3' HD21 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 1.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.437 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG22 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 . . . . . 0 N--CA 1.428 -1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.45 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.62 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.461 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.538 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.62 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 27.9 m-70 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.429 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.59 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.593 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.407 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 53' ' ' PHE . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 N--CA 1.428 -1.527 0 CA-C-O 121.766 0.793 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.544 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.528 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.408 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.586 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.52 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.586 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.49 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.499 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.499 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 N--CA 1.413 -2.284 0 CA-C-O 121.581 0.705 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.611 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.507 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.455 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.44 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 26' ' ' PHE . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.464 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 44.5 m-70 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.446 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.446 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.431 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.613 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 . . . . . 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.425 HD21 HG11 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . 0.732 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.539 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' HH ' ' HB3' ' A' ' 25' ' ' LYS . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.554 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.442 ' O ' HG22 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . 0.524 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 26' ' ' PHE . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.732 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 41.3 m-70 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.431 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.455 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.455 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.422 ' HG3' HD13 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CE2' HG22 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.408 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 48' ' ' TYR . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.441 ' O ' HG21 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.408 ' HD2' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.441 HG21 ' O ' ' A' ' 53' ' ' PHE . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 . . . . . 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.467 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.433 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.407 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.613 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.478 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.54 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.54 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.478 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.452 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.646 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.634 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.743 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.607 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -87.98 -156.67 0.06 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.948 2.432 . . . . 0.0 111.007 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -66.17 -29.81 70.17 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.197 0.523 . . . . 0.0 110.896 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.421 ' O ' ' HD2' ' A' ' 7' ' ' HIS . 12.5 tpt -109.7 92.58 4.11 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -111.91 34.14 4.39 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 123.612 1.672 . . . . 0.0 110.192 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.0 t -106.2 25.43 2.04 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.322 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.421 ' HD2' ' O ' ' A' ' 4' ' ' MET . 88.3 m-70 -85.69 6.37 27.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 113.846 -1.525 . . . . 0.0 110.216 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.427 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.435 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.427 ' CZ ' HD21 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' HA ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.439 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.476 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.449 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.437 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.449 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 68.0 m-70 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.416 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.518 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.842 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.416 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.576 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.407 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.469 ' O ' HG21 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.576 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.443 ' O ' HG22 ' A' ' 59' ' ' THR . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.545 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 74.0 t60 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.469 HG21 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -61.38 -32.12 72.03 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.443 HG22 ' O ' ' A' ' 55' ' ' ARG . 75.8 p -71.49 -21.57 61.91 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.894 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.842 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.3 m-70 -78.3 -21.83 49.1 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.715 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -89.22 -28.86 19.67 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 16.7 t70 -67.83 -49.53 61.74 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 122.124 0.964 . . . . 0.0 109.554 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 61.81 14.81 6.52 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 60.04 32.3 20.99 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.378 1.071 . . . . 0.0 108.546 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 t 54.09 74.24 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.198 -176.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tt -74.59 99.48 3.64 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -84.82 -40.17 17.49 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.712 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -154.64 -55.63 0.1 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -177.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 C--N 1.301 -1.534 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.903 -179.868 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.517 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -76.9 25.14 0.46 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.268 2.645 . . . . 0.0 113.205 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -73.07 -25.37 60.88 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.846 0.832 . . . . 0.0 108.87 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 43.8 tpp -160.62 144.21 13.57 Favored 'General case' 0 N--CA 1.4 -2.973 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 4.8 p-10 -127.21 -169.39 2.03 Favored 'General case' 0 C--N 1.26 -3.318 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -174.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -157.62 28.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -93.33 11.4 28.35 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.348 -172.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.486 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.487 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.507 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.537 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.424 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.487 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.486 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.562 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 40' ' ' CYS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.635 ' HB2' ' CE1' ' A' ' 60' ' ' HIS . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.572 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.562 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.483 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.427 ' O ' HG21 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.427 HG21 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -73.52 -35.24 65.55 Favored 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 53.6 p -66.32 -27.01 67.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 118.254 0.479 . . . . 0.0 111.793 179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.635 ' CE1' ' HB2' ' A' ' 39' ' ' MET . 70.0 m-70 -63.28 -41.65 99.02 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.602 0.715 . . . . 0.0 109.181 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -85.21 -24.63 27.78 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.199 -175.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -67.26 -59.65 3.25 Favored 'General case' 0 CA--C 1.482 -1.64 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 66.83 0.45 1.92 Allowed 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.784 -2.007 . . . . 0.0 112.693 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.3 -51.0 6.52 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.51 -17.6 12.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.974 -178.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.9 mt 58.83 -79.5 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 125.572 1.549 . . . . 0.0 114.145 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.2 m120 53.03 86.78 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 125.607 1.563 . . . . 0.0 112.972 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -127.0 -176.03 3.59 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.317 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 119.138 -0.458 . . . . 0.0 109.769 -179.734 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.739 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -62.08 116.51 3.52 Favored 'Trans proline' 0 C--O 1.25 1.099 0 C-N-CA 123.317 2.678 . . . . 0.0 112.006 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.9 p-80 -114.74 115.24 26.73 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.407 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.4 tpp -110.51 96.48 6.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.184 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -125.29 126.67 45.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.6 t -115.27 27.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -82.96 -2.27 54.66 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.022 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.419 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.465 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.51 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.51 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.513 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.594 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.554 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.513 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.568 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.594 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.554 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.47 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.465 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 68.0 m-70 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.419 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.454 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.454 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.456 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.543 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.456 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.461 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 70.1 t60 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -63.71 -26.7 68.77 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 p -72.01 -20.26 61.73 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.195 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.461 ' HD2' ' O ' ' A' ' 56' ' ' HIS . 37.4 m-70 -78.32 -24.06 46.78 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -89.62 -27.93 19.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.251 0.548 . . . . 0.0 109.666 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -71.35 -36.77 71.63 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.243 1.021 . . . . 0.0 109.246 176.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 69.37 6.11 5.51 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 126.565 1.946 . . . . 0.0 113.049 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m120 69.22 0.27 2.78 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.982 1.313 . . . . 0.0 113.527 174.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.262 14.3 p 38.99 68.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 125.618 1.567 . . . . 0.0 113.346 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.4 pp -127.12 141.04 51.86 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -82.54 -43.77 16.72 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -152.56 -65.86 0.16 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 170.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.481 -1.691 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 176.203 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.291 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.88 147.44 80.59 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 122.825 2.35 . . . . 0.0 111.714 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -79.66 -63.31 1.44 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.957 0.408 . . . . 0.0 110.09 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 49.2 ttm 66.31 103.62 0.04 OUTLIER 'General case' 0 C--O 1.242 0.699 0 C-N-CA 125.462 1.505 . . . . 0.0 113.575 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.535 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 10.1 t0 -159.78 111.22 2.0 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 114.189 -1.369 . . . . 0.0 109.985 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.3 p -162.67 29.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 104.706 -2.331 . . . . 0.0 104.706 176.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -93.96 46.86 1.19 Allowed 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 112.782 -2.008 . . . . 0.0 110.388 -175.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.53 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.517 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.535 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.451 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.401 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.451 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.41 HG11 HD22 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.453 ' HB3' HE22 ' A' ' 43' ' ' GLN . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.495 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.472 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.872 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.495 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.2 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.53 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.523 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.564 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 81.1 t60 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.539 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER -55.71 -42.77 75.77 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 55' ' ' ARG . 82.3 p -62.7 -23.24 67.04 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.872 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 30.5 m-70 -75.74 -22.11 56.84 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.422 0.63 . . . . 0.0 109.54 178.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -103.83 -32.45 9.31 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.666 0.746 . . . . 0.0 110.913 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.513 ' C ' ' H ' ' A' ' 64' ' ' ASN . 7.4 t70 -103.05 17.78 23.24 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 125.735 1.614 . . . . 0.0 109.782 -171.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -45.32 22.45 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.513 ' H ' ' C ' ' A' ' 62' ' ' ASP . 45.9 m-80 -79.48 -9.06 59.54 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 172.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.42 -11.97 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.333 176.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.6 mt -81.53 94.4 6.87 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.5 t30 177.43 -40.26 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.56 101.4 9.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.241 -175.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 35.5 t70 . . . . . 0 C--N 1.297 -1.695 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 177.082 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.474 ' O ' ' HB ' ' A' ' 6' ' ' VAL . . . . . . . . 0 CA--C 1.489 -1.589 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -69.01 -18.17 40.67 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.222 1.948 . . . . 0.0 110.514 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -131.95 176.53 8.28 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.465 ' HA ' ' HE3' ' A' ' 4' ' ' MET . 4.5 mmt 70.13 -79.87 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 124.95 1.3 . . . . 0.0 112.491 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -129.38 120.77 26.12 Favored 'General case' 0 C--N 1.256 -3.499 0 CA-C-O 122.021 0.915 . . . . 0.0 111.209 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 1' ' ' GLY . 11.8 p -158.14 29.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.282 -2.341 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 177.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -104.82 7.32 34.47 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.672 -1.603 . . . . 0.0 110.728 -176.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.675 ' HB2' ' ND1' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.507 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.492 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.452 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 11.8 t-160 -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.627 ' HA ' ' CD2' ' A' ' 33' ' ' HIS . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.675 ' ND1' ' HB2' ' A' ' 12' ' ' LEU . 15.0 m-70 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.433 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.412 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.621 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.621 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.888 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.671 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.617 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.671 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.617 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.583 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 70.3 t60 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.32 -34.01 75.79 Favored 'General case' 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.448 HG21 ' O ' ' A' ' 55' ' ' ARG . 72.3 p -68.18 -24.45 64.96 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 118.453 0.57 . . . . 0.0 111.267 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.888 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 40.9 m-70 -69.74 -29.9 67.36 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 177.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -89.61 -37.01 14.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.784 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -74.9 -57.52 3.86 Favored 'General case' 0 CA--C 1.487 -1.463 0 CA-C-O 121.859 0.837 . . . . 0.0 110.231 -172.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 60.15 9.7 1.98 Allowed 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 113.276 -1.784 . . . . 0.0 112.922 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m120 62.94 17.32 9.94 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.718 1.607 . . . . 0.0 112.144 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.1 t 61.2 33.36 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 122.958 1.361 . . . . 0.0 108.205 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 92.8 mt -139.69 168.15 20.47 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.063 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -85.04 120.82 26.98 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 166.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -62.03 -52.55 63.51 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.044 0.45 . . . . 0.0 110.591 -174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--N 1.292 -1.912 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 177.24 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.58 126.56 16.35 Favored 'Trans proline' 0 C--O 1.251 1.135 0 C-N-CA 122.725 2.283 . . . . 0.0 109.666 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.474 ' CE1' ' HA ' ' A' ' 5' ' ' ASP . 0.4 OUTLIER -139.24 179.16 6.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.122 -174.02 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.401 ' HE3' ' HB2' ' A' ' 4' ' ' MET . 45.8 mtm -75.79 -20.33 58.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 121.914 0.864 . . . . 0.0 110.961 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.498 ' O ' ' HB ' ' A' ' 6' ' ' VAL . 26.7 t0 75.95 146.78 0.09 Allowed 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 112.04 -2.345 . . . . 0.0 112.513 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.498 ' HB ' ' O ' ' A' ' 5' ' ' ASP . 10.1 p 170.38 -23.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.055 0 C-N-CA 125.726 1.61 . . . . 0.0 108.77 -175.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -131.79 84.95 2.21 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.421 ' HZ2' ' CG ' ' A' ' 5' ' ' ASP . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.42 HD21 HG12 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.414 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.55 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.486 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.506 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 26' ' ' PHE . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.506 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 75.4 m-70 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.472 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.44 ' HD2' ' N ' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.489 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.864 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.457 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.472 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.428 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.525 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 74.4 t60 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 58' ' ' GLN . 22.6 mm-40 -57.73 -38.77 75.88 Favored 'General case' 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.2 p -69.59 -16.87 63.48 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.084 0.468 . . . . 0.0 111.701 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.864 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 40.4 m-70 -83.35 -27.94 29.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 176.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -91.48 -22.78 20.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.621 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -91.67 -70.65 0.68 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-O 121.414 0.626 . . . . 0.0 110.799 -178.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 64.55 6.92 3.4 Favored 'General case' 0 C--N 1.292 -1.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.515 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -159.21 -12.23 0.06 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -174.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.0 t 66.72 20.39 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.265 0 CA-C-O 123.137 1.446 . . . . 0.0 110.096 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.5 tp -108.02 86.46 2.3 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -95.87 -9.19 32.07 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -73.58 -64.64 0.95 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.392 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.254 1.308 0 O-C-N 124.633 1.208 . . . . 0.0 112.381 175.21 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.619 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -60.89 -30.14 89.46 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.708 2.272 . . . . 0.0 110.808 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.3 m-70 -129.52 158.35 39.48 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.9 tpt -92.49 69.06 4.93 Favored 'General case' 0 C--N 1.298 -1.633 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.371 176.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.475 ' OD2' ' HG3' ' A' ' 8' ' ' LYS . 38.5 t70 169.74 154.18 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 125.636 1.575 . . . . 0.0 107.57 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.3 p -165.24 26.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 N-CA-C 106.097 -1.816 . . . . 0.0 106.097 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -112.0 9.16 20.41 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-N 114.187 -1.37 . . . . 0.0 112.559 -170.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.475 ' HG3' ' OD2' ' A' ' 5' ' ' ASP . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.422 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.491 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.425 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.605 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.605 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.408 ' HB2' HE22 ' A' ' 43' ' ' GLN . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.46 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.519 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.874 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.519 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 23.2 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.491 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.471 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 69.6 t60 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.59 -23.49 67.28 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.9 p -74.81 -30.84 61.53 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.329 0.585 . . . . 0.0 109.644 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.874 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 41.2 m-70 -70.87 -32.53 69.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.719 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -83.66 -31.08 26.35 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.112 176.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.32 -54.12 33.78 Favored 'General case' 0 CA--C 1.488 -1.423 0 CA-C-O 122.015 0.912 . . . . 0.0 109.462 -178.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 65.75 1.76 1.9 Allowed 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 112.621 -2.081 . . . . 0.0 113.081 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -92.06 -42.02 10.19 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.5 73.09 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.52 0 CA-C-O 122.831 1.301 . . . . 0.0 111.866 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 pp -99.5 -10.65 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 122.871 1.319 . . . . 0.0 107.635 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -80.37 107.85 13.51 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.077 -1.874 . . . . 0.0 107.389 174.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -81.46 98.81 8.43 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.144 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 C--N 1.309 -1.161 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.082 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.498 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.02 119.32 6.33 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.671 2.247 . . . . 0.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 68.45 -86.89 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.387 1.075 . . . . 0.0 111.956 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 78.7 mtp -161.93 153.86 19.1 Favored 'General case' 0 CA--C 1.476 -1.884 0 N-CA-C 103.887 -2.634 . . . . 0.0 103.887 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -82.58 103.98 12.51 Favored 'General case' 0 C--N 1.273 -2.739 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.209 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -138.34 35.32 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.278 -2.518 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -92.4 9.39 34.38 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 112.264 -2.244 . . . . 0.0 110.431 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.753 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.427 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.468 ' O ' HG21 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.507 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.753 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 25.9 m-70 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.527 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.486 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.486 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.527 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.449 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.449 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.604 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 78.0 t60 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -59.42 -35.1 73.37 Favored 'General case' 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.4 p -72.22 -24.0 61.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.547 0.612 . . . . 0.0 111.514 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.604 ' HD2' ' O ' ' A' ' 56' ' ' HIS . 33.6 m-70 -74.18 -30.91 62.45 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 176.08 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -88.46 -29.94 19.79 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.271 0.558 . . . . 0.0 110.865 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.58 -32.54 69.97 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.094 0.949 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.555 HE21 ' HA ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER 59.91 69.92 0.67 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 112.615 -2.084 . . . . 0.0 109.48 -175.472 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.426 ' C ' ' H ' ' A' ' 66' ' ' LEU . 29.0 p-10 -86.21 -15.94 39.29 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.131 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.362 14.8 p 62.14 -44.51 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 128.526 2.73 . . . . 0.0 114.878 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' H ' ' C ' ' A' ' 64' ' ' ASN . 89.9 mt -130.5 121.65 26.17 Favored 'General case' 0 C--N 1.255 -3.525 0 C-N-CA 124.817 1.247 . . . . 0.0 107.984 179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -64.83 116.29 6.18 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -89.35 70.47 8.14 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.207 0.527 . . . . 0.0 109.593 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.5 t0 . . . . . 0 CA--C 1.499 -0.989 0 C-N-CA 124.768 1.227 . . . . 0.0 108.426 177.652 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.523 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -66.82 121.13 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 121.773 1.649 . . . . 0.0 109.854 177.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -78.6 121.04 24.14 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.769 -177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.5 tpt -115.4 86.52 2.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -83.36 -2.93 56.93 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.175 0.988 . . . . 0.0 110.968 -174.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 t -110.96 31.55 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -170.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -83.62 -9.81 58.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.455 ' HB3' ' HG3' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.468 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.45 HD21 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.45 ' CZ ' HD21 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.492 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 26' ' ' PHE . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.532 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.492 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 81.1 m-70 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.498 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.446 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.863 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.498 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.449 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.455 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.481 ' O ' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.406 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.555 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.555 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.577 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 81.7 t60 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -59.12 -40.13 84.47 Favored 'General case' 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.1 p -63.64 -27.91 69.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.863 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.5 m-70 -70.12 -33.81 72.3 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 177.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -89.44 -31.29 17.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.037 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.04 -44.82 62.76 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 121.798 0.809 . . . . 0.0 109.519 -176.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 56.85 20.47 5.26 Favored 'General case' 0 C--N 1.288 -2.095 0 C-N-CA 126.203 1.801 . . . . 0.0 113.58 173.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -81.45 5.8 16.57 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.094 -1.004 . . . . 0.0 111.295 178.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.1 -18.38 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 122.989 1.376 . . . . 0.0 108.361 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 50.1 tp -109.36 103.24 12.14 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.304 175.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -176.79 -55.09 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -62.63 -45.33 93.37 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 113.791 -1.55 . . . . 0.0 106.862 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 N--CA 1.426 -1.674 0 N-CA-C 102.648 -3.093 . . . . 0.0 102.648 174.096 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.578 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.6 -38.07 94.86 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 122.912 2.408 . . . . 0.0 111.262 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.52 114.27 26.23 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 90.1 mtp -100.39 -176.76 3.3 Favored 'General case' 0 N--CA 1.395 -3.216 0 CA-C-O 121.826 0.822 . . . . 0.0 109.278 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -95.56 108.66 20.93 Favored 'General case' 0 C--N 1.255 -3.519 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.64 -176.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.9 p -157.23 46.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 123.534 1.635 . . . . 0.0 107.586 -175.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -82.14 -5.51 58.5 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.871 -175.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.724 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.501 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.658 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.501 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.532 ' O ' HG22 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.658 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.1 t-160 -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.538 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.724 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.459 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.418 ' HB3' HD11 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.614 ' CE2' HG11 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.546 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.614 HG11 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.592 ' O ' HG22 ' A' ' 59' ' ' THR . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -67.81 -25.2 65.45 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.592 HG22 ' O ' ' A' ' 56' ' ' HIS . 12.7 t -78.62 -33.39 47.39 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.792 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.558 ' HD2' ' O ' ' A' ' 56' ' ' HIS . 1.6 p80 -89.43 -11.2 43.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.771 175.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -80.17 -35.6 36.23 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -86.66 -25.48 24.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 122.256 1.027 . . . . 0.0 109.988 -176.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 57.29 32.94 22.56 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.433 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 32.6 p30 -81.81 -16.19 51.7 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.504 175.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t 60.7 70.6 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.545 0 C-N-CA 125.908 1.683 . . . . 0.0 112.774 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.9 tp -101.27 83.39 2.47 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.242 173.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -172.61 161.9 5.0 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -116.96 109.18 16.7 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.676 -1.209 . . . . 0.0 113.783 -171.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 C--O 1.259 1.601 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.632 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.792 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -86.21 124.42 2.45 Favored 'Trans proline' 0 N--CA 1.437 -1.797 0 C-N-CA 122.251 1.967 . . . . 0.0 110.904 179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -80.67 -87.84 0.08 Allowed 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 119.888 -0.725 . . . . 0.0 109.625 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.493 ' HE1' ' HA ' ' A' ' 4' ' ' MET . 1.4 tpt 46.52 29.98 1.01 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.474 1.109 . . . . 0.0 110.33 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.66 2.71 54.41 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.721 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.6 57.77 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -97.79 -1.52 43.08 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.135 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.443 HD23 HG11 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.505 ' CG ' ' HD3' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HD3' ' CG ' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.453 ' O ' HG22 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.453 HG22 ' O ' ' A' ' 26' ' ' PHE . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.525 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.886 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.435 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 25.7 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.525 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.549 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 77.4 t60 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.548 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER -59.95 -32.58 70.93 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 p -69.51 -25.62 64.13 Favored 'General case' 0 C--O 1.196 -1.752 0 CA-C-N 117.722 0.237 . . . . 0.0 111.164 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.886 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 32.6 m-70 -75.62 -22.48 56.8 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.441 0.639 . . . . 0.0 109.48 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -91.78 -30.98 15.93 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.177 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.422 ' C ' ' H ' ' A' ' 64' ' ' ASN . 69.2 m-20 -97.48 6.25 48.45 Favored 'General case' 0 CA--C 1.481 -1.701 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -68.38 12.4 0.13 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 62' ' ' ASP . 2.4 p-10 -115.11 -14.78 11.76 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.306 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.6 m -94.15 -0.72 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 CA-C-O 122.216 1.008 . . . . 0.0 109.524 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -102.39 118.15 36.26 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 173.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -85.54 130.35 34.6 Favored 'General case' 0 C--N 1.294 -1.834 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.291 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -96.61 14.03 26.22 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 C--N 1.302 -1.457 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.088 178.619 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.562 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -83.5 -3.75 10.77 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.056 1.837 . . . . 0.0 113.693 -175.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -109.57 -67.44 0.99 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.673 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 79.8 mtp 60.66 97.75 0.03 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 124.853 1.261 . . . . 0.0 110.801 -176.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 171.36 14.23 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.728 0.775 . . . . 0.0 109.852 -175.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.7 t -138.46 33.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -93.56 -26.64 17.03 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.402 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.482 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.444 HD12 ' HG3' ' A' ' 46' ' ' PRO . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.458 HD21 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.458 ' CE1' HD21 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 26' ' ' PHE . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.406 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.507 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.892 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.406 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.444 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.579 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.597 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.579 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.418 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.597 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 59' ' ' THR . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.435 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 76.5 t60 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -65.03 -21.89 66.91 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.9 p -71.11 -28.87 64.62 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.892 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 30.4 m-70 -77.19 -29.0 54.13 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.14 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -81.19 -30.39 34.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.823 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.541 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 17.8 t70 -72.34 -46.28 56.19 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-O 122.579 1.181 . . . . 0.0 109.233 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 66.79 15.57 10.17 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 112.787 -2.006 . . . . 0.0 111.222 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 63.9 t30 76.77 -25.03 0.21 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 126.194 1.797 . . . . 0.0 112.529 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.53 3.14 2.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 62' ' ' ASP . 45.2 mt -104.08 4.44 34.28 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 120.934 0.397 . . . . 0.0 110.45 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -73.36 -55.76 5.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.221 -177.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -113.87 105.06 12.81 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.537 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 CA--C 1.502 -0.888 0 C-N-CA 124.458 1.103 . . . . 0.0 108.498 177.966 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.4 106.55 1.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.159 1.906 . . . . 0.0 110.62 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -94.51 20.09 8.87 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.283 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.1 tpt -77.08 84.58 3.58 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.715 0.769 . . . . 0.0 110.409 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -158.43 127.8 5.71 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.451 176.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.2 p -155.44 21.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.305 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 170.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -124.12 -22.78 4.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 113.928 -1.487 . . . . 0.0 113.446 -170.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.822 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.638 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.465 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.423 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.822 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.504 ' HZ ' ' ND1' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.455 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG21 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.77 ' HE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.494 HG21 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.456 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.509 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.47 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.869 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.422 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.9 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.429 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.495 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 4.4 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.64 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 80.6 t60 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.99 -35.12 79.67 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 56' ' ' HIS . 14.2 t -72.51 -18.9 61.61 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.14 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.869 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.5 m-70 -73.93 -32.75 63.66 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -83.02 -34.39 26.28 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.639 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.37 -46.39 60.5 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-O 122.203 1.002 . . . . 0.0 109.151 -178.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 63' ' ' GLN . 8.0 tt0 59.28 4.43 0.47 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 126.649 1.98 . . . . 0.0 112.701 176.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 73.76 8.21 4.93 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.198 1.399 . . . . 0.0 110.766 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.4 p -95.36 -14.81 7.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 123.109 1.433 . . . . 0.0 108.092 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.7 tp -99.98 10.6 41.04 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.861 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -133.51 -179.36 5.47 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -94.81 106.65 18.64 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.845 0.831 . . . . 0.0 111.351 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--N 1.291 -1.975 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.756 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.099 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -88.83 28.61 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 122.916 2.41 . . . . 0.0 112.44 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -143.04 136.26 28.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.9 tpp 64.01 95.33 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.147 0.975 . . . . 0.0 112.025 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.35 20.33 0.87 Allowed 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.7 0.61 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -115.56 11.72 15.94 Favored 'General case' 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.499 ' CD1' ' HG3' ' A' ' 46' ' ' PRO . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.472 ' O ' HG22 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.5 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 26' ' ' PHE . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.5 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.434 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.434 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.463 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.499 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.485 ' CE2' HG13 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.513 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.485 HG13 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.513 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.491 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.569 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -68.2 -21.18 64.88 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.512 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 37.8 p -76.46 -46.39 27.06 Favored 'General case' 0 C--O 1.194 -1.825 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.071 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.569 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.311 0.5 OUTLIER -71.44 -9.81 58.76 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 119.131 -1.028 . . . . 0.0 113.476 178.978 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.514 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 33.5 m-85 -92.83 -18.69 22.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.909 169.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.75 -12.95 10.18 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.608 -1.237 . . . . 0.0 113.622 -172.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.512 ' HG2' ' O ' ' A' ' 59' ' ' THR . 18.6 pt20 -76.41 52.85 0.8 Allowed 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 59.47 29.73 19.32 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.89 1.329 . . . . 0.0 110.899 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.62 -3.31 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 122.53 1.157 . . . . 0.0 110.495 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.491 ' O ' HD13 ' A' ' 66' ' ' LEU . 3.5 pp -121.92 116.65 24.76 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.6 177.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -92.16 94.49 9.23 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -105.08 -35.65 7.55 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.776 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 . . . . . 0 C--N 1.305 -1.362 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -176.834 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.388 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.505 ' HA ' ' OD1' ' A' ' 5' ' ' ASP . 44.2 Cg_endo -67.31 86.21 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.514 2.809 . . . . 0.0 114.289 -174.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -159.26 -52.59 0.06 Allowed 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.435 ' HA ' ' CE1' ' A' ' 7' ' ' HIS . 76.7 mtp -68.17 -27.89 66.81 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 122.897 1.332 . . . . 0.0 111.453 -175.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' OD1' ' HA ' ' A' ' 2' ' ' PRO . 7.1 p-10 -82.82 5.44 21.61 Favored 'General case' 0 C--N 1.249 -3.767 0 CA-C-N 112.944 -1.934 . . . . 0.0 111.944 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 t -119.62 8.59 6.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 4' ' ' MET . 41.7 m170 -84.65 -0.62 54.07 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.813 -177.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.432 HD21 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.554 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.49 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.49 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.472 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.472 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 46.7 m-70 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.46 ' CB ' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.578 ' HB2' ' CE1' ' A' ' 60' ' ' HIS . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.46 ' HB2' ' CB ' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.432 ' HG3' HD21 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.594 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 1.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.437 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG22 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.594 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.437 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.571 ' O ' HG21 ' A' ' 59' ' ' THR . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.425 HG22 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -72.49 -32.94 66.59 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.571 HG21 ' O ' ' A' ' 56' ' ' HIS . 6.3 t -72.29 -24.21 61.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 118.092 0.406 . . . . 0.0 109.908 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.578 ' CE1' ' HB2' ' A' ' 39' ' ' MET . 40.6 m-70 -61.0 -41.85 97.3 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 171.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.52 -31.64 37.03 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.653 -177.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.431 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 26.8 t70 -69.28 -21.22 63.9 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.356 1.074 . . . . 0.0 109.024 177.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 54.66 20.37 2.91 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 127.994 2.517 . . . . 0.0 113.734 178.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 68.38 16.46 9.24 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.517 1.127 . . . . 0.0 110.545 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.3 t 52.74 71.06 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.115 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -155.64 160.44 40.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.776 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -111.89 102.5 10.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 122.031 0.919 . . . . 0.0 111.573 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.71 70.5 7.75 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.168 -174.646 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.958 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -77.31 103.66 1.77 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.407 2.071 . . . . 0.0 111.505 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -112.86 128.07 56.36 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 121.218 0.532 . . . . 0.0 110.69 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.9 ttp -99.03 29.98 3.62 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.478 ' CG ' ' HZ2' ' A' ' 9' ' ' LYS . 3.4 t70 -146.87 155.1 42.06 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.293 -1.776 . . . . 0.0 108.267 -174.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 p -145.8 45.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.74 0 CA-C-O 124.275 1.988 . . . . 0.0 106.383 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 67.21 39.12 3.15 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.174 -2.739 . . . . 0.0 110.369 -176.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.478 ' HZ2' ' CG ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.45 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.572 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.62 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.461 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.46 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.538 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.62 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 27.9 m-70 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.429 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.429 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.59 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.509 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.593 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.407 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.593 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.589 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.403 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -74.55 -17.19 60.77 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.566 HG23 ' O ' ' A' ' 56' ' ' HIS . 13.0 t -87.25 -36.83 17.71 Favored 'General case' 0 N--CA 1.427 -1.62 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.214 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.589 ' HD2' ' O ' ' A' ' 56' ' ' HIS 0.262 1.6 p80 -81.07 -13.1 59.09 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 118.48 -1.288 . . . . 0.0 111.862 174.771 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.31 -13.89 58.82 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 168.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.478 ' HB3' ' O ' ' A' ' 59' ' ' THR . 28.7 t70 -90.49 -70.55 0.67 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.168 178.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 179.3 -31.51 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 126.073 1.749 . . . . 0.0 108.959 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 68.54 73.88 0.28 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.922 1.289 . . . . 0.0 111.945 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m 37.69 50.27 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.676 1.99 . . . . 0.0 114.293 175.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 44.8 tp -85.31 -2.91 58.59 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.06 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 61.77 -106.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -144.72 73.1 1.36 Allowed 'General case' 0 C--O 1.243 0.719 0 CA-C-N 117.956 0.344 . . . . 0.0 110.438 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.255 1.359 0 O-C-N 124.281 0.988 . . . . 0.0 110.803 -179.653 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.89 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.88 -32.09 36.92 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.303 2.002 . . . . 0.0 112.751 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.0 m80 62.95 14.74 7.77 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.438 1.095 . . . . 0.0 110.935 -176.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.2 ttm -137.54 121.51 17.75 Favored 'General case' 0 N--CA 1.412 -2.353 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.053 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.402 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 10.7 t70 -125.62 114.86 19.26 Favored 'General case' 0 C--N 1.274 -2.715 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.077 175.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -131.79 39.58 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 N-CA-C 104.168 -2.53 . . . . 0.0 104.168 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -91.32 1.98 56.72 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.54 -1.664 . . . . 0.0 110.374 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.408 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.402 ' HD3' ' O ' ' A' ' 5' ' ' ASP . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.454 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.544 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.528 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.544 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.408 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.586 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.448 ' SD ' ' HB3' ' A' ' 60' ' ' HIS . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.88 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.586 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.49 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.499 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.499 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.535 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 77.0 t60 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -62.97 -28.83 70.36 Favored 'General case' 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.1 p -73.77 -17.93 61.03 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.773 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.88 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 37.1 m-70 -81.03 -23.38 38.63 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -91.34 -21.03 21.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.197 174.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.41 ' OD2' HG22 ' A' ' 65' ' ' VAL . 16.3 t70 -80.39 -60.76 2.2 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 121.803 0.811 . . . . 0.0 109.634 -176.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 60.35 28.17 17.77 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-N 113.526 -1.67 . . . . 0.0 112.645 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.273 53.6 m-80 81.71 70.71 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.836 0 C-N-CA 126.38 1.872 . . . . 0.0 113.225 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.41 HG22 ' OD2' ' A' ' 62' ' ' ASP . 20.4 m -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 CA-C-O 121.983 0.896 . . . . 0.0 108.877 173.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -70.64 106.57 3.55 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -87.42 117.55 26.27 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -168.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -93.19 -45.39 7.89 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 170.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 C--N 1.308 -1.232 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.797 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.68 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -82.0 84.05 1.95 Allowed 'Trans proline' 0 N--CA 1.437 -1.808 0 C-N-CA 122.081 1.854 . . . . 0.0 112.458 -178.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -85.85 99.94 11.73 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.431 ' HA ' ' HE1' ' A' ' 4' ' ' MET . 16.1 mmt 67.78 -85.0 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.139 0.976 . . . . 0.0 109.761 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -157.15 114.57 3.1 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 113.811 -1.541 . . . . 0.0 107.115 175.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.6 p -131.63 23.43 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.027 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -101.58 8.14 41.96 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.692 -1.594 . . . . 0.0 109.929 -173.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.431 HD12 ' HG3' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.611 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.611 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.507 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.477 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.455 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.44 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 26' ' ' PHE . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.464 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 44.5 m-70 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.414 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.446 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.446 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.431 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.613 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.612 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.613 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.52 ' O ' HG22 ' A' ' 59' ' ' THR . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . 0.467 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.584 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -72.68 -16.16 61.69 Favored 'General case' 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.52 HG22 ' O ' ' A' ' 55' ' ' ARG . 39.0 p -75.62 -45.73 35.69 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 118.752 0.706 . . . . 0.0 110.282 177.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.584 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.272 1.2 p80 -75.07 -18.45 60.29 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.623 -179.066 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.504 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 26.7 m-85 -82.57 -28.06 31.18 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.647 172.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -81.09 -41.42 22.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-O 122.296 1.046 . . . . 0.0 109.761 -178.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 69.8 -7.01 0.96 Allowed 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 126.343 1.857 . . . . 0.0 112.517 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.1 t30 72.65 6.42 5.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.093 1.357 . . . . 0.0 109.614 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.9 t -119.17 20.2 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.1 mt 73.74 152.89 0.13 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.384 1.474 . . . . 0.0 110.828 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -59.49 -36.81 76.74 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.343 -178.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.0 t80 56.03 84.7 0.08 Allowed 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.283 1.033 . . . . 0.0 111.767 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.488 -1.408 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.684 -178.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.381 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.82 45.37 1.3 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.795 2.997 . . . . 0.0 112.716 -179.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -68.69 -36.14 78.1 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.813 0.845 . . . . 0.0 109.81 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.3 tpt -131.89 102.51 5.88 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.598 ' HA ' ' SD ' ' A' ' 16' ' ' MET . 11.8 t70 -129.36 150.54 50.68 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 -177.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -125.62 25.1 3.06 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 123.344 1.545 . . . . 0.0 109.647 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 69.04 5.3 4.99 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 172.321 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.539 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.425 HD21 HG11 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . 0.731 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.539 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 5' ' ' ASP . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' HH ' ' HB3' ' A' ' 25' ' ' LYS . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.554 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.442 ' O ' HG22 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . 0.524 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.442 HG22 ' O ' ' A' ' 26' ' ' PHE . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.731 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 41.3 m-70 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.431 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.455 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.455 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.431 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.422 ' HG3' HD13 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CE2' HG22 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.474 ' O ' HG23 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.408 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.612 HG22 ' CE2' ' A' ' 48' ' ' TYR . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.441 ' O ' HG21 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.513 ' O ' HG21 ' A' ' 59' ' ' THR . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.694 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -72.01 -17.06 62.07 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.513 HG21 ' O ' ' A' ' 55' ' ' ARG . 76.7 p -73.55 -41.82 62.46 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 118.694 0.679 . . . . 0.0 109.594 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.694 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.265 0.7 OUTLIER -79.87 -16.89 54.48 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.454 179.112 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.473 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 23.3 m-85 -83.35 -23.58 32.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.311 0.577 . . . . 0.0 109.657 170.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.9 -36.53 31.07 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.13 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.408 ' HB3' ' CD2' ' A' ' 66' ' ' LEU . 11.0 mm100 75.03 0.08 3.45 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 113.42 -1.718 . . . . 0.0 113.131 -179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.9 m120 71.36 21.46 4.61 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.227 1.011 . . . . 0.0 113.533 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.7 t 64.24 83.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.174 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.31 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . 0.408 ' CD2' ' HB3' ' A' ' 63' ' ' GLN . 3.4 mm? -72.22 118.06 14.62 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.311 -0.858 . . . . 0.0 108.944 172.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -111.61 99.38 8.13 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 120.847 0.356 . . . . 0.0 110.823 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -69.41 -47.32 64.52 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 C--O 1.243 0.735 0 C-N-CA 126.319 1.848 . . . . 0.0 114.744 173.49 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.289 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -83.21 28.82 0.56 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.307 2.671 . . . . 0.0 112.211 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.88 93.38 2.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.726 0.774 . . . . 0.0 111.285 -177.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.7 mtp -132.64 96.26 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.902 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -138.28 165.62 26.27 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -176.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 t -119.45 25.97 4.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-O 123.8 1.762 . . . . 0.0 107.052 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 75.69 4.55 3.95 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-N 111.847 -2.433 . . . . 0.0 115.849 174.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.407 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.467 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.433 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . 0.401 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.467 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.407 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.613 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.478 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.54 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.54 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.478 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.452 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.646 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.634 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.634 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.743 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.86 -16.59 63.37 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.3 p -76.79 -39.33 51.87 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 -63.71 -32.68 74.25 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 114.684 -1.143 . . . . 0.0 109.689 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -90.33 -15.53 30.97 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.113 178.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -84.08 -73.32 0.43 Allowed 'General case' 0 CA--C 1.477 -1.835 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.42 ' HA ' ' OE1' ' A' ' 63' ' ' GLN . 11.7 mm-40 49.79 16.39 0.21 Allowed 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 126.413 1.885 . . . . 0.0 112.815 -177.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -107.36 -33.35 7.41 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 124.258 1.023 . . . . 0.0 110.379 -171.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.4 m -81.29 22.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.491 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.0 mp 56.75 77.55 0.25 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 123.46 0.704 . . . . 0.0 109.13 -174.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -87.74 106.31 17.97 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.835 -175.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -87.69 93.71 9.52 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.317 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--N 1.298 -1.646 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.265 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.414 -2.252 0 CA-C-O 121.266 0.555 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 33' ' ' HIS . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 23.1 mm-40 -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 12' ' ' LEU . 68.3 m80 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.429 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.613 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.429 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.425 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.478 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 122.016 0.912 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 18.9 mm-40 -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.518 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' CYS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.467 ' HB3' HG23 ' A' ' 52' ' ' VAL . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' ASP . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.421 -1.911 0 CA-C-O 121.74 0.781 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.431 ' HA ' ' CD2' ' A' ' 34' ' ' TRP . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.431 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HE3' ' NE2' ' A' ' 50' ' ' GLN . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.514 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.514 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 16.1 mm-40 -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.483 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.483 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.419 -1.987 0 CA-C-O 121.871 0.843 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.531 HG13 HD21 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.556 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 47.9 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.549 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.537 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 . . . . . 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 . . . . . 0 N--CA 1.429 -1.501 0 CA-C-O 121.24 0.543 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.886 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.49 ' OE1' ' HA ' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.501 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.886 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 55.6 m80 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.451 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.61 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.647 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.433 ' HB3' HG23 ' A' ' 52' ' ' VAL . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.632 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.647 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.618 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.618 HG13 HD21 ' A' ' 12' ' ' LEU . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.478 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.592 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.592 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.516 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.478 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 . . . . . 0 N--CA 1.424 -1.743 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.437 ' HE3' ' OE1' ' A' ' 23' ' ' GLN . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.628 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.47 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.607 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.602 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.607 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.5 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.558 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 53' ' ' PHE . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.442 ' HG ' ' HE2' ' A' ' 33' ' ' HIS . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.477 ' O ' HG23 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.442 ' HE2' ' HG ' ' A' ' 13' ' ' CYS . 23.2 m80 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.574 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.53 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.459 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 . . . . . 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.641 HD21 HG13 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.468 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.468 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.499 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.641 HG13 HD21 ' A' ' 12' ' ' LEU . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.474 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.644 ' HB3' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 . . . . . 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 . . . . . 0 N--CA 1.442 -0.861 0 CA-C-O 121.33 0.586 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.666 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HG3' HD22 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.61 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.541 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.541 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.61 HG12 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 53' ' ' PHE . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 . . . . . 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 . . . . . 0 N--CA 1.431 -1.391 0 CA-C-O 122.73 1.253 . . . . 0.0 108.135 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.413 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.413 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.57 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.585 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.57 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.408 ' HB3' HG23 ' A' ' 52' ' ' VAL . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 74.1 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 49' ' ' ASP . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 . . . . . 0 N--CA 1.417 -2.122 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.644 HD21 HG13 ' A' ' 30' ' ' VAL . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CE1' HD23 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG13 HD21 ' A' ' 12' ' ' LEU . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.6 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.6 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.591 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.591 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.857 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.663 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.48 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.413 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.708 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 24' ' ' SER . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.721 ' HE1' ' HA ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.475 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 46.3 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.46 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.663 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 5.4 pp0? -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 30.0 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 . . . . . 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 . . . . . 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.622 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.452 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 9' ' ' LYS 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 21' ' ' TYR . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' HD2' ' A' ' 18' ' ' PRO . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.622 HG13 HD21 ' A' ' 12' ' ' LEU . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.452 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.483 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.442 ' HB3' HG23 ' A' ' 52' ' ' VAL . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.1 pp0? -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.572 ' HG2' ' NE2' ' A' ' 50' ' ' GLN . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 . . . . . 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.7 m170 . . . . . 0 N--CA 1.422 -1.851 0 CA-C-O 121.381 0.61 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.419 ' O ' ' HB3' ' A' ' 32' ' ' SER . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.444 ' HB2' HD12 ' A' ' 12' ' ' LEU . 49.8 m80 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.501 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.496 ' HG3' HD22 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HB2' HG23 ' A' ' 52' ' ' VAL . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 13.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.429 HG23 ' HB2' ' A' ' 49' ' ' ASP . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 . . . . . 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 . . . . . 0 N--CA 1.428 -1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.467 ' HB2' ' CB ' ' A' ' 10' ' ' CYS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HB3' ' CG ' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.549 ' CE1' ' HB2' ' A' ' 12' ' ' LEU . 6.5 m80 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.41 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HB3' HD13 ' A' ' 12' ' ' LEU . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.598 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 17.1 mm-40 -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.409 HG23 ' HB3' ' A' ' 49' ' ' ASP . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.412 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 53' ' ' PHE . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 N--CA 1.428 -1.527 0 CA-C-O 121.766 0.793 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 30' ' ' VAL . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.419 ' HZ ' ' HD1' ' A' ' 29' ' ' HIS . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.536 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.419 ' HD1' ' HZ ' ' A' ' 17' ' ' PHE . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.464 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.623 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 21.0 mm-40 -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 N--CA 1.413 -2.284 0 CA-C-O 121.581 0.705 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.523 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' CD2' ' A' ' 21' ' ' TYR . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.603 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.523 HG13 HD21 ' A' ' 12' ' ' LEU . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.51 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 52' ' ' VAL . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 4.3 pp0? -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.596 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 . . . . . 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.409 ' SG ' ' NE2' ' A' ' 33' ' ' HIS . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.409 ' NE2' ' SG ' ' A' ' 13' ' ' CYS . 43.1 m80 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HD12 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.674 ' HB3' HG22 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 49' ' ' ASP . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' PHE . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 . . . . . 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.406 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' HIS . . . . . 0.458 ' CD2' ' HZ ' ' A' ' 17' ' ' PHE . 0.3 OUTLIER -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.499 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.646 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.668 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.668 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.649 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 17.2 mm-40 -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.753 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.646 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.753 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.607 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -87.98 -156.67 0.06 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.948 2.432 . . . . 0.0 111.007 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -66.17 -29.81 70.17 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.197 0.523 . . . . 0.0 110.896 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.5 tpt -109.7 92.58 4.11 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -111.91 34.14 4.39 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 123.612 1.672 . . . . 0.0 110.192 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.0 t -106.2 25.43 2.04 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.322 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -85.69 6.37 27.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 113.846 -1.525 . . . . 0.0 110.216 178.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 33' ' ' HIS . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 23.1 mm-40 -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 12' ' ' LEU . 68.3 m80 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.429 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.613 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.429 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.425 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.478 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 59' ' ' THR . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -61.38 -32.12 72.03 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 55' ' ' ARG . 75.8 p -71.49 -21.57 61.91 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.894 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 43.8 m80 -78.3 -21.83 49.1 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.715 177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -89.22 -28.86 19.67 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.451 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 16.7 t70 -67.83 -49.53 61.74 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 122.124 0.964 . . . . 0.0 109.554 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 61.81 14.81 6.52 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 66.8 t30 60.04 32.3 20.99 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.378 1.071 . . . . 0.0 108.546 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 t 54.09 74.24 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.198 -176.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tt -74.59 99.48 3.64 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -84.82 -40.17 17.49 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.712 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -154.64 -55.63 0.1 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -177.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 C--N 1.301 -1.534 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.903 -179.868 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.517 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -76.9 25.14 0.46 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.268 2.645 . . . . 0.0 113.205 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -73.07 -25.37 60.88 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.846 0.832 . . . . 0.0 108.87 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 43.8 tpp -160.62 144.21 13.57 Favored 'General case' 0 N--CA 1.4 -2.973 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 4.8 p-10 -127.21 -169.39 2.03 Favored 'General case' 0 C--N 1.26 -3.318 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -174.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -157.62 28.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -93.33 11.4 28.35 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.348 -172.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.494 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 18.9 mm-40 -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.518 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.478 ' HB3' ' HE1' ' A' ' 60' ' ' HIS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.447 ' HB2' ' NE2' ' A' ' 60' ' ' HIS . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.467 ' HB3' HG23 ' A' ' 52' ' ' VAL . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' ASP . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -73.52 -35.24 65.55 Favored 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 62' ' ' ASP . 53.6 p -66.32 -27.01 67.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 118.254 0.479 . . . . 0.0 111.793 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.478 ' HE1' ' HB3' ' A' ' 37' ' ' CYS . 30.0 m80 -63.28 -41.65 99.02 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.602 0.715 . . . . 0.0 109.181 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -85.21 -24.63 27.78 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.199 -175.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.414 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 16.3 t70 -67.26 -59.65 3.25 Favored 'General case' 0 CA--C 1.482 -1.64 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.0 tt0 66.83 0.45 1.92 Allowed 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.784 -2.007 . . . . 0.0 112.693 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -86.3 -51.0 6.52 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.51 -17.6 12.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.974 -178.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.9 mt 58.83 -79.5 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 125.572 1.549 . . . . 0.0 114.145 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.2 m120 53.03 86.78 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 125.607 1.563 . . . . 0.0 112.972 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -127.0 -176.03 3.59 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.317 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 119.138 -0.458 . . . . 0.0 109.769 -179.734 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.739 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -62.08 116.51 3.52 Favored 'Trans proline' 0 C--O 1.25 1.099 0 C-N-CA 123.317 2.678 . . . . 0.0 112.006 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.9 p-80 -114.74 115.24 26.73 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.407 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.4 tpp -110.51 96.48 6.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.184 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -125.29 126.67 45.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.6 t -115.27 27.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -82.96 -2.27 54.66 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.022 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.431 ' HA ' ' CD2' ' A' ' 34' ' ' TRP . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.431 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.458 ' HE3' ' NE2' ' A' ' 50' ' ' GLN . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.514 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.514 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 16.1 mm-40 -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.483 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.483 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -63.71 -26.7 68.77 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 p -72.01 -20.26 61.73 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.195 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -78.32 -24.06 46.78 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -89.62 -27.93 19.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.251 0.548 . . . . 0.0 109.666 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -71.35 -36.77 71.63 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.243 1.021 . . . . 0.0 109.246 176.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 69.37 6.11 5.51 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 126.565 1.946 . . . . 0.0 113.049 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m120 69.22 0.27 2.78 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.982 1.313 . . . . 0.0 113.527 174.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.262 14.3 p 38.99 68.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 125.618 1.567 . . . . 0.0 113.346 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.4 pp -127.12 141.04 51.86 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -82.54 -43.77 16.72 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -152.56 -65.86 0.16 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 170.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.481 -1.691 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 176.203 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.291 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.88 147.44 80.59 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 122.825 2.35 . . . . 0.0 111.714 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -79.66 -63.31 1.44 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.957 0.408 . . . . 0.0 110.09 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 49.2 ttm 66.31 103.62 0.04 OUTLIER 'General case' 0 C--O 1.242 0.699 0 C-N-CA 125.462 1.505 . . . . 0.0 113.575 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.524 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 10.1 t0 -159.78 111.22 2.0 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 114.189 -1.369 . . . . 0.0 109.985 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.3 p -162.67 29.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 104.706 -2.331 . . . . 0.0 104.706 176.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -93.96 46.86 1.19 Allowed 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 112.782 -2.008 . . . . 0.0 110.388 -175.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.524 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.531 HG13 HD21 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 35.9 m80 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.556 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 47.9 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.549 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.537 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -55.71 -42.77 75.77 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 55' ' ' ARG . 82.3 p -62.7 -23.24 67.04 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.9 m80 -75.74 -22.11 56.84 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.422 0.63 . . . . 0.0 109.54 178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -103.83 -32.45 9.31 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.666 0.746 . . . . 0.0 110.913 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.447 ' C ' ' H ' ' A' ' 64' ' ' ASN . 7.4 t70 -103.05 17.78 23.24 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 125.735 1.614 . . . . 0.0 109.782 -171.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -45.32 22.45 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.447 ' H ' ' C ' ' A' ' 62' ' ' ASP . 45.9 m-80 -79.48 -9.06 59.54 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 172.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.42 -11.97 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.333 176.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.6 mt -81.53 94.4 6.87 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.5 t30 177.43 -40.26 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.56 101.4 9.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.241 -175.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 35.5 t70 . . . . . 0 C--N 1.297 -1.695 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 177.082 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.493 ' O ' ' HB ' ' A' ' 6' ' ' VAL . . . . . . . . 0 CA--C 1.489 -1.589 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -69.01 -18.17 40.67 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.222 1.948 . . . . 0.0 110.514 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -131.95 176.53 8.28 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.422 ' CE ' ' HA ' ' A' ' 4' ' ' MET . 4.5 mmt 70.13 -79.87 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 124.95 1.3 . . . . 0.0 112.491 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -129.38 120.77 26.12 Favored 'General case' 0 C--N 1.256 -3.499 0 CA-C-O 122.021 0.915 . . . . 0.0 111.209 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 1' ' ' GLY . 11.8 p -158.14 29.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.282 -2.341 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 177.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -104.82 7.32 34.47 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.672 -1.603 . . . . 0.0 110.728 -176.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.886 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.49 ' OE1' ' HA ' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.501 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.886 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 55.6 m80 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.451 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.61 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.647 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.433 ' HB3' HG23 ' A' ' 52' ' ' VAL . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.632 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.647 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 24.2 t-80 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.32 -34.01 75.79 Favored 'General case' 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 55' ' ' ARG . 72.3 p -68.18 -24.45 64.96 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 118.453 0.57 . . . . 0.0 111.267 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -69.74 -29.9 67.36 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 177.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -89.61 -37.01 14.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.784 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -74.9 -57.52 3.86 Favored 'General case' 0 CA--C 1.487 -1.463 0 CA-C-O 121.859 0.837 . . . . 0.0 110.231 -172.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 60.15 9.7 1.98 Allowed 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 113.276 -1.784 . . . . 0.0 112.922 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 62.94 17.32 9.94 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.718 1.607 . . . . 0.0 112.144 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.1 t 61.2 33.36 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 122.958 1.361 . . . . 0.0 108.205 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 92.8 mt -139.69 168.15 20.47 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.063 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -85.04 120.82 26.98 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 166.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -62.03 -52.55 63.51 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.044 0.45 . . . . 0.0 110.591 -174.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--N 1.292 -1.912 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 177.24 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.58 126.56 16.35 Favored 'Trans proline' 0 C--O 1.251 1.135 0 C-N-CA 122.725 2.283 . . . . 0.0 109.666 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 5' ' ' ASP . 0.4 OUTLIER -139.24 179.16 6.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.122 -174.02 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 45.8 mtm -75.79 -20.33 58.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 121.914 0.864 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.493 ' HA ' ' CE1' ' A' ' 3' ' ' HIS . 26.7 t0 75.95 146.78 0.09 Allowed 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 112.04 -2.345 . . . . 0.0 112.513 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.45 ' HB ' ' O ' ' A' ' 5' ' ' ASP . 10.1 p 170.38 -23.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.055 0 C-N-CA 125.726 1.61 . . . . 0.0 108.77 -175.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -131.79 84.95 2.21 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.618 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.618 HG13 HD21 ' A' ' 12' ' ' LEU . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.478 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' N ' ' HD2' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.592 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.592 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.516 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.478 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.6 t-80 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -57.73 -38.77 75.88 Favored 'General case' 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.2 p -69.59 -16.87 63.48 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.084 0.468 . . . . 0.0 111.701 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.9 m80 -83.35 -27.94 29.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -91.48 -22.78 20.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.621 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -91.67 -70.65 0.68 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-O 121.414 0.626 . . . . 0.0 110.799 -178.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 64.55 6.92 3.4 Favored 'General case' 0 C--N 1.292 -1.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.515 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -159.21 -12.23 0.06 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -174.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.0 t 66.72 20.39 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.265 0 CA-C-O 123.137 1.446 . . . . 0.0 110.096 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.5 tp -108.02 86.46 2.3 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -95.87 -9.19 32.07 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -73.58 -64.64 0.95 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.392 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.254 1.308 0 O-C-N 124.633 1.208 . . . . 0.0 112.381 175.21 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.619 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -60.89 -30.14 89.46 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.708 2.272 . . . . 0.0 110.808 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.3 m-70 -129.52 158.35 39.48 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.9 tpt -92.49 69.06 4.93 Favored 'General case' 0 C--N 1.298 -1.633 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.371 176.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.484 ' OD2' ' HG3' ' A' ' 8' ' ' LYS . 38.5 t70 169.74 154.18 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 125.636 1.575 . . . . 0.0 107.57 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.3 p -165.24 26.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 N-CA-C 106.097 -1.816 . . . . 0.0 106.097 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -112.0 9.16 20.41 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-N 114.187 -1.37 . . . . 0.0 112.559 -170.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.484 ' HG3' ' OD2' ' A' ' 5' ' ' ASP . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.628 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.47 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.607 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.602 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.607 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.5 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.558 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 53' ' ' PHE . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.59 -23.49 67.28 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.9 p -74.81 -30.84 61.53 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.329 0.585 . . . . 0.0 109.644 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.3 m80 -70.87 -32.53 69.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.719 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -83.66 -31.08 26.35 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.112 176.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.32 -54.12 33.78 Favored 'General case' 0 CA--C 1.488 -1.423 0 CA-C-O 122.015 0.912 . . . . 0.0 109.462 -178.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 65.75 1.76 1.9 Allowed 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 112.621 -2.081 . . . . 0.0 113.081 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -92.06 -42.02 10.19 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.5 73.09 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.52 0 CA-C-O 122.831 1.301 . . . . 0.0 111.866 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 pp -99.5 -10.65 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 122.871 1.319 . . . . 0.0 107.635 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -80.37 107.85 13.51 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.077 -1.874 . . . . 0.0 107.389 174.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -81.46 98.81 8.43 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.144 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 C--N 1.309 -1.161 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.082 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.498 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.02 119.32 6.33 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.671 2.247 . . . . 0.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 68.45 -86.89 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.387 1.075 . . . . 0.0 111.956 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 78.7 mtp -161.93 153.86 19.1 Favored 'General case' 0 CA--C 1.476 -1.884 0 N-CA-C 103.887 -2.634 . . . . 0.0 103.887 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -82.58 103.98 12.51 Favored 'General case' 0 C--N 1.273 -2.739 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.209 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -138.34 35.32 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.278 -2.518 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -92.4 9.39 34.38 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 112.264 -2.244 . . . . 0.0 110.431 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.477 ' O ' HG23 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 23.2 m80 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.574 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.53 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.459 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 39.9 t-80 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -59.42 -35.1 73.37 Favored 'General case' 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.4 p -72.22 -24.0 61.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.547 0.612 . . . . 0.0 111.514 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.8 m80 -74.18 -30.91 62.45 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 176.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -88.46 -29.94 19.79 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.271 0.558 . . . . 0.0 110.865 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.58 -32.54 69.97 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.094 0.949 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 59.91 69.92 0.67 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 112.615 -2.084 . . . . 0.0 109.48 -175.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -86.21 -15.94 39.29 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.131 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.362 14.8 p 62.14 -44.51 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 128.526 2.73 . . . . 0.0 114.878 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.5 121.65 26.17 Favored 'General case' 0 C--N 1.255 -3.525 0 C-N-CA 124.817 1.247 . . . . 0.0 107.984 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -64.83 116.29 6.18 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -89.35 70.47 8.14 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.207 0.527 . . . . 0.0 109.593 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.5 t0 . . . . . 0 CA--C 1.499 -0.989 0 C-N-CA 124.768 1.227 . . . . 0.0 108.426 177.652 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.523 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -66.82 121.13 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 121.773 1.649 . . . . 0.0 109.854 177.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -78.6 121.04 24.14 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.769 -177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.5 tpt -115.4 86.52 2.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -83.36 -2.93 56.93 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.175 0.988 . . . . 0.0 110.968 -174.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 t -110.96 31.55 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -170.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -83.62 -9.81 58.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.641 HD21 HG13 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.468 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.499 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.641 HG13 HD21 ' A' ' 12' ' ' LEU . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.474 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.644 ' HB3' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -59.12 -40.13 84.47 Favored 'General case' 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.1 p -63.64 -27.91 69.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -70.12 -33.81 72.3 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 177.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -89.44 -31.29 17.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.037 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.04 -44.82 62.76 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 121.798 0.809 . . . . 0.0 109.519 -176.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 56.85 20.47 5.26 Favored 'General case' 0 C--N 1.288 -2.095 0 C-N-CA 126.203 1.801 . . . . 0.0 113.58 173.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -81.45 5.8 16.57 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.094 -1.004 . . . . 0.0 111.295 178.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.1 -18.38 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 122.989 1.376 . . . . 0.0 108.361 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD12 ' OXT' ' A' ' 69' ' ' ASP . 50.1 tp -109.36 103.24 12.14 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.304 175.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -176.79 -55.09 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -62.63 -45.33 93.37 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 113.791 -1.55 . . . . 0.0 106.862 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.401 ' OXT' HD12 ' A' ' 66' ' ' LEU . 34.3 t70 . . . . . 0 N--CA 1.426 -1.674 0 N-CA-C 102.648 -3.093 . . . . 0.0 102.648 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.578 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.6 -38.07 94.86 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 122.912 2.408 . . . . 0.0 111.262 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.52 114.27 26.23 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 90.1 mtp -100.39 -176.76 3.3 Favored 'General case' 0 N--CA 1.395 -3.216 0 CA-C-O 121.826 0.822 . . . . 0.0 109.278 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -95.56 108.66 20.93 Favored 'General case' 0 C--N 1.255 -3.519 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.64 -176.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.9 p -157.23 46.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 123.534 1.635 . . . . 0.0 107.586 -175.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -82.14 -5.51 58.5 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.871 -175.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.666 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.433 ' SD ' ' HD2' ' A' ' 60' ' ' HIS . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HG3' HD22 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.61 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.541 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.541 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.61 HG12 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' ' 59' ' ' THR . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.564 ' HA ' ' CE1' ' A' ' 60' ' ' HIS . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -67.81 -25.2 65.45 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.597 HG22 ' O ' ' A' ' 56' ' ' HIS . 12.7 t -78.62 -33.39 47.39 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.792 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.564 ' CE1' ' HA ' ' A' ' 57' ' ' VAL . 3.7 p-80 -89.43 -11.2 43.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.771 175.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -80.17 -35.6 36.23 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -86.66 -25.48 24.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 122.256 1.027 . . . . 0.0 109.988 -176.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 57.29 32.94 22.56 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.433 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 32.6 p30 -81.81 -16.19 51.7 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.504 175.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t 60.7 70.6 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.545 0 C-N-CA 125.908 1.683 . . . . 0.0 112.774 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.9 tp -101.27 83.39 2.47 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.242 173.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -172.61 161.9 5.0 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -116.96 109.18 16.7 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.676 -1.209 . . . . 0.0 113.783 -171.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 C--O 1.259 1.601 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.632 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.792 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -86.21 124.42 2.45 Favored 'Trans proline' 0 N--CA 1.437 -1.797 0 C-N-CA 122.251 1.967 . . . . 0.0 110.904 179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -80.67 -87.84 0.08 Allowed 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 119.888 -0.725 . . . . 0.0 109.625 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 tpt 46.52 29.98 1.01 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.474 1.109 . . . . 0.0 110.33 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.66 2.71 54.41 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.721 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.6 57.77 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -97.79 -1.52 43.08 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.135 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.413 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.413 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.57 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.585 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.57 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.408 ' HB3' HG23 ' A' ' 52' ' ' VAL . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 74.1 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 49' ' ' ASP . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -59.95 -32.58 70.93 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 p -69.51 -25.62 64.13 Favored 'General case' 0 C--O 1.196 -1.752 0 CA-C-N 117.722 0.237 . . . . 0.0 111.164 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.2 m80 -75.62 -22.48 56.8 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.441 0.639 . . . . 0.0 109.48 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -91.78 -30.98 15.93 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.177 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -97.48 6.25 48.45 Favored 'General case' 0 CA--C 1.481 -1.701 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -68.38 12.4 0.13 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -115.11 -14.78 11.76 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.6 m -94.15 -0.72 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 CA-C-O 122.216 1.008 . . . . 0.0 109.524 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -102.39 118.15 36.26 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 173.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -85.54 130.35 34.6 Favored 'General case' 0 C--N 1.294 -1.834 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.291 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -96.61 14.03 26.22 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 C--N 1.302 -1.457 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.088 178.619 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.562 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -83.5 -3.75 10.77 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.056 1.837 . . . . 0.0 113.693 -175.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -109.57 -67.44 0.99 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.673 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 79.8 mtp 60.66 97.75 0.03 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 124.853 1.261 . . . . 0.0 110.801 -176.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 171.36 14.23 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.728 0.775 . . . . 0.0 109.852 -175.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.7 t -138.46 33.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -93.56 -26.64 17.03 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.402 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.644 HD21 HG13 ' A' ' 30' ' ' VAL . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CE1' HD23 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG13 HD21 ' A' ' 12' ' ' LEU . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 62.3 m80 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.6 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.6 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.591 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.591 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' HG23 ' A' ' 59' ' ' THR . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -65.03 -21.89 66.91 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.9 p -71.11 -28.87 64.62 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.7 m80 -77.19 -29.0 54.13 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.14 -179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -81.19 -30.39 34.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.823 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.536 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 17.8 t70 -72.34 -46.28 56.19 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-O 122.579 1.181 . . . . 0.0 109.233 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 66.79 15.57 10.17 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 112.787 -2.006 . . . . 0.0 111.222 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 63.9 t30 76.77 -25.03 0.21 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 126.194 1.797 . . . . 0.0 112.529 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.53 3.14 2.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 62' ' ' ASP . 45.2 mt -104.08 4.44 34.28 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 120.934 0.397 . . . . 0.0 110.45 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -73.36 -55.76 5.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.221 -177.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -113.87 105.06 12.81 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.537 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 CA--C 1.502 -0.888 0 C-N-CA 124.458 1.103 . . . . 0.0 108.498 177.966 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.4 106.55 1.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.159 1.906 . . . . 0.0 110.62 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -94.51 20.09 8.87 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.283 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.1 tpt -77.08 84.58 3.58 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.715 0.769 . . . . 0.0 110.409 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -158.43 127.8 5.71 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.451 176.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.2 p -155.44 21.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.305 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 170.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -124.12 -22.78 4.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 113.928 -1.487 . . . . 0.0 113.446 -170.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.857 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.663 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.477 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.413 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.708 ' HZ ' ' CD2' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 24' ' ' SER . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.721 ' HE1' ' HA ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.475 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 46.3 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.46 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.663 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 5.4 pp0? -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 30.0 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.414 ' O ' HG22 ' A' ' 59' ' ' THR . 39.0 t-80 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -63.99 -35.12 79.67 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 56' ' ' HIS . 14.2 t -72.51 -18.9 61.61 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.14 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -73.93 -32.75 63.66 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -83.02 -34.39 26.28 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.639 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.37 -46.39 60.5 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-O 122.203 1.002 . . . . 0.0 109.151 -178.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.453 ' HB3' HG12 ' A' ' 65' ' ' VAL . 43.6 tt0 59.28 4.43 0.47 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 126.649 1.98 . . . . 0.0 112.701 176.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 73.76 8.21 4.93 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.198 1.399 . . . . 0.0 110.766 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' A' ' 63' ' ' GLN . 13.4 p -95.36 -14.81 7.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 123.109 1.433 . . . . 0.0 108.092 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.7 tp -99.98 10.6 41.04 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.861 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -133.51 -179.36 5.47 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -94.81 106.65 18.64 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.845 0.831 . . . . 0.0 111.351 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--N 1.291 -1.975 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.756 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.099 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -88.83 28.61 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 122.916 2.41 . . . . 0.0 112.44 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -143.04 136.26 28.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.9 tpp 64.01 95.33 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.147 0.975 . . . . 0.0 112.025 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.35 20.33 0.87 Allowed 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.7 0.61 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -115.56 11.72 15.94 Favored 'General case' 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.622 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.452 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 9' ' ' LYS 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 21' ' ' TYR . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' HD2' ' A' ' 18' ' ' PRO . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.622 HG13 HD21 ' A' ' 12' ' ' LEU . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.452 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.483 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.442 ' HB3' HG23 ' A' ' 52' ' ' VAL . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.1 pp0? -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.572 ' HG2' ' NE2' ' A' ' 50' ' ' GLN . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.776 ' HA ' ' CE1' ' A' ' 60' ' ' HIS . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -68.2 -21.18 64.88 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 37.8 p -76.46 -46.39 27.06 Favored 'General case' 0 C--O 1.194 -1.825 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.071 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.776 ' CE1' ' HA ' ' A' ' 57' ' ' VAL 0.311 2.2 p-80 -71.44 -9.81 58.76 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 119.131 -1.028 . . . . 0.0 113.476 178.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.525 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 33.5 m-85 -92.83 -18.69 22.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.909 169.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.75 -12.95 10.18 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.608 -1.237 . . . . 0.0 113.622 -172.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 59' ' ' THR . 18.6 pt20 -76.41 52.85 0.8 Allowed 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 59.47 29.73 19.32 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.89 1.329 . . . . 0.0 110.899 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.62 -3.31 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 122.53 1.157 . . . . 0.0 110.495 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.495 ' O ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -121.92 116.65 24.76 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.6 177.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -92.16 94.49 9.23 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -105.08 -35.65 7.55 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.776 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 . . . . . 0 C--N 1.305 -1.362 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -176.834 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.388 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.561 ' HA ' ' OD1' ' A' ' 5' ' ' ASP . 44.2 Cg_endo -67.31 86.21 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.514 2.809 . . . . 0.0 114.289 -174.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -159.26 -52.59 0.06 Allowed 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.447 ' HA ' ' CE1' ' A' ' 7' ' ' HIS . 76.7 mtp -68.17 -27.89 66.81 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 122.897 1.332 . . . . 0.0 111.453 -175.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.561 ' OD1' ' HA ' ' A' ' 2' ' ' PRO . 7.1 p-10 -82.82 5.44 21.61 Favored 'General case' 0 C--N 1.249 -3.767 0 CA-C-N 112.944 -1.934 . . . . 0.0 111.944 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 t -119.62 8.59 6.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.447 ' CE1' ' HA ' ' A' ' 4' ' ' MET . 41.7 m170 -84.65 -0.62 54.07 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.813 -177.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.419 ' O ' ' HB3' ' A' ' 32' ' ' SER . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.444 ' HB2' HD12 ' A' ' 12' ' ' LEU . 49.8 m80 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.501 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.496 ' HG3' HD22 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HB2' HG23 ' A' ' 52' ' ' VAL . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 13.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.429 HG23 ' HB2' ' A' ' 49' ' ' ASP . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 59' ' ' THR . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -72.49 -32.94 66.59 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 56' ' ' HIS . 6.3 t -72.29 -24.21 61.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 118.092 0.406 . . . . 0.0 109.908 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -61.0 -41.85 97.3 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 171.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.52 -31.64 37.03 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.653 -177.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.495 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 26.8 t70 -69.28 -21.22 63.9 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.356 1.074 . . . . 0.0 109.024 177.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 54.66 20.37 2.91 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 127.994 2.517 . . . . 0.0 113.734 178.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 68.38 16.46 9.24 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.517 1.127 . . . . 0.0 110.545 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.3 t 52.74 71.06 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.115 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -155.64 160.44 40.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.776 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -111.89 102.5 10.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 122.031 0.919 . . . . 0.0 111.573 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.71 70.5 7.75 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.168 -174.646 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.958 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -77.31 103.66 1.77 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.407 2.071 . . . . 0.0 111.505 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 79.4 m80 -112.86 128.07 56.36 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 121.218 0.532 . . . . 0.0 110.69 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.9 ttp -99.03 29.98 3.62 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -146.87 155.1 42.06 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.293 -1.776 . . . . 0.0 108.267 -174.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 p -145.8 45.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.74 0 CA-C-O 124.275 1.988 . . . . 0.0 106.383 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 67.21 39.12 3.15 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.174 -2.739 . . . . 0.0 110.369 -176.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.467 ' HB2' ' CB ' ' A' ' 10' ' ' CYS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HB3' ' CG ' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.549 ' CE1' ' HB2' ' A' ' 12' ' ' LEU . 6.5 m80 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.537 ' SD ' ' HD2' ' A' ' 60' ' ' HIS . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.41 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HB3' HD13 ' A' ' 12' ' ' LEU . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.598 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 17.1 mm-40 -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.409 HG23 ' HB3' ' A' ' 49' ' ' ASP . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.412 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' HIS . . . . . 0.55 ' O ' HG22 ' A' ' 59' ' ' THR . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.604 ' HA ' ' CE1' ' A' ' 60' ' ' HIS . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -74.55 -17.19 60.77 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 56' ' ' HIS . 13.0 t -87.25 -36.83 17.71 Favored 'General case' 0 N--CA 1.427 -1.62 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.214 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.604 ' CE1' ' HA ' ' A' ' 57' ' ' VAL 0.262 4.3 p-80 -81.07 -13.1 59.09 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 118.48 -1.288 . . . . 0.0 111.862 174.771 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.31 -13.89 58.82 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 168.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' ' 59' ' ' THR . 28.7 t70 -90.49 -70.55 0.67 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.168 178.101 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 179.3 -31.51 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 126.073 1.749 . . . . 0.0 108.959 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 68.54 73.88 0.28 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.922 1.289 . . . . 0.0 111.945 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m 37.69 50.27 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.676 1.99 . . . . 0.0 114.293 175.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 44.8 tp -85.31 -2.91 58.59 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.06 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 61.77 -106.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -144.72 73.1 1.36 Allowed 'General case' 0 C--O 1.243 0.719 0 CA-C-N 117.956 0.344 . . . . 0.0 110.438 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.255 1.359 0 O-C-N 124.281 0.988 . . . . 0.0 110.803 -179.653 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.89 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.88 -32.09 36.92 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.303 2.002 . . . . 0.0 112.751 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.0 m80 62.95 14.74 7.77 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.438 1.095 . . . . 0.0 110.935 -176.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.2 ttm -137.54 121.51 17.75 Favored 'General case' 0 N--CA 1.412 -2.353 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.053 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -125.62 114.86 19.26 Favored 'General case' 0 C--N 1.274 -2.715 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.077 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -131.79 39.58 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 N-CA-C 104.168 -2.53 . . . . 0.0 104.168 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -91.32 1.98 56.72 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.54 -1.664 . . . . 0.0 110.374 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 30' ' ' VAL . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.419 ' HZ ' ' HD1' ' A' ' 29' ' ' HIS . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.536 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' HIS . . . . . 0.419 ' HD1' ' HZ ' ' A' ' 17' ' ' PHE . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.464 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.46 ' SD ' ' HB3' ' A' ' 60' ' ' HIS . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.623 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 21.0 mm-40 -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -62.97 -28.83 70.36 Favored 'General case' 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.1 p -73.77 -17.93 61.03 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.773 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.46 ' HB3' ' SD ' ' A' ' 39' ' ' MET . 46.9 m80 -81.03 -23.38 38.63 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -91.34 -21.03 21.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.197 174.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.415 ' OD2' HG22 ' A' ' 65' ' ' VAL . 16.3 t70 -80.39 -60.76 2.2 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 121.803 0.811 . . . . 0.0 109.634 -176.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 60.35 28.17 17.77 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-N 113.526 -1.67 . . . . 0.0 112.645 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.273 53.6 m-80 81.71 70.71 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.836 0 C-N-CA 126.38 1.872 . . . . 0.0 113.225 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.415 HG22 ' OD2' ' A' ' 62' ' ' ASP . 20.4 m -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 CA-C-O 121.983 0.896 . . . . 0.0 108.877 173.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -70.64 106.57 3.55 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -87.42 117.55 26.27 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -168.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -93.19 -45.39 7.89 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 170.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 C--N 1.308 -1.232 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.797 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.503 -0.68 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.416 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 9.8 Cg_endo -82.0 84.05 1.95 Allowed 'Trans proline' 0 N--CA 1.437 -1.808 0 C-N-CA 122.081 1.854 . . . . 0.0 112.458 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -85.85 99.94 11.73 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.1 mmt 67.78 -85.0 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.139 0.976 . . . . 0.0 109.761 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -157.15 114.57 3.1 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 113.811 -1.541 . . . . 0.0 107.115 175.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.6 p -131.63 23.43 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.027 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -101.58 8.14 41.96 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.692 -1.594 . . . . 0.0 109.929 -173.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.523 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' CD2' ' A' ' 21' ' ' TYR . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.603 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.523 HG13 HD21 ' A' ' 12' ' ' LEU . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.51 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 52' ' ' VAL . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 4.3 pp0? -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.596 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 59' ' ' THR . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.792 ' HA ' ' CE1' ' A' ' 60' ' ' HIS . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.68 -16.16 61.69 Favored 'General case' 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.52 HG23 ' O ' ' A' ' 55' ' ' ARG . 39.0 p -75.62 -45.73 35.69 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 118.752 0.706 . . . . 0.0 110.282 177.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.792 ' CE1' ' HA ' ' A' ' 57' ' ' VAL 0.272 3.0 p-80 -75.07 -18.45 60.29 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.623 -179.066 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.507 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 26.7 m-85 -82.57 -28.06 31.18 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.647 172.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -81.09 -41.42 22.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-O 122.296 1.046 . . . . 0.0 109.761 -178.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 69.8 -7.01 0.96 Allowed 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 126.343 1.857 . . . . 0.0 112.517 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.1 t30 72.65 6.42 5.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.093 1.357 . . . . 0.0 109.614 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.9 t -119.17 20.2 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.1 mt 73.74 152.89 0.13 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.384 1.474 . . . . 0.0 110.828 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -59.49 -36.81 76.74 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.343 -178.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.0 t80 56.03 84.7 0.08 Allowed 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.283 1.033 . . . . 0.0 111.767 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.488 -1.408 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.684 -178.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.381 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.82 45.37 1.3 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.795 2.997 . . . . 0.0 112.716 -179.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -68.69 -36.14 78.1 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.813 0.845 . . . . 0.0 109.81 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.3 tpt -131.89 102.51 5.88 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.625 ' HA ' ' SD ' ' A' ' 16' ' ' MET . 11.8 t70 -129.36 150.54 50.68 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 -177.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -125.62 25.1 3.06 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 123.344 1.545 . . . . 0.0 109.647 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 69.04 5.3 4.99 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 172.321 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 5' ' ' ASP . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.1 m80 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HD12 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.674 ' HB3' HG22 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 49' ' ' ASP . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' HG23 ' A' ' 59' ' ' THR . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.704 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -72.01 -17.06 62.07 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ARG . 76.7 p -73.55 -41.82 62.46 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 118.694 0.679 . . . . 0.0 109.594 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.704 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.265 0.7 OUTLIER -79.87 -16.89 54.48 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.454 179.112 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.474 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 23.3 m-85 -83.35 -23.58 32.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.311 0.577 . . . . 0.0 109.657 170.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.9 -36.53 31.07 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.13 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HB3' ' CD2' ' A' ' 66' ' ' LEU . 69.6 mm-40 75.03 0.08 3.45 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 113.42 -1.718 . . . . 0.0 113.131 -179.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.9 m120 71.36 21.46 4.61 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.227 1.011 . . . . 0.0 113.533 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.7 t 64.24 83.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.174 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.31 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' CD2' ' HB3' ' A' ' 63' ' ' GLN . 3.4 mm? -72.22 118.06 14.62 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.311 -0.858 . . . . 0.0 108.944 172.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -111.61 99.38 8.13 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 120.847 0.356 . . . . 0.0 110.823 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -69.41 -47.32 64.52 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 C--O 1.243 0.735 0 C-N-CA 126.319 1.848 . . . . 0.0 114.744 173.49 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.289 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -83.21 28.82 0.56 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.307 2.671 . . . . 0.0 112.211 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.88 93.38 2.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.726 0.774 . . . . 0.0 111.285 -177.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.7 mtp -132.64 96.26 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.902 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -138.28 165.62 26.27 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -176.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 t -119.45 25.97 4.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-O 123.8 1.762 . . . . 0.0 107.052 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 75.69 4.55 3.95 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-N 111.847 -2.433 . . . . 0.0 115.849 174.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.406 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.499 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.646 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.668 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.668 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.649 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 17.2 mm-40 -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.753 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.646 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.753 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.86 -16.59 63.37 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.3 p -76.79 -39.33 51.87 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 61.3 m80 -63.71 -32.68 74.25 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 114.684 -1.143 . . . . 0.0 109.689 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -90.33 -15.53 30.97 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.113 178.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -84.08 -73.32 0.43 Allowed 'General case' 0 CA--C 1.477 -1.835 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 49.79 16.39 0.21 Allowed 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 126.413 1.885 . . . . 0.0 112.815 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -107.36 -33.35 7.41 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 124.258 1.023 . . . . 0.0 110.379 -171.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.4 m -81.29 22.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.491 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.0 mp 56.75 77.55 0.25 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 123.46 0.704 . . . . 0.0 109.13 -174.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -87.74 106.31 17.97 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.835 -175.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -87.69 93.71 9.52 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.317 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--N 1.298 -1.646 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.265 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 . . . . . 0 N--CA 1.414 -2.252 0 CA-C-O 121.266 0.555 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 33' ' ' HIS . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.437 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.54 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.45 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 12' ' ' LEU . 68.0 m-70 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.429 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.613 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.429 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.425 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.478 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 . . . . . 0 N--CA 1.434 -1.243 0 CA-C-O 122.016 0.912 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.611 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.518 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' CYS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.467 ' HB3' HG23 ' A' ' 52' ' ' VAL . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' ASP . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 . . . . . 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 . . . . . 0 N--CA 1.421 -1.911 0 CA-C-O 121.74 0.781 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.431 ' HA ' ' CD2' ' A' ' 34' ' ' TRP . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.484 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 68.0 m-70 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.431 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.514 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.514 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.483 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.483 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 . . . . . 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 . . . . . 0 N--CA 1.419 -1.987 0 CA-C-O 121.871 0.843 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.549 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.531 HG13 HD21 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HB3' HE22 ' A' ' 43' ' ' GLN . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.556 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.2 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.549 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.537 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.58 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 . . . . . 0 N--CA 1.429 -1.501 0 CA-C-O 121.24 0.543 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.414 ' SG ' ' CE1' ' A' ' 29' ' ' HIS . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.687 ' HB2' ' ND1' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.669 ' SG ' ' CE1' ' A' ' 33' ' ' HIS . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.501 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.44 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 11.8 t-160 -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.609 ' HA ' ' CD2' ' A' ' 33' ' ' HIS . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.687 ' ND1' ' HB2' ' A' ' 12' ' ' LEU . 15.0 m-70 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.451 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.61 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.647 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.433 ' HB3' HG23 ' A' ' 52' ' ' VAL . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.632 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.647 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 70.3 t60 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 . . . . . 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.618 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.437 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.507 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.618 HG13 HD21 ' A' ' 12' ' ' LEU . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.507 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 75.4 m-70 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.478 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HD2' ' N ' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.592 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.592 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.516 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.478 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.403 ' HA ' ' NE2' ' A' ' 58' ' ' GLN . 22.6 mm-40 . . . . . 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 . . . . . 0 N--CA 1.424 -1.743 0 N-CA-C 112.559 0.577 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.437 ' HE3' ' OE1' ' A' ' 23' ' ' GLN . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.437 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.628 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.428 ' HB2' HE22 ' A' ' 43' ' ' GLN . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.47 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.607 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.602 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.607 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 23.2 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.558 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HA ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 69.6 t60 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 53' ' ' PHE . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.431 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.675 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.477 ' O ' HG23 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.503 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.675 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 25.9 m-70 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.496 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.574 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.53 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.459 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 . . . . . 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 . . . . . 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.641 HD21 HG13 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.485 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.468 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.468 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.499 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.494 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.641 HG13 HD21 ' A' ' 12' ' ' LEU . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.494 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 81.1 m-70 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.514 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.474 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.644 ' HB3' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 . . . . . 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 . . . . . 0 N--CA 1.442 -0.861 0 CA-C-O 121.33 0.586 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.666 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.404 ' O ' ' HD2' ' A' ' 29' ' ' HIS . 7.1 t-160 -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HG3' HD22 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.61 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.541 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.541 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.61 HG12 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 53' ' ' PHE . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 . . . . . 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 . . . . . 0 N--CA 1.431 -1.391 0 CA-C-O 122.73 1.253 . . . . 0.0 108.135 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.413 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.413 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.57 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.585 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.57 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.408 ' HB3' HG23 ' A' ' 52' ' ' VAL . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 25.7 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 49' ' ' ASP . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.646 HE21 ' HA ' ' A' ' 58' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 . . . . . 0 N--CA 1.417 -2.122 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.644 HD21 HG13 ' A' ' 30' ' ' VAL . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CE1' HD23 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.644 HG13 HD21 ' A' ' 12' ' ' LEU . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.6 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.6 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.591 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.591 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 76.5 t60 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 N--CA 1.435 -1.221 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.857 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.663 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.48 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.413 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HZ ' ' ND1' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 24' ' ' SER . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.775 ' HE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.538 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.475 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.9 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.46 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.663 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 4.4 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 80.6 t60 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 . . . . . 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.622 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.452 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 9' ' ' LYS 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 21' ' ' TYR . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' HD2' ' A' ' 18' ' ' PRO . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.622 HG13 HD21 ' A' ' 12' ' ' LEU . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.452 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.422 HE22 ' HB2' ' A' ' 31' ' ' GLU . 51.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.483 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.442 ' HB3' HG23 ' A' ' 52' ' ' VAL . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.528 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 . . . . . 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 41.7 m170 . . . . . 0 N--CA 1.422 -1.851 0 CA-C-O 121.381 0.61 . . . . 0.0 111.813 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.473 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.473 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 46.7 m-70 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.501 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.496 ' HG3' HD22 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HB2' HG23 ' A' ' 52' ' ' VAL . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 1.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.429 HG23 ' HB2' ' A' ' 49' ' ' ASP . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 . . . . . 0 N--CA 1.428 -1.555 0 CA-C-O 121.646 0.736 . . . . 0.0 110.369 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.58 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.62 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HB3' ' CG ' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.62 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 27.9 m-70 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.41 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HB3' HD13 ' A' ' 12' ' ' LEU . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.598 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.409 HG23 ' HB3' ' A' ' 49' ' ' ASP . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.412 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 53' ' ' PHE . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 . . . . . 0 N--CA 1.428 -1.527 0 CA-C-O 121.766 0.793 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 30' ' ' VAL . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.419 ' HZ ' ' HD1' ' A' ' 29' ' ' HIS . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.536 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.419 ' HD1' ' HZ ' ' A' ' 17' ' ' PHE . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.464 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.623 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.519 ' HA ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 . . . . . 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 . . . . . 0 N--CA 1.413 -2.284 0 CA-C-O 121.581 0.705 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.523 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' CD2' ' A' ' 21' ' ' TYR . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.603 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.441 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.523 HG13 HD21 ' A' ' 12' ' ' LEU . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.483 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 44.5 m-70 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.51 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 52' ' ' VAL . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.596 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 . . . . . 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 . . . . . 0 N--CA 1.427 -1.602 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.638 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . 0.523 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.638 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 41.3 m-70 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HD12 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.674 ' HB3' HG22 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 49' ' ' ASP . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 53' ' ' PHE . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 . . . . . 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 . . . . . 0 N--CA 1.421 -1.921 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.406 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.499 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.646 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.668 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.668 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.649 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.753 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.646 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.753 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 . . . . . 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.607 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -87.98 -156.67 0.06 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.948 2.432 . . . . 0.0 111.007 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 71.1 m80 -66.17 -29.81 70.17 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.197 0.523 . . . . 0.0 110.896 178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.416 ' O ' ' HD2' ' A' ' 7' ' ' HIS . 12.5 tpt -109.7 92.58 4.11 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 174.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -111.91 34.14 4.39 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 123.612 1.672 . . . . 0.0 110.192 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.0 t -106.2 25.43 2.04 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.322 0 N-CA-C 104.83 -2.285 . . . . 0.0 104.83 -178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.416 ' HD2' ' O ' ' A' ' 4' ' ' MET . 88.3 m-70 -85.69 6.37 27.93 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-N 113.846 -1.525 . . . . 0.0 110.216 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -82.07 78.79 8.72 Favored 'General case' 0 N--CA 1.418 -2.048 0 CA-C-O 122.75 1.262 . . . . 0.0 109.698 178.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 18.9 ptmt -133.15 139.88 47.3 Favored 'General case' 0 C--N 1.263 -3.193 0 CA-C-N 112.637 -2.074 . . . . 0.0 107.81 177.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 29.8 t -65.69 114.31 15.5 Favored Pre-proline 0 C--N 1.278 -2.506 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 173.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -69.75 -7.7 21.72 Favored 'Trans proline' 0 C--N 1.328 -0.549 0 C-N-CA 121.484 1.456 . . . . 0.0 111.712 -177.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.526 HD12 ' HB2' ' A' ' 33' ' ' HIS . 20.9 mt -93.51 -27.77 16.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.682 -175.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.437 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 17.7 p -133.7 -4.63 2.88 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.541 176.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.471 10.6 pt-20 52.13 56.72 7.34 Favored 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 126.388 1.875 . . . . 0.0 115.535 -171.67 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.0 tp -89.74 125.72 35.39 Favored 'General case' 0 N--CA 1.424 -1.741 0 N-CA-C 104.578 -2.379 . . . . 0.0 104.578 168.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 45.1 ttp -101.97 130.54 48.53 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 123.344 0.403 . . . . 0.0 110.469 -173.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.438 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 80.1 m-85 -109.9 166.34 10.97 Favored Pre-proline 0 C--N 1.296 -1.73 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.91 158.35 57.07 Favored 'Trans proline' 0 CA--C 1.542 0.917 0 C-N-CA 121.773 1.649 . . . . 0.0 110.309 173.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -61.21 -19.86 65.53 Favored 'Trans proline' 0 N--CA 1.483 0.897 0 C-N-CA 123.042 2.495 . . . . 0.0 113.082 179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -96.86 10.89 37.67 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.966 -175.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 88.8 t80 -77.27 143.97 38.49 Favored 'General case' 0 N--CA 1.404 -2.737 0 CA-C-O 121.921 0.867 . . . . 0.0 112.093 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.494 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.3 m-20 -53.87 116.78 2.72 Favored 'General case' 0 C--N 1.294 -1.826 0 CA-C-N 112.42 -2.173 . . . . 0.0 111.435 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.54 ' HA ' HE21 ' A' ' 23' ' ' GLN . 0.0 OUTLIER -57.11 -44.16 83.0 Favored 'General case' 0 C--N 1.287 -2.129 0 CA-C-N 114.299 -1.319 . . . . 0.0 112.04 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 67.4 m -71.81 -31.3 66.42 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 120.973 0.416 . . . . 0.0 111.219 -178.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 59.1 mttp -71.82 -26.02 62.22 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.506 0.67 . . . . 0.0 110.106 175.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.447 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.2 t80 -71.04 -50.26 35.9 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.329 174.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 50.5 mt-10 -60.25 -38.92 84.96 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 123.732 0.813 . . . . 0.0 111.504 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.525 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 11.8 pt-20 -68.72 -26.01 65.05 Favored 'General case' 0 CA--C 1.479 -1.776 0 C-N-CA 120.459 -0.496 . . . . 0.0 110.886 177.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.45 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.3 t60 -77.6 -37.77 49.66 Favored 'General case' 0 N--CA 1.413 -2.307 0 C-N-CA 119.521 -0.871 . . . . 0.0 108.857 176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.3 t -61.87 -44.25 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -69.87 -11.41 60.84 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.4 m -81.9 -29.63 32.29 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.526 ' HB2' HD12 ' A' ' 12' ' ' LEU . 68.0 m-70 -75.32 -26.15 58.41 Favored 'General case' 0 CA--C 1.485 -1.524 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.363 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.429 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 29.2 m0 -70.98 105.03 3.15 Favored 'General case' 1 N--CA 1.375 -4.216 0 N-CA-C 105.532 -2.025 . . . . 0.0 105.532 168.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -72.56 114.08 10.31 Favored 'General case' 0 N--CA 1.411 -2.392 0 CA-C-O 122.36 1.076 . . . . 0.0 111.195 -169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.3 p -94.67 126.7 47.05 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.067 0 CA-C-N 112.969 -1.923 . . . . 0.0 112.144 -174.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.613 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.5 t -82.48 120.75 77.41 Favored Pre-proline 0 N--CA 1.415 -2.198 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.93 -22.6 48.32 Favored 'Trans proline' 0 C--N 1.325 -0.707 0 C-N-CA 122.212 1.941 . . . . 0.0 110.776 -175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 41.2 mtm -95.56 -6.43 40.39 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.361 -1.291 . . . . 0.0 112.356 -176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.745 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 8.7 m -116.96 -22.92 8.24 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.101 0.477 . . . . 0.0 110.435 174.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 84.4 p 58.94 29.27 18.7 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.385 1.474 . . . . 0.0 109.618 -172.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.9 mt-10 -110.3 137.07 48.53 Favored 'General case' 1 N--CA 1.378 -4.067 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.377 -179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -100.67 126.26 47.17 Favored 'General case' 1 C--N 1.224 -4.86 0 CA-C-N 111.93 -2.395 . . . . 0.0 106.715 -178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -102.17 141.21 22.08 Favored Pre-proline 0 C--N 1.281 -2.381 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.42 160.79 22.41 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.88 2.387 . . . . 0.0 112.745 -173.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.429 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 30.4 Cg_endo -67.34 -16.17 47.43 Favored 'Trans proline' 0 C--N 1.331 -0.378 0 C-N-CA 122.307 2.005 . . . . 0.0 109.755 175.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -78.04 -8.5 58.27 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.25 -1.341 . . . . 0.0 110.172 178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -89.14 154.8 19.87 Favored 'General case' 0 N--CA 1.395 -3.205 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 -178.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -92.2 136.45 33.18 Favored 'General case' 1 C--N 1.24 -4.156 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.386 -174.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.578 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.33 -35.61 77.88 Favored 'General case' 0 C--N 1.292 -1.922 0 O-C-N 123.687 0.617 . . . . 0.0 111.255 175.899 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.425 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 41.2 mt-30 -64.03 -45.73 87.58 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.96 -39.74 80.14 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.903 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.49 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.478 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.1 t80 -64.35 -44.73 90.54 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.738 178.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 56.9 mt-10 -64.65 -37.27 86.99 Favored 'General case' 0 CA--C 1.506 -0.715 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.867 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.451 ' O ' HG23 ' A' ' 59' ' ' THR . 9.1 mpt_? -71.49 -34.1 69.84 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.571 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.542 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 74.0 t60 -59.43 -48.28 82.24 Favored 'General case' 0 C--O 1.208 -1.104 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.534 172.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 53' ' ' PHE . 61.1 t -67.14 -37.06 78.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -177.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -61.38 -32.12 72.03 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.815 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 55' ' ' ARG . 75.8 p -71.49 -21.57 61.91 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.576 -0.45 . . . . 0.0 110.894 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.745 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.3 m-70 -78.3 -21.83 49.1 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.715 177.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -89.22 -28.86 19.67 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.451 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 16.7 t70 -67.83 -49.53 61.74 Favored 'General case' 0 CA--C 1.483 -1.601 0 CA-C-O 122.124 0.964 . . . . 0.0 109.554 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 61.81 14.81 6.52 Favored 'General case' 0 C--N 1.293 -1.849 0 CA-C-N 112.899 -1.955 . . . . 0.0 112.395 175.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 60.04 32.3 20.99 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.378 1.071 . . . . 0.0 108.546 -175.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 t 54.09 74.24 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.198 -176.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.1 tt -74.59 99.48 3.64 Favored 'General case' 0 N--CA 1.433 -1.322 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -84.82 -40.17 17.49 Favored 'General case' 0 C--N 1.296 -1.727 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.712 -177.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -154.64 -55.63 0.1 Allowed 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 -177.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 C--N 1.301 -1.534 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.903 -179.868 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.517 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -76.9 25.14 0.46 Allowed 'Trans proline' 0 CA--C 1.547 1.13 0 C-N-CA 123.268 2.645 . . . . 0.0 113.205 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 m80 -73.07 -25.37 60.88 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 121.846 0.832 . . . . 0.0 108.87 -179.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 43.8 tpp -160.62 144.21 13.57 Favored 'General case' 0 N--CA 1.4 -2.973 0 N-CA-C 103.953 -2.61 . . . . 0.0 103.953 175.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 4.8 p-10 -127.21 -169.39 2.03 Favored 'General case' 0 C--N 1.26 -3.318 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -174.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -157.62 28.36 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.287 -2.136 0 N-CA-C 106.626 -1.62 . . . . 0.0 106.626 174.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -93.33 11.4 28.35 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 114.156 -1.383 . . . . 0.0 111.348 -172.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.3 mmtp -81.93 83.77 7.13 Favored 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.178 -1.373 . . . . 0.0 108.264 -177.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.9 mmtm -133.21 136.4 45.62 Favored 'General case' 0 CA--C 1.486 -1.486 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 176.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.4 t -74.23 110.15 8.71 Favored Pre-proline 0 C--N 1.292 -1.918 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 176.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -71.15 -1.21 9.22 Favored 'Trans proline' 0 CA--C 1.532 0.404 0 C-N-CA 122.028 1.819 . . . . 0.0 113.412 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.518 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 6.2 mp -100.0 -23.01 15.03 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.747 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.8 p -130.09 -12.15 4.14 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 121.37 0.605 . . . . 0.0 112.49 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 73.59 16.44 3.93 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 125.725 1.61 . . . . 0.0 112.731 -179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.9 tp -62.06 129.94 43.19 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 175.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 87.3 mtp -88.14 140.36 29.57 Favored 'General case' 0 C--N 1.292 -1.908 0 CA-C-N 115.085 -0.962 . . . . 0.0 109.629 -175.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -122.17 159.04 53.7 Favored Pre-proline 0 N--CA 1.433 -1.32 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -63.52 147.61 93.0 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 121.761 1.641 . . . . 0.0 110.634 175.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 25.1 Cg_exo -40.87 -43.77 4.71 Favored 'Trans proline' 0 N--CA 1.48 0.714 0 C-N-CA 124.623 3.549 . . . . 0.0 115.058 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -100.7 24.98 8.35 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.767 -173.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -62.85 145.11 55.83 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-O 121.609 0.719 . . . . 0.0 109.671 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.515 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 19.4 t70 -68.52 130.56 43.23 Favored 'General case' 0 C--N 1.265 -3.097 0 CA-C-N 113.248 -1.796 . . . . 0.0 110.951 -174.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.611 HE21 ' HA ' ' A' ' 23' ' ' GLN . 0.0 OUTLIER -61.84 -38.98 90.25 Favored 'General case' 0 C--N 1.265 -3.076 0 CA-C-N 113.885 -1.507 . . . . 0.0 112.714 179.735 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.435 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 37.4 m -78.04 -32.72 51.08 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-O 121.03 0.443 . . . . 0.0 110.412 -177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.515 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.7 mmtm -71.71 -26.98 62.72 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.489 0.661 . . . . 0.0 109.812 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 76.3 t80 -62.46 -47.7 82.86 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 174.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.7 -31.03 71.81 Favored 'General case' 0 C--O 1.208 -1.088 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.025 176.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 24' ' ' SER . 7.2 mm-40 -60.83 -26.82 67.61 Favored 'General case' 0 CA--C 1.474 -1.971 0 C-N-CA 122.547 0.339 . . . . 0.0 110.131 175.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -86.74 -51.45 6.1 Favored 'General case' 0 N--CA 1.4 -2.938 0 C-N-CA 118.755 -1.178 . . . . 0.0 108.985 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 26' ' ' PHE . 22.2 t -59.24 -43.2 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 N-CA-C 111.961 0.356 . . . . 0.0 111.961 -172.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -66.58 -25.15 66.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.001 0.429 . . . . 0.0 110.439 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.6 m -81.02 -10.43 59.7 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.686 -178.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.518 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 4.3 m-70 -77.5 -37.51 50.96 Favored 'General case' 0 CA--C 1.488 -1.41 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.439 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.401 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 12.3 m0 -61.74 123.09 16.99 Favored 'General case' 1 N--CA 1.37 -4.439 0 C-N-CA 123.984 0.914 . . . . 0.0 109.391 179.36 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.2 mmtt -72.1 99.37 2.3 Favored 'General case' 0 C--N 1.296 -1.749 0 CA-C-N 114.686 -1.143 . . . . 0.0 110.398 -174.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.589 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.5 p -96.42 121.35 46.86 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.101 0 CA-C-N 113.576 -1.647 . . . . 0.0 112.257 -176.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.458 ' HB2' ' HB2' ' A' ' 40' ' ' CYS . 61.5 m -62.64 136.19 96.02 Favored Pre-proline 0 N--CA 1.417 -2.11 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 173.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 10.9 Cg_exo -68.68 -28.13 31.29 Favored 'Trans proline' 0 C--N 1.322 -0.842 0 C-N-CA 121.695 1.596 . . . . 0.0 110.151 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.647 ' HB2' ' CE1' ' A' ' 60' ' ' HIS . 4.7 mpp? -92.07 -31.42 15.56 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.344 -178.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.56 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 94.2 m -97.46 -30.07 13.12 Favored 'General case' 0 CA--C 1.505 -0.766 0 C-N-CA 119.025 -1.07 . . . . 0.0 111.029 -176.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.0 m 65.09 31.36 11.08 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 122.936 1.351 . . . . 0.0 108.218 -170.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.589 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 40.5 tt0 -102.96 120.85 41.37 Favored 'General case' 0 CA--C 1.451 -2.84 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 -178.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 67.3 mt-30 -101.56 126.75 48.42 Favored 'General case' 1 C--N 1.211 -5.445 0 CA-C-N 112.435 -2.166 . . . . 0.0 108.814 -176.13 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -102.06 144.5 28.71 Favored Pre-proline 0 C--N 1.282 -2.336 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.16 165.46 21.86 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 122.477 2.118 . . . . 0.0 112.337 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.76 -16.49 53.61 Favored 'Trans proline' 0 N--CA 1.484 0.95 0 C-N-CA 123.12 2.547 . . . . 0.0 112.496 179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -73.08 -13.68 61.25 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.428 0.632 . . . . 0.0 110.062 177.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -87.86 123.22 32.39 Favored 'General case' 0 N--CA 1.393 -3.309 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 176.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.467 ' HB3' HG23 ' A' ' 52' ' ' VAL . 8.4 t70 -70.42 136.45 49.58 Favored 'General case' 0 C--N 1.261 -3.271 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.482 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 6.1 tt0 -62.78 -32.84 74.09 Favored 'General case' 0 C--N 1.27 -2.861 0 O-C-N 124.288 0.993 . . . . 0.0 109.857 -178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 -76.14 -21.67 56.31 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 120.912 0.387 . . . . 0.0 110.714 -179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.467 HG23 ' HB3' ' A' ' 49' ' ' ASP . 53.5 t -77.15 -40.8 30.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 173.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 57' ' ' VAL . 52.4 t80 -64.85 -33.3 75.67 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.493 175.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 75.9 mm-40 -58.19 -30.86 66.76 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 123.136 0.574 . . . . 0.0 110.762 176.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -72.01 -35.94 69.57 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.585 176.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -66.82 -37.02 83.7 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 53' ' ' PHE . 60.4 t -61.44 -36.19 71.49 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -73.52 -35.24 65.55 Favored 'General case' 0 C--O 1.197 -1.698 0 CA-C-N 114.374 -1.285 . . . . 0.0 112.463 177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.414 ' HA ' ' HB3' ' A' ' 62' ' ' ASP . 53.6 p -66.32 -27.01 67.58 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 118.254 0.479 . . . . 0.0 111.793 179.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.647 ' CE1' ' HB2' ' A' ' 39' ' ' MET . 70.0 m-70 -63.28 -41.65 99.02 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.602 0.715 . . . . 0.0 109.181 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -85.21 -24.63 27.78 Favored 'General case' 0 CA--C 1.492 -1.264 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.199 -175.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.414 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 16.3 t70 -67.26 -59.65 3.25 Favored 'General case' 0 CA--C 1.482 -1.64 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 174.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 66.83 0.45 1.92 Allowed 'General case' 0 C--N 1.288 -2.089 0 CA-C-N 112.784 -2.007 . . . . 0.0 112.693 175.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 38.1 m-80 -86.3 -51.0 6.52 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.3 m -79.51 -17.6 12.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.278 -0.873 . . . . 0.0 111.974 -178.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 95.9 mt 58.83 -79.5 0.02 OUTLIER 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 125.572 1.549 . . . . 0.0 114.145 -178.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.2 m120 53.03 86.78 0.04 OUTLIER 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 125.607 1.563 . . . . 0.0 112.972 -178.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -127.0 -176.03 3.59 Favored 'General case' 0 N--CA 1.437 -1.091 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.317 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 . . . . . 0 C--N 1.3 -1.583 0 CA-C-O 119.138 -0.458 . . . . 0.0 109.769 -179.734 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.739 0 N-CA-C 111.662 -0.575 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -62.08 116.51 3.52 Favored 'Trans proline' 0 C--O 1.25 1.099 0 C-N-CA 123.317 2.678 . . . . 0.0 112.006 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 27.9 p-80 -114.74 115.24 26.73 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.407 -177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.4 tpp -110.51 96.48 6.22 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.003 -0.999 . . . . 0.0 109.184 179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -125.29 126.67 45.49 Favored 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.6 t -115.27 27.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 90.8 m-70 -82.96 -2.27 54.66 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 114.112 -1.404 . . . . 0.0 111.022 -177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -115.19 86.4 2.45 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 115.02 -0.991 . . . . 0.0 108.339 178.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 25.2 pttm -133.18 143.65 49.34 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 36.7 t -67.35 110.88 5.93 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 171.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -73.38 3.01 5.06 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 121.947 1.764 . . . . 0.0 111.72 -175.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.427 ' HG ' ' HG3' ' A' ' 46' ' ' PRO . 6.9 mp -97.5 -29.59 13.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.94 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.484 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.1 p -130.74 -13.31 3.71 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 119.5 -0.88 . . . . 0.0 112.579 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 65.59 78.64 0.27 Allowed 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 124.454 1.102 . . . . 0.0 109.622 -174.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 26.8 tp -128.91 130.9 47.41 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 177.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.9 ttt -85.9 134.14 33.91 Favored 'General case' 0 C--N 1.295 -1.789 0 O-C-N 124.051 0.845 . . . . 0.0 111.508 -175.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 82.3 m-85 -123.97 152.57 66.8 Favored Pre-proline 0 C--N 1.297 -1.692 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 174.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.15 148.68 92.76 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 122.452 2.101 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -59.29 -19.8 52.27 Favored 'Trans proline' 0 C--O 1.241 0.668 0 C-N-CA 123.051 2.501 . . . . 0.0 113.678 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -107.81 22.03 16.56 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 120.4 -0.52 . . . . 0.0 111.898 179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -80.12 153.23 28.83 Favored 'General case' 0 N--CA 1.405 -2.69 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' A' ' 25' ' ' LYS . 11.0 t70 -65.06 124.22 21.54 Favored 'General case' 0 C--N 1.277 -2.548 0 CA-C-N 114.495 -1.229 . . . . 0.0 110.715 -176.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.598 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 12.1 mm100 -59.72 -39.34 84.32 Favored 'General case' 0 C--N 1.269 -2.925 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.378 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.559 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 66.4 m -81.55 -31.32 32.75 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 120.379 -0.528 . . . . 0.0 111.837 -176.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' A' ' 22' ' ' ASP . 38.2 mmtm -67.84 -27.68 66.9 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 174.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 61.1 t80 -66.16 -48.33 71.12 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.76 172.133 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.598 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 45.7 mt-10 -60.8 -36.09 78.15 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 123.993 0.917 . . . . 0.0 111.053 178.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 24' ' ' SER . 5.9 mm-40 -60.53 -35.93 77.19 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 174.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -77.8 -36.36 50.45 Favored 'General case' 0 C--N 1.285 -2.215 0 C-N-CA 119.621 -0.832 . . . . 0.0 110.236 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 26' ' ' PHE . 41.2 t -64.74 -43.63 96.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.431 ' HA ' ' CD2' ' A' ' 34' ' ' TRP . 8.9 pt-20 -67.41 -21.61 65.57 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.855 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.7 m -72.16 -27.97 62.93 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 120.963 0.411 . . . . 0.0 110.706 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.484 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 68.0 m-70 -76.05 -27.98 57.49 Favored 'General case' 0 CA--C 1.5 -0.946 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 175.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.431 ' CD2' ' HA ' ' A' ' 31' ' ' GLU . 30.6 m0 -63.0 122.37 15.87 Favored 'General case' 0 N--CA 1.395 -3.195 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 174.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -75.67 107.61 7.95 Favored 'General case' 0 C--N 1.287 -2.121 0 CA-C-N 114.71 -1.132 . . . . 0.0 110.755 -172.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.514 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.0 p -95.25 131.03 43.15 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.03 0 CA-C-N 113.713 -1.585 . . . . 0.0 113.155 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 44.3 t -80.44 122.34 82.47 Favored Pre-proline 0 N--CA 1.425 -1.706 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 173.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -67.4 -15.74 46.18 Favored 'Trans proline' 0 C--N 1.323 -0.788 0 C-N-CA 122.838 2.359 . . . . 0.0 112.195 -172.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.8 mtm -105.35 -6.4 19.63 Favored 'General case' 0 C--N 1.306 -1.303 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.049 -177.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.838 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 48.5 m -119.54 -28.68 5.27 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.214 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.6 t 68.01 26.64 7.29 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -174.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.453 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 47.5 tt0 -100.11 114.94 28.66 Favored 'General case' 0 N--CA 1.401 -2.916 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -177.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.514 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 34.3 mt-30 -94.45 127.72 40.54 Favored 'General case' 1 C--N 1.225 -4.81 0 CA-C-N 111.745 -2.479 . . . . 0.0 108.638 -178.596 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -102.15 145.01 29.74 Favored Pre-proline 0 C--N 1.274 -2.698 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.016 179.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -67.68 160.68 47.06 Favored 'Trans proline' 0 N--CA 1.452 -0.949 0 C-N-CA 122.601 2.201 . . . . 0.0 112.745 -175.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HG3' ' HG ' ' A' ' 12' ' ' LEU . 57.3 Cg_endo -67.44 -13.2 38.4 Favored 'Trans proline' 0 N--CA 1.477 0.546 0 C-N-CA 123.202 2.601 . . . . 0.0 112.963 -178.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -100.28 12.16 37.74 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.415 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -87.51 -172.76 4.05 Favored 'General case' 0 N--CA 1.394 -3.27 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -110.33 130.37 55.56 Favored 'General case' 0 C--N 1.267 -2.999 0 N-CA-C 106.849 -1.538 . . . . 0.0 106.849 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -61.64 -35.63 78.46 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 123.578 0.549 . . . . 0.0 111.833 178.953 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.483 ' HB3' HH11 ' A' ' 55' ' ' ARG . 70.4 mt-30 -76.58 -32.53 58.19 Favored 'General case' 0 C--N 1.307 -1.26 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.507 -177.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 75.9 t -69.86 -35.04 63.04 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -66.68 -46.5 75.43 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.272 175.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.54 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 40.3 mt-10 -62.83 -38.55 91.21 Favored 'General case' 0 C--O 1.213 -0.85 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.212 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.483 HH11 ' HB3' ' A' ' 51' ' ' GLN . 5.4 mpt_? -61.74 -35.92 79.49 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.924 0.392 . . . . 0.0 110.569 176.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.455 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 70.1 t60 -61.81 -50.37 72.56 Favored 'General case' 0 C--O 1.209 -1.028 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 174.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 73.2 t -67.08 -37.16 78.75 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.422 0.63 . . . . 0.0 110.258 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -63.71 -26.7 68.77 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.5 p -72.01 -20.26 61.73 Favored 'General case' 0 C--O 1.217 -0.628 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.195 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.838 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 37.4 m-70 -78.32 -24.06 46.78 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -89.62 -27.93 19.86 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.251 0.548 . . . . 0.0 109.666 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -71.35 -36.77 71.63 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.243 1.021 . . . . 0.0 109.246 176.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 69.37 6.11 5.51 Favored 'General case' 0 C--N 1.299 -1.623 0 C-N-CA 126.565 1.946 . . . . 0.0 113.049 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 17.7 m120 69.22 0.27 2.78 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.982 1.313 . . . . 0.0 113.527 174.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.262 14.3 p 38.99 68.03 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 125.618 1.567 . . . . 0.0 113.346 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.4 pp -127.12 141.04 51.86 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -176.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -82.54 -43.77 16.72 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 56.6 m-85 -152.56 -65.86 0.16 Allowed 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 170.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 36.4 t70 . . . . . 0 CA--C 1.481 -1.691 0 N-CA-C 106.163 -1.792 . . . . 0.0 106.163 176.203 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.291 0 N-CA-C 110.774 -0.931 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.88 147.44 80.59 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 122.825 2.35 . . . . 0.0 111.714 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -79.66 -63.31 1.44 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.957 0.408 . . . . 0.0 110.09 -178.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 49.2 ttm 66.31 103.62 0.04 OUTLIER 'General case' 0 C--O 1.242 0.699 0 C-N-CA 125.462 1.505 . . . . 0.0 113.575 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.524 ' O ' ' HB3' ' A' ' 19' ' ' PRO . 10.1 t0 -159.78 111.22 2.0 Favored 'General case' 0 C--N 1.29 -2.007 0 CA-C-N 114.189 -1.369 . . . . 0.0 109.985 178.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.3 p -162.67 29.12 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.277 -2.582 0 N-CA-C 104.706 -2.331 . . . . 0.0 104.706 176.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -93.96 46.86 1.19 Allowed 'General case' 0 N--CA 1.419 -1.987 0 CA-C-N 112.782 -2.008 . . . . 0.0 110.388 -175.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -105.55 88.39 2.83 Favored 'General case' 0 C--N 1.281 -2.373 0 CA-C-N 114.872 -1.058 . . . . 0.0 108.963 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -125.56 126.81 45.4 Favored 'General case' 0 CA--C 1.468 -2.208 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 173.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.5 t -53.62 113.71 5.24 Favored Pre-proline 0 C--N 1.305 -1.362 0 O-C-N 124.538 1.148 . . . . 0.0 108.096 173.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -63.02 -11.47 24.94 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 122.026 1.817 . . . . 0.0 113.027 -174.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.549 ' CD1' ' HG2' ' A' ' 46' ' ' PRO . 0.4 OUTLIER -92.65 -42.07 9.84 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -177.556 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.5 p -120.26 -18.84 7.88 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.576 -177.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.391 27.1 mt-10 62.07 75.84 0.39 Allowed 'General case' 0 C--N 1.292 -1.919 0 C-N-CA 125.422 1.489 . . . . 0.0 114.94 -172.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 23.9 tp -103.54 133.19 48.98 Favored 'General case' 0 N--CA 1.417 -2.084 0 N-CA-C 103.233 -2.877 . . . . 0.0 103.233 170.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.3 ttt -100.81 128.48 46.83 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-O 121.241 0.543 . . . . 0.0 111.152 -172.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -113.05 151.69 44.36 Favored Pre-proline 0 C--N 1.303 -1.423 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.834 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.02 167.62 26.76 Favored 'Trans proline' 0 CA--C 1.555 1.566 0 C-N-CA 123.182 2.588 . . . . 0.0 113.308 -177.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.524 ' HB3' ' O ' ' A' ' 5' ' ' ASP . 16.7 Cg_endo -58.77 -24.16 70.23 Favored 'Trans proline' 0 C--N 1.367 1.545 0 C-N-CA 123.833 3.022 . . . . 0.0 113.96 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -95.41 6.54 48.73 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 119.329 -0.948 . . . . 0.0 113.055 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -83.55 148.42 27.2 Favored 'General case' 0 N--CA 1.396 -3.129 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 177.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.481 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.4 t70 -83.8 133.87 34.74 Favored 'General case' 0 C--N 1.263 -3.16 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.72 -172.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.504 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 13.5 mm100 -59.6 -38.55 81.55 Favored 'General case' 0 C--N 1.281 -2.382 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.286 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 20.8 m -73.3 -33.84 65.41 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.481 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 45.7 mmtm -69.4 -23.03 63.66 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.425 0.631 . . . . 0.0 110.175 175.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.504 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 38.5 t80 -74.12 -47.92 32.99 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 124.286 1.035 . . . . 0.0 109.088 174.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 52.0 mt-10 -65.25 -30.34 71.2 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.52 179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 24' ' ' SER . 40.1 mm-40 -59.91 -33.69 72.2 Favored 'General case' 0 CA--C 1.489 -1.38 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 171.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -79.64 -35.81 38.78 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.58 -0.848 . . . . 0.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.531 HG13 HD21 ' A' ' 12' ' ' LEU . 55.6 t -60.88 -48.99 86.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 175.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.51 ' HB3' HE22 ' A' ' 43' ' ' GLN . 44.7 mt-10 -69.51 -14.49 62.89 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 59.0 m -76.05 -23.89 55.12 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.099 0.476 . . . . 0.0 110.23 173.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -78.26 -29.16 47.88 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 174.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 22.7 m0 -72.64 120.91 18.91 Favored 'General case' 0 N--CA 1.39 -3.435 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -81.85 116.54 21.56 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.163 -173.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.556 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.0 p -95.01 138.25 21.34 Favored 'Isoleucine or valine' 0 C--N 1.257 -3.429 0 CA-C-N 113.949 -1.478 . . . . 0.0 113.018 -174.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 51.7 t -91.76 117.15 67.6 Favored Pre-proline 0 N--CA 1.411 -2.413 0 N-CA-C 103.824 -2.658 . . . . 0.0 103.824 172.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HB2' ' SD ' ' A' ' 39' ' ' MET . 24.4 Cg_exo -56.55 -47.82 21.99 Favored 'Trans proline' 0 C--N 1.324 -0.728 0 C-N-CA 122.279 1.986 . . . . 0.0 111.116 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 38' ' ' PRO . 3.5 mpp? -72.0 -14.89 62.02 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.006 -0.997 . . . . 0.0 112.988 -176.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.761 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.2 m -107.94 -21.77 12.69 Favored 'General case' 0 C--O 1.217 -0.614 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.707 176.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 63.9 p 59.49 24.94 13.67 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 125.819 1.648 . . . . 0.0 111.245 -175.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -111.59 135.58 51.97 Favored 'General case' 1 N--CA 1.37 -4.454 0 CA-C-O 122.13 0.967 . . . . 0.0 108.858 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.2 mt-30 -100.3 126.9 46.68 Favored 'General case' 1 C--N 1.233 -4.462 0 CA-C-N 111.53 -2.577 . . . . 0.0 109.057 -176.139 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -98.59 145.06 29.26 Favored Pre-proline 0 C--N 1.272 -2.765 0 CA-C-N 114.722 -1.127 . . . . 0.0 110.159 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 36.7 Cg_endo -64.53 156.34 61.3 Favored 'Trans proline' 0 N--CA 1.452 -0.928 0 C-N-CA 123.132 2.555 . . . . 0.0 111.624 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.549 ' HG2' ' CD1' ' A' ' 12' ' ' LEU . 58.3 Cg_exo -61.32 -22.8 75.6 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.067 2.512 . . . . 0.0 110.746 175.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.73 -3.49 38.39 Favored 'General case' 0 C--O 1.239 0.502 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.744 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -84.35 156.62 21.78 Favored 'General case' 0 N--CA 1.384 -3.752 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 179.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -88.48 130.08 35.29 Favored 'General case' 1 C--N 1.243 -4.06 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 -174.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 8.8 pt20 -61.38 -34.93 76.15 Favored 'General case' 0 C--O 1.19 -2.051 0 O-C-N 124.063 0.852 . . . . 0.0 111.361 -178.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.537 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 77.7 mt-30 -71.23 -37.31 72.03 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 96.7 t -68.5 -33.54 60.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -71.6 -46.79 58.21 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 114.609 -1.178 . . . . 0.0 110.176 177.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 56.5 mm-40 -56.61 -45.67 81.34 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 178.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.537 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 11.3 mpt_? -58.93 -46.62 87.52 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 123.537 0.523 . . . . 0.0 110.839 177.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.56 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 81.1 t60 -57.77 -50.93 71.61 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.511 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.7 t -68.2 -41.16 83.78 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 CA-C-O 120.859 0.362 . . . . 0.0 110.297 -175.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.58 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -55.71 -42.77 75.77 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 111.802 177.602 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 55' ' ' ARG . 82.3 p -62.7 -23.24 67.04 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.761 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 30.5 m-70 -75.74 -22.11 56.84 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.422 0.63 . . . . 0.0 109.54 178.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -103.83 -32.45 9.31 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.666 0.746 . . . . 0.0 110.913 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.447 ' C ' ' H ' ' A' ' 64' ' ' ASN . 7.4 t70 -103.05 17.78 23.24 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 125.735 1.614 . . . . 0.0 109.782 -171.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -45.32 22.45 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 117.336 2.347 . . . . 0.0 117.336 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.447 ' H ' ' C ' ' A' ' 62' ' ' ASP . 45.9 m-80 -79.48 -9.06 59.54 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.062 -1.088 . . . . 0.0 108.062 172.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -73.42 -11.97 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.28 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.333 176.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 71.6 mt -81.53 94.4 6.87 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.5 t30 177.43 -40.26 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 -174.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -81.56 101.4 9.94 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.241 -175.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 35.5 t70 . . . . . 0 C--N 1.297 -1.695 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 177.082 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.493 ' O ' ' HB ' ' A' ' 6' ' ' VAL . . . . . . . . 0 CA--C 1.489 -1.589 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -69.01 -18.17 40.67 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 122.222 1.948 . . . . 0.0 110.514 177.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m80 -131.95 176.53 8.28 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.422 ' CE ' ' HA ' ' A' ' 4' ' ' MET . 4.5 mmt 70.13 -79.87 0.04 OUTLIER 'General case' 0 CA--C 1.501 -0.942 0 C-N-CA 124.95 1.3 . . . . 0.0 112.491 177.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -129.38 120.77 26.12 Favored 'General case' 0 C--N 1.256 -3.499 0 CA-C-O 122.021 0.915 . . . . 0.0 111.209 178.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.493 ' HB ' ' O ' ' A' ' 1' ' ' GLY . 11.8 p -158.14 29.47 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.282 -2.341 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 177.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.0 m-70 -104.82 7.32 34.47 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.672 -1.603 . . . . 0.0 110.728 -176.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.8 mmmm -82.84 82.52 8.1 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -133.62 145.44 50.01 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.148 -176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.4 m -57.63 119.45 33.12 Favored Pre-proline 0 C--N 1.314 -0.952 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 169.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -70.84 -15.7 33.03 Favored 'Trans proline' 0 C--N 1.326 -0.606 0 C-N-CA 121.323 1.349 . . . . 0.0 110.85 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.687 ' HB2' ' ND1' ' A' ' 33' ' ' HIS . 3.8 mt -111.08 -9.11 14.39 Favored 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.722 -176.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 74.6 m -115.62 -25.69 7.76 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.966 -0.459 . . . . 0.0 111.411 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 67.48 18.79 10.06 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.024 0.916 . . . . 0.0 110.089 -169.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.8 tt -81.56 135.01 35.57 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-N 114.163 -1.38 . . . . 0.0 107.409 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -98.98 140.6 32.88 Favored 'General case' 0 C--N 1.281 -2.411 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.431 -172.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -119.86 158.68 49.29 Favored Pre-proline 0 C--N 1.306 -1.319 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -69.05 154.58 70.29 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.723 1.615 . . . . 0.0 110.741 175.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -55.71 -28.22 65.21 Favored 'Trans proline' 0 CA--C 1.504 -1.002 0 C-N-CA 123.184 2.59 . . . . 0.0 112.395 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -87.98 -0.97 57.68 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.58 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -62.47 143.61 56.92 Favored 'General case' 0 N--CA 1.425 -1.679 0 CA-C-O 122.032 0.92 . . . . 0.0 113.013 -175.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.85 119.62 12.19 Favored 'General case' 0 C--N 1.283 -2.29 0 CA-C-N 112.357 -2.201 . . . . 0.0 110.083 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.49 ' HA ' ' OE1' ' A' ' 23' ' ' GLN . 7.1 mm-40 -62.76 -33.56 75.42 Favored 'General case' 0 C--N 1.283 -2.305 0 CA-C-N 114.691 -1.14 . . . . 0.0 111.285 178.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 7.6 p -65.3 -48.3 73.59 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.746 178.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.43 ' HD3' ' HA ' ' A' ' 25' ' ' LYS . 73.2 mmtt -64.85 -28.97 69.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.641 -0.708 . . . . 0.0 111.007 178.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.501 ' O ' HG23 ' A' ' 30' ' ' VAL . 68.1 t80 -63.66 -45.65 89.18 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.262 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 51.3 mt-10 -71.17 -31.81 68.11 Favored 'General case' 0 CA--C 1.496 -1.112 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.175 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -65.36 -25.17 67.46 Favored 'General case' 0 CA--C 1.478 -1.819 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 176.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.44 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 11.8 t-160 -85.29 -44.08 13.17 Favored 'General case' 0 N--CA 1.395 -3.177 0 C-N-CA 119.139 -1.024 . . . . 0.0 109.246 175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.609 ' HA ' ' CD2' ' A' ' 33' ' ' HIS . 22.0 t -58.36 -44.38 88.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 CA-C-N 118.281 0.491 . . . . 0.0 110.635 -179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 57.9 mm-40 -63.41 -26.13 68.6 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.115 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 49.9 m -86.48 -9.91 55.23 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 120.956 0.407 . . . . 0.0 111.447 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.687 ' ND1' ' HB2' ' A' ' 12' ' ' LEU . 15.0 m-70 -70.16 -35.53 74.06 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 172.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.482 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 11.0 m0 -63.54 121.32 13.57 Favored 'General case' 1 N--CA 1.347 -5.578 0 C-N-CA 124.576 1.15 . . . . 0.0 110.244 177.701 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -69.88 113.74 7.4 Favored 'General case' 0 N--CA 1.416 -2.172 0 CA-C-N 113.701 -1.591 . . . . 0.0 110.729 -175.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.451 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -93.47 120.57 43.08 Favored 'Isoleucine or valine' 0 C--N 1.255 -3.509 0 CA-C-N 113.232 -1.804 . . . . 0.0 112.075 -174.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 39' ' ' MET . 48.9 t -85.44 119.15 71.96 Favored Pre-proline 0 N--CA 1.402 -2.857 0 N-CA-C 104.884 -2.265 . . . . 0.0 104.884 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -71.57 -9.53 25.22 Favored 'Trans proline' 0 C--O 1.219 -0.451 0 C-N-CA 121.907 1.738 . . . . 0.0 109.941 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.61 ' HB2' ' SG ' ' A' ' 37' ' ' CYS . 84.8 mmm -92.29 -40.54 10.88 Favored 'General case' 0 N--CA 1.424 -1.74 0 CA-C-N 113.775 -1.557 . . . . 0.0 110.11 -177.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.789 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 27.6 m -89.92 -20.71 23.03 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.072 0.463 . . . . 0.0 110.574 176.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.3 p 63.09 23.84 14.16 Favored 'General case' 0 C--O 1.245 0.831 0 C-N-CA 126.17 1.788 . . . . 0.0 110.476 -174.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -124.31 150.92 44.9 Favored 'General case' 1 N--CA 1.375 -4.181 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.367 -176.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.482 ' HB3' ' HB3' ' A' ' 34' ' ' TRP . 96.0 mt-30 -100.9 127.04 47.55 Favored 'General case' 1 C--N 1.235 -4.389 0 CA-C-N 111.437 -2.619 . . . . 0.0 108.612 -177.185 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -100.89 146.13 31.58 Favored Pre-proline 0 C--N 1.286 -2.163 0 C-N-CA 123.102 0.561 . . . . 0.0 110.821 -178.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -58.48 161.19 14.95 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.382 2.721 . . . . 0.0 113.508 -172.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -57.14 -19.98 36.05 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.96 3.107 . . . . 0.0 112.852 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -72.96 -18.95 61.32 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.504 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.647 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -75.67 107.41 7.81 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-O 122.208 1.004 . . . . 0.0 109.591 -179.71 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.433 ' HB3' HG23 ' A' ' 52' ' ' VAL . 11.4 t70 -67.19 146.94 53.69 Favored 'General case' 0 C--N 1.267 -3.007 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.073 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -56.31 -37.4 69.87 Favored 'General case' 0 C--N 1.281 -2.377 0 O-C-N 123.798 0.686 . . . . 0.0 112.468 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.632 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.4 mt-30 -69.38 -38.17 77.91 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-O 121.563 0.697 . . . . 0.0 109.855 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.647 HG12 ' CE2' ' A' ' 48' ' ' TYR . 86.8 t -71.89 -38.02 63.42 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.845 179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -73.03 -45.75 55.87 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.854 -1.066 . . . . 0.0 111.692 -178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -65.48 -39.93 92.51 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 120.031 -0.667 . . . . 0.0 110.97 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.632 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 2.9 mpt_? -67.46 -38.49 84.52 Favored 'General case' 0 CA--C 1.512 -0.513 0 C-N-CA 120.229 -0.588 . . . . 0.0 109.922 177.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.579 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 70.3 t60 -54.28 -54.79 35.47 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.7 174.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.4 t -64.86 -40.43 89.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.357 0.599 . . . . 0.0 110.078 -175.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.32 -34.01 75.79 Favored 'General case' 0 C--O 1.197 -1.696 0 CA-C-N 114.993 -1.003 . . . . 0.0 113.223 179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 55' ' ' ARG . 72.3 p -68.18 -24.45 64.96 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 118.453 0.57 . . . . 0.0 111.267 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.789 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 40.9 m-70 -69.74 -29.9 67.36 Favored 'General case' 0 N--CA 1.461 0.087 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 177.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -89.61 -37.01 14.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.784 177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -74.9 -57.52 3.86 Favored 'General case' 0 CA--C 1.487 -1.463 0 CA-C-O 121.859 0.837 . . . . 0.0 110.231 -172.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 60.15 9.7 1.98 Allowed 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 113.276 -1.784 . . . . 0.0 112.922 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.9 m120 62.94 17.32 9.94 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 125.718 1.607 . . . . 0.0 112.144 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.1 t 61.2 33.36 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-O 122.958 1.361 . . . . 0.0 108.205 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 92.8 mt -139.69 168.15 20.47 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.856 -1.066 . . . . 0.0 109.063 -178.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -85.04 120.82 26.98 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 166.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -62.03 -52.55 63.51 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.044 0.45 . . . . 0.0 110.591 -174.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.5 t70 . . . . . 0 C--N 1.292 -1.912 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 177.24 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.094 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.58 126.56 16.35 Favored 'Trans proline' 0 C--O 1.251 1.135 0 C-N-CA 122.725 2.283 . . . . 0.0 109.666 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.493 ' CE1' ' HA ' ' A' ' 5' ' ' ASP . 0.4 OUTLIER -139.24 179.16 6.68 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.122 -174.02 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 45.8 mtm -75.79 -20.33 58.3 Favored 'General case' 0 CA--C 1.494 -1.187 0 CA-C-O 121.914 0.864 . . . . 0.0 110.961 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.493 ' HA ' ' CE1' ' A' ' 3' ' ' HIS . 26.7 t0 75.95 146.78 0.09 Allowed 'General case' 0 C--N 1.296 -1.751 0 CA-C-N 112.04 -2.345 . . . . 0.0 112.513 176.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.45 ' HB ' ' O ' ' A' ' 5' ' ' ASP . 10.1 p 170.38 -23.91 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.438 -1.055 0 C-N-CA 125.726 1.61 . . . . 0.0 108.77 -175.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -131.79 84.95 2.21 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 122.311 1.053 . . . . 0.0 111.864 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.5 mmtm -89.21 93.23 9.49 Favored 'General case' 0 C--N 1.286 -2.194 0 CA-C-N 114.084 -1.416 . . . . 0.0 112.578 176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 56.8 mttp -102.2 144.22 31.02 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.104 171.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -65.29 124.8 88.01 Favored Pre-proline 0 C--N 1.295 -1.794 0 N-CA-C 105.509 -2.034 . . . . 0.0 105.509 166.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -62.41 -18.53 63.51 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 121.413 1.409 . . . . 0.0 111.966 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.618 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -95.83 -60.67 1.59 Allowed 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 120.615 -0.434 . . . . 0.0 112.029 -178.199 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.437 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 21.3 p -94.51 -9.01 36.72 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 119.536 -0.866 . . . . 0.0 112.907 -174.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 66.13 16.33 10.41 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.523 -1.217 . . . . 0.0 113.357 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.9 tt -65.62 140.32 58.5 Favored 'General case' 0 C--O 1.245 0.833 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 55.8 ttp -97.03 130.52 44.33 Favored 'General case' 0 N--CA 1.419 -2.003 0 CA-C-O 121.519 0.676 . . . . 0.0 112.138 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -109.97 153.81 42.97 Favored Pre-proline 0 C--N 1.287 -2.109 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 176.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 40.0 Cg_endo -69.1 150.2 71.98 Favored 'Trans proline' 0 N--CA 1.448 -1.151 0 C-N-CA 121.197 1.265 . . . . 0.0 110.133 174.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 27.3 Cg_exo -63.57 -3.41 5.39 Favored 'Trans proline' 0 N--CA 1.489 1.228 0 C-N-CA 123.235 2.624 . . . . 0.0 113.351 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -101.86 7.39 41.61 Favored 'General case' 0 C--N 1.299 -1.629 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.487 176.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -64.3 153.95 36.71 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 122.152 0.977 . . . . 0.0 111.488 179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 22.9 t70 -72.92 135.41 45.06 Favored 'General case' 0 C--N 1.27 -2.865 0 CA-C-N 113.294 -1.775 . . . . 0.0 110.747 -177.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -64.44 -45.39 87.69 Favored 'General case' 0 C--N 1.266 -3.06 0 CA-C-N 113.654 -1.612 . . . . 0.0 112.863 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.4 m -76.09 -40.71 52.41 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -174.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.647 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 5.8 mptp? -64.17 -30.14 71.22 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.717 176.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.494 ' O ' HG23 ' A' ' 30' ' ' VAL . 73.8 t80 -65.52 -47.71 75.0 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 175.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.42 -38.38 89.75 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.987 -179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -66.75 -24.89 66.27 Favored 'General case' 0 CA--C 1.477 -1.841 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.46 175.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.507 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 8.5 t60 -82.53 -39.14 22.79 Favored 'General case' 0 N--CA 1.403 -2.823 0 C-N-CA 119.612 -0.835 . . . . 0.0 109.075 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.618 HG13 HD21 ' A' ' 12' ' ' LEU . 58.2 t -58.83 -47.92 87.84 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -76.73 -2.37 32.65 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.476 -0.784 . . . . 0.0 112.484 -179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.5 t -87.01 -25.07 24.43 Favored 'General case' 0 C--O 1.245 0.861 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 173.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.507 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 75.4 m-70 -75.93 -30.93 58.9 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.803 174.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.478 ' CD1' ' HD3' ' A' ' 46' ' ' PRO . 17.6 m0 -65.09 126.74 29.03 Favored 'General case' 1 N--CA 1.363 -4.804 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 169.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HD2' ' N ' ' A' ' 35' ' ' LYS . 2.5 mptp? -78.31 106.66 10.38 Favored 'General case' 0 C--N 1.285 -2.218 0 CA-C-O 122.454 1.121 . . . . 0.0 112.188 -172.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 9.1 p -95.04 125.53 47.67 Favored 'Isoleucine or valine' 0 C--N 1.246 -3.925 0 CA-C-N 113.043 -1.89 . . . . 0.0 111.511 -178.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.592 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 42.3 t -83.55 126.32 71.57 Favored Pre-proline 0 N--CA 1.426 -1.673 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 176.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -60.02 -40.54 60.6 Favored 'Trans proline' 0 C--N 1.322 -0.845 0 C-N-CA 122.319 2.013 . . . . 0.0 111.086 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -79.41 -24.87 42.25 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.102 -0.954 . . . . 0.0 112.851 -176.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.75 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 47.4 m -99.4 -27.86 13.55 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.701 -0.799 . . . . 0.0 110.865 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.0 m 65.64 21.62 11.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 124.482 1.113 . . . . 0.0 110.912 -175.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.521 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.6 mt-10 -107.96 141.01 40.26 Favored 'General case' 1 N--CA 1.372 -4.346 0 CA-C-N 114.983 -1.008 . . . . 0.0 108.391 -178.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.516 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 89.8 mt-30 -103.92 128.18 51.44 Favored 'General case' 1 C--N 1.23 -4.624 0 CA-C-N 111.483 -2.599 . . . . 0.0 109.707 -176.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -98.63 155.66 36.5 Favored Pre-proline 0 C--N 1.28 -2.419 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.45 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 38.0 Cg_endo -64.65 157.48 55.43 Favored 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 121.78 1.653 . . . . 0.0 111.536 -176.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.478 ' HD3' ' CD1' ' A' ' 34' ' ' TRP . 34.5 Cg_endo -66.99 -21.14 50.08 Favored 'Trans proline' 0 CA--C 1.529 0.275 0 C-N-CA 122.649 2.233 . . . . 0.0 111.295 -179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 9.0 p-10 -93.66 15.91 15.14 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.306 -178.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -82.87 176.37 9.35 Favored 'General case' 0 N--CA 1.398 -3.061 0 N-CA-C 105.016 -2.216 . . . . 0.0 105.016 174.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -103.36 130.2 50.61 Favored 'General case' 0 C--N 1.253 -3.59 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -176.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -54.89 -41.38 70.82 Favored 'General case' 0 C--O 1.201 -1.498 0 O-C-N 124.057 0.848 . . . . 0.0 111.37 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -65.87 -43.08 89.43 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -177.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 87.9 t -68.31 -33.28 59.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.75 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -72.83 -44.2 61.71 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.55 177.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -56.51 -45.8 80.87 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-O 121.291 0.567 . . . . 0.0 110.257 178.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 83.9 mtt180 -65.73 -32.92 74.74 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.173 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.519 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 74.4 t60 -64.34 -46.88 81.55 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 174.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.52 -37.78 80.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.403 ' HA ' ' NE2' ' A' ' 58' ' ' GLN . 22.6 mm-40 -57.73 -38.77 75.88 Favored 'General case' 0 C--O 1.186 -2.24 0 CA-C-N 114.67 -1.15 . . . . 0.0 113.081 177.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 82.2 p -69.59 -16.87 63.48 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.084 0.468 . . . . 0.0 111.701 -178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.75 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 40.4 m-70 -83.35 -27.94 29.34 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 176.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -91.48 -22.78 20.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.621 177.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -91.67 -70.65 0.68 Allowed 'General case' 0 C--N 1.303 -1.428 0 CA-C-O 121.414 0.626 . . . . 0.0 110.799 -178.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 64.55 6.92 3.4 Favored 'General case' 0 C--N 1.292 -1.902 0 C-N-CA 126.785 2.034 . . . . 0.0 113.515 176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 34.9 p30 -159.21 -12.23 0.06 Allowed 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -174.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.0 t 66.72 20.39 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.265 0 CA-C-O 123.137 1.446 . . . . 0.0 110.096 -177.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 62.5 tp -108.02 86.46 2.3 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -95.87 -9.19 32.07 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -73.58 -64.64 0.95 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.911 -1.041 . . . . 0.0 108.392 179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.254 1.308 0 O-C-N 124.633 1.208 . . . . 0.0 112.381 175.21 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.619 0 N-CA-C 110.06 -1.216 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -60.89 -30.14 89.46 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 122.708 2.272 . . . . 0.0 110.808 175.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.3 m-70 -129.52 158.35 39.48 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 174.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.9 tpt -92.49 69.06 4.93 Favored 'General case' 0 C--N 1.298 -1.633 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.371 176.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.484 ' OD2' ' HG3' ' A' ' 8' ' ' LYS . 38.5 t70 169.74 154.18 0.05 OUTLIER 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 125.636 1.575 . . . . 0.0 107.57 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.3 p -165.24 26.06 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 N-CA-C 106.097 -1.816 . . . . 0.0 106.097 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -112.0 9.16 20.41 Favored 'General case' 0 N--CA 1.424 -1.743 0 CA-C-N 114.187 -1.37 . . . . 0.0 112.559 -170.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.484 ' HG3' ' OD2' ' A' ' 5' ' ' ASP . 64.6 mttp -88.69 84.21 6.72 Favored 'General case' 0 N--CA 1.415 -2.218 0 CA-C-O 123.334 1.54 . . . . 0.0 111.359 -176.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 35.1 mttm -133.94 144.24 48.68 Favored 'General case' 0 C--N 1.267 -2.981 0 CA-C-N 110.934 -2.848 . . . . 0.0 104.662 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 43.4 t -64.08 117.36 35.51 Favored Pre-proline 0 C--N 1.274 -2.712 0 N-CA-C 105.228 -2.138 . . . . 0.0 105.228 168.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -63.7 -7.77 13.74 Favored 'Trans proline' 0 CA--C 1.532 0.393 0 C-N-CA 121.678 1.585 . . . . 0.0 112.404 -176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.558 ' HG ' ' HG2' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -101.58 -64.48 1.05 Allowed 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.392 -178.228 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 15.3 p -94.23 -14.19 25.8 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 119.781 -0.768 . . . . 0.0 111.291 -175.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.25 38.1 mt-10 65.61 36.52 6.43 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -177.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 33.4 tp -64.31 132.84 51.36 Favored 'General case' 0 C--O 1.246 0.91 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 167.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 52.4 ttm -90.83 138.72 31.37 Favored 'General case' 0 N--CA 1.427 -1.607 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 -174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -124.85 158.94 60.86 Favored Pre-proline 0 N--CA 1.431 -1.396 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' A' ' 19' ' ' PRO . 50.2 Cg_exo -58.84 150.37 71.94 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.148 1.899 . . . . 0.0 110.599 173.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 18' ' ' PRO . 21.7 Cg_exo -65.88 -9.96 25.05 Favored 'Trans proline' 0 N--CA 1.479 0.643 0 C-N-CA 122.589 2.192 . . . . 0.0 113.354 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 29.2 p-10 -115.81 18.52 15.64 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-O 120.797 0.332 . . . . 0.0 110.341 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -63.82 149.74 46.28 Favored 'General case' 0 N--CA 1.413 -2.294 0 CA-C-O 122.0 0.905 . . . . 0.0 111.874 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -61.65 108.96 1.07 Allowed 'General case' 0 C--N 1.278 -2.535 0 CA-C-N 112.606 -2.088 . . . . 0.0 112.17 -178.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.437 ' OE1' ' HE3' ' A' ' 8' ' ' LYS . 13.5 mm100 -54.8 -39.68 68.72 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 124.927 1.291 . . . . 0.0 113.428 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.628 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 23.5 m -62.96 -46.51 87.37 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.6 mmmt -66.37 -30.96 71.45 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.583 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 76.6 t80 -65.48 -51.37 60.54 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 124.015 0.926 . . . . 0.0 109.886 178.106 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -62.85 -34.41 77.28 Favored 'General case' 0 C--O 1.215 -0.761 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.798 179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.628 ' HG2' ' O ' ' A' ' 24' ' ' SER . 11.8 mm-40 -60.47 -30.92 69.98 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 121.273 0.558 . . . . 0.0 109.502 175.053 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -85.44 -37.85 19.31 Favored 'General case' 0 N--CA 1.406 -2.641 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.091 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 26' ' ' PHE . 31.7 t -62.9 -42.95 98.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 178.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.428 ' HB2' HE22 ' A' ' 43' ' ' GLN . 9.9 pt-20 -66.48 -22.73 66.19 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.103 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.4 t -67.97 -28.18 67.23 Favored 'General case' 0 C--O 1.241 0.646 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -83.39 -31.2 26.82 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.561 177.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.47 ' NE1' HG12 ' A' ' 30' ' ' VAL . 34.0 m0 -64.04 122.79 17.38 Favored 'General case' 0 N--CA 1.4 -2.932 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -71.8 105.06 3.63 Favored 'General case' 0 C--N 1.283 -2.295 0 CA-C-O 122.565 1.174 . . . . 0.0 112.1 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.607 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -94.64 125.01 47.34 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.149 0 CA-C-N 113.201 -1.818 . . . . 0.0 112.525 -175.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.602 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 50.3 t -81.24 122.5 81.39 Favored Pre-proline 0 N--CA 1.419 -2.01 0 N-CA-C 105.28 -2.118 . . . . 0.0 105.28 174.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -63.07 -25.76 73.42 Favored 'Trans proline' 0 C--N 1.331 -0.372 0 C-N-CA 122.467 2.111 . . . . 0.0 110.833 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 mtm -100.19 -10.47 21.37 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.3 -1.318 . . . . 0.0 113.228 -173.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.773 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.1 m -110.36 -26.22 9.68 Favored 'General case' 0 C--N 1.31 -1.134 0 C-N-CA 120.216 -0.594 . . . . 0.0 109.715 174.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 m 65.83 24.02 11.36 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.683 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -110.58 135.63 50.92 Favored 'General case' 1 N--CA 1.373 -4.307 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.607 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 23.2 mt-30 -106.71 125.56 51.16 Favored 'General case' 1 C--N 1.227 -4.742 0 CA-C-N 111.932 -2.395 . . . . 0.0 109.009 -176.345 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 50.7 m-85 -93.82 153.16 41.06 Favored Pre-proline 0 C--N 1.28 -2.44 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.106 -179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' A' ' 46' ' ' PRO . 35.4 Cg_endo -65.94 147.65 85.06 Favored 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.399 1.399 . . . . 0.0 110.799 -178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.558 ' HG2' ' HG ' ' A' ' 12' ' ' LEU . 44.8 Cg_exo -68.05 0.09 4.89 Favored 'Trans proline' 0 N--CA 1.487 1.132 0 C-N-CA 123.438 2.758 . . . . 0.0 112.578 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -99.66 1.19 43.27 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 123.792 0.837 . . . . 0.0 109.523 178.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -77.48 -172.34 2.49 Favored 'General case' 0 N--CA 1.415 -2.193 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -110.03 137.49 47.72 Favored 'General case' 0 C--N 1.258 -3.391 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 -176.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HA ' HE21 ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.19 -41.33 88.27 Favored 'General case' 0 C--N 1.292 -1.894 0 O-C-N 124.189 0.931 . . . . 0.0 112.221 178.335 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -77.91 -36.3 49.65 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 -176.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 98.1 t -67.85 -32.88 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 59.3 t80 -72.55 -44.5 62.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.031 176.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -58.95 -45.79 89.62 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.574 179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 69.6 mtp180 -61.18 -38.89 88.14 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.758 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.469 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 69.6 t60 -60.38 -50.36 73.93 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.756 175.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 53' ' ' PHE . 87.1 t -65.72 -35.69 75.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-O 121.608 0.718 . . . . 0.0 109.991 -175.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.59 -23.49 67.28 Favored 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 72.9 p -74.81 -30.84 61.53 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.329 0.585 . . . . 0.0 109.644 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.773 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 41.2 m-70 -70.87 -32.53 69.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.719 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -83.66 -31.08 26.35 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.112 176.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -65.32 -54.12 33.78 Favored 'General case' 0 CA--C 1.488 -1.423 0 CA-C-O 122.015 0.912 . . . . 0.0 109.462 -178.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 65.75 1.76 1.9 Allowed 'General case' 0 C--N 1.288 -2.082 0 CA-C-N 112.621 -2.081 . . . . 0.0 113.081 175.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -92.06 -42.02 10.19 Favored 'General case' 0 CA--C 1.486 -1.484 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.1 p -124.5 73.09 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.409 -2.52 0 CA-C-O 122.831 1.301 . . . . 0.0 111.866 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.3 pp -99.5 -10.65 21.87 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 122.871 1.319 . . . . 0.0 107.635 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -80.37 107.85 13.51 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 113.077 -1.874 . . . . 0.0 107.389 174.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -81.46 98.81 8.43 Favored 'General case' 0 C--N 1.297 -1.674 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.144 -178.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 C--N 1.309 -1.161 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.082 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.498 0 N-CA-C 110.439 -1.064 . . . . 0.0 110.439 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -66.02 119.32 6.33 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.671 2.247 . . . . 0.0 111.551 -179.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 68.45 -86.89 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.387 1.075 . . . . 0.0 111.956 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 78.7 mtp -161.93 153.86 19.1 Favored 'General case' 0 CA--C 1.476 -1.884 0 N-CA-C 103.887 -2.634 . . . . 0.0 103.887 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -82.58 103.98 12.51 Favored 'General case' 0 C--N 1.273 -2.739 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.209 178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.2 p -138.34 35.32 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.278 -2.518 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 175.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -92.4 9.39 34.38 Favored 'General case' 0 N--CA 1.432 -1.367 0 CA-C-N 112.264 -2.244 . . . . 0.0 110.431 -176.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 46.2 mmtm -80.38 78.47 7.08 Favored 'General case' 0 N--CA 1.427 -1.591 0 CA-C-O 121.677 0.751 . . . . 0.0 109.595 -178.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -133.98 136.88 44.44 Favored 'General case' 0 CA--C 1.473 -1.987 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 175.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.2 t -64.46 118.19 44.95 Favored Pre-proline 0 C--N 1.295 -1.774 0 N-CA-C 104.308 -2.478 . . . . 0.0 104.308 168.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_exo -64.4 -19.26 65.25 Favored 'Trans proline' 0 C--N 1.326 -0.626 0 C-N-CA 121.422 1.415 . . . . 0.0 110.501 -177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.9 mt -90.26 -40.79 11.94 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 113.307 -1.77 . . . . 0.0 110.677 -172.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.675 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 94.1 m -91.04 -31.34 16.33 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.337 0.589 . . . . 0.0 110.827 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 69.18 16.91 8.48 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.543 1.537 . . . . 0.0 111.146 -166.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -76.33 132.95 40.09 Favored 'General case' 0 N--CA 1.433 -1.299 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.392 176.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 56.1 ttp -95.17 138.23 33.15 Favored 'General case' 0 N--CA 1.419 -1.977 0 O-C-N 124.238 0.961 . . . . 0.0 110.825 -173.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 97.7 m-85 -115.69 157.57 44.14 Favored Pre-proline 0 C--N 1.296 -1.752 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 177.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.2 147.21 85.1 Favored 'Trans proline' 0 CA--C 1.54 0.784 0 C-N-CA 121.985 1.79 . . . . 0.0 111.228 175.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.04 -26.79 83.39 Favored 'Trans proline' 0 CA--C 1.51 -0.677 0 C-N-CA 123.193 2.595 . . . . 0.0 113.197 -178.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -105.62 18.95 21.37 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.792 -176.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -75.96 150.2 37.51 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-O 121.561 0.696 . . . . 0.0 109.591 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 41.4 m-20 -57.53 114.45 2.24 Favored 'General case' 0 C--N 1.282 -2.355 0 CA-C-N 113.9 -1.5 . . . . 0.0 112.303 -177.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.436 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 43.5 mt-30 -58.03 -39.94 79.61 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-N 114.451 -1.249 . . . . 0.0 112.436 178.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.5 m -65.81 -38.21 88.32 Favored 'General case' 0 C--O 1.21 -0.979 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 30.0 mmtp -66.34 -37.7 85.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.253 0.549 . . . . 0.0 110.121 176.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.477 ' O ' HG23 ' A' ' 30' ' ' VAL . 65.5 t80 -60.48 -49.96 75.46 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.036 177.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.8 mt-10 -66.54 -35.01 79.19 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.988 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.01 -30.41 71.58 Favored 'General case' 0 CA--C 1.483 -1.6 0 CA-C-O 120.745 0.307 . . . . 0.0 110.593 174.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.503 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 13.2 t60 -79.75 -40.36 28.98 Favored 'General case' 0 N--CA 1.409 -2.505 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.919 176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 26' ' ' PHE . 40.8 t -64.08 -46.11 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 O-C-N 122.196 -0.315 . . . . 0.0 110.216 178.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -70.91 -13.26 61.96 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 15.4 t -77.66 -30.01 51.86 Favored 'General case' 0 N--CA 1.432 -1.333 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.675 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 25.9 m-70 -73.72 -33.72 64.48 Favored 'General case' 0 CA--C 1.495 -1.141 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.648 174.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -62.77 125.5 24.16 Favored 'General case' 0 N--CA 1.388 -3.544 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 175.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.53 ' HE2' ' OE1' ' A' ' 50' ' ' GLN . 44.4 mmtm -74.75 100.94 4.15 Favored 'General case' 0 C--N 1.276 -2.617 0 CA-C-N 114.758 -1.11 . . . . 0.0 111.45 -173.288 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.574 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -96.61 130.8 44.73 Favored 'Isoleucine or valine' 0 C--N 1.264 -3.145 0 CA-C-N 113.375 -1.738 . . . . 0.0 111.989 -176.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 43.3 t -82.33 119.63 75.26 Favored Pre-proline 0 N--CA 1.411 -2.378 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 174.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -58.23 -35.66 98.51 Favored 'Trans proline' 0 N--CA 1.478 0.58 0 C-N-CA 122.578 2.185 . . . . 0.0 111.637 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.8 mpp? -80.35 -27.49 38.29 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.041 -177.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.77 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 46.0 m -98.59 -29.06 13.28 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.348 -179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.6 m 65.99 28.9 10.4 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.529 1.132 . . . . 0.0 108.572 -172.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 22.9 tt0 -104.55 115.51 30.47 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 106.517 -1.661 . . . . 0.0 106.517 -177.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.574 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 20.5 mt-30 -92.45 126.6 37.6 Favored 'General case' 1 C--N 1.233 -4.458 0 CA-C-N 112.248 -2.251 . . . . 0.0 108.932 -178.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -101.77 153.99 37.58 Favored Pre-proline 0 C--N 1.278 -2.52 0 CA-C-N 115.19 -0.914 . . . . 0.0 108.992 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -63.8 155.85 61.29 Favored 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 121.778 1.652 . . . . 0.0 111.786 -177.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -63.7 -18.61 64.87 Favored 'Trans proline' 0 N--CA 1.479 0.661 0 C-N-CA 123.734 2.956 . . . . 0.0 112.728 -178.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -102.38 16.96 24.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.384 0.611 . . . . 0.0 110.559 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.5 t80 -78.47 -175.14 4.13 Favored 'General case' 0 N--CA 1.399 -3.02 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 177.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -109.99 129.42 55.67 Favored 'General case' 0 C--N 1.263 -3.187 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 -173.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.53 ' OE1' ' HE2' ' A' ' 35' ' ' LYS . 15.8 mm100 -59.07 -38.23 78.92 Favored 'General case' 0 C--O 1.199 -1.555 0 O-C-N 123.804 0.69 . . . . 0.0 112.024 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.459 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 14.1 mm-40 -76.97 -20.62 55.87 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-O 120.825 0.345 . . . . 0.0 110.758 -176.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 88.0 t -87.46 -40.52 13.87 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.295 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 61.8 t80 -66.15 -45.13 82.08 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.526 177.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.54 -35.75 76.76 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.588 179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 7.5 mpt_? -65.19 -40.51 94.33 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.717 0.294 . . . . 0.0 111.064 177.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.598 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 78.0 t60 -63.21 -47.15 83.73 Favored 'General case' 0 C--O 1.197 -1.695 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.0 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 65.8 t -68.18 -39.02 80.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-O 121.12 0.486 . . . . 0.0 109.852 -176.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -59.42 -35.1 73.37 Favored 'General case' 0 C--O 1.19 -2.033 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 56.4 p -72.22 -24.0 61.33 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 118.547 0.612 . . . . 0.0 111.514 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.77 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 33.6 m-70 -74.18 -30.91 62.45 Favored 'General case' 0 C--O 1.214 -0.777 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 176.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -88.46 -29.94 19.79 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.271 0.558 . . . . 0.0 110.865 177.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -70.58 -32.54 69.97 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 122.094 0.949 . . . . 0.0 109.278 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.687 HE21 ' HA ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER 59.91 69.92 0.67 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 112.615 -2.084 . . . . 0.0 109.48 -175.472 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -86.21 -15.94 39.29 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.131 -177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.362 14.8 p 62.14 -44.51 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 128.526 2.73 . . . . 0.0 114.878 178.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 89.9 mt -130.5 121.65 26.17 Favored 'General case' 0 C--N 1.255 -3.525 0 C-N-CA 124.817 1.247 . . . . 0.0 107.984 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -64.83 116.29 6.18 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -89.35 70.47 8.14 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.207 0.527 . . . . 0.0 109.593 -178.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 19.5 t0 . . . . . 0 CA--C 1.499 -0.989 0 C-N-CA 124.768 1.227 . . . . 0.0 108.426 177.652 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.49 -1.523 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_exo -66.82 121.13 8.29 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 121.773 1.649 . . . . 0.0 109.854 177.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -78.6 121.04 24.14 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.024 -0.671 . . . . 0.0 110.769 -177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.5 tpt -115.4 86.52 2.48 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -83.36 -2.93 56.93 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 122.175 0.988 . . . . 0.0 110.968 -174.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.8 t -110.96 31.55 1.23 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.042 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 -170.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -83.62 -9.81 58.65 Favored 'General case' 0 N--CA 1.423 -1.785 0 CA-C-O 122.62 1.2 . . . . 0.0 110.535 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -125.09 98.83 5.84 Favored 'General case' 0 C--N 1.282 -2.34 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.666 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -118.12 140.58 49.57 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 175.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 39.6 t -65.72 115.23 20.57 Favored Pre-proline 0 C--N 1.299 -1.602 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 173.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -66.81 -5.25 12.83 Favored 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.096 1.864 . . . . 0.0 112.185 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.641 HD21 HG13 ' A' ' 30' ' ' VAL . 0.4 OUTLIER -99.11 -54.36 3.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 116.182 -0.463 . . . . 0.0 112.133 -178.8 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.485 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 19.7 p -108.89 -5.82 16.01 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.967 -176.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 78.34 3.7 2.7 Favored 'General case' 0 C--N 1.31 -1.142 0 N-CA-C 114.399 1.259 . . . . 0.0 114.399 179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.468 HD23 ' CZ ' ' A' ' 17' ' ' PHE . 36.4 tp -54.76 136.31 46.37 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 68.4 mtm -100.22 131.78 45.96 Favored 'General case' 0 C--N 1.29 -1.991 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.77 -173.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.468 ' CZ ' HD23 ' A' ' 15' ' ' LEU . 97.0 m-85 -120.63 148.67 48.59 Favored Pre-proline 0 C--N 1.292 -1.916 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.339 179.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -62.02 152.32 76.14 Favored 'Trans proline' 0 CA--C 1.55 1.325 0 C-N-CA 122.449 2.099 . . . . 0.0 111.679 176.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -70.92 -14.66 32.55 Favored 'Trans proline' 0 CA--C 1.508 -0.801 0 C-N-CA 122.708 2.272 . . . . 0.0 112.012 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -108.15 16.28 23.44 Favored 'General case' 0 C--N 1.297 -1.675 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.299 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -81.32 153.07 27.25 Favored 'General case' 0 N--CA 1.404 -2.733 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.73 103.56 0.35 Allowed 'General case' 0 C--N 1.277 -2.547 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.332 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -65.5 -28.31 69.1 Favored 'General case' 0 N--CA 1.409 -2.508 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.486 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 14.7 m -64.49 -28.31 69.57 Favored 'General case' 0 C--O 1.211 -0.951 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 177.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -85.97 -32.64 21.43 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.029 178.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.499 ' O ' HG23 ' A' ' 30' ' ' VAL . 55.3 t80 -60.58 -44.11 96.59 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 124.032 0.933 . . . . 0.0 109.723 175.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -69.59 -26.71 64.59 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.748 -176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 15.8 mt-10 -72.16 -28.84 63.49 Favored 'General case' 0 CA--C 1.464 -2.343 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.494 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 5.3 t60 -78.24 -38.26 43.31 Favored 'General case' 0 N--CA 1.408 -2.547 0 C-N-CA 119.727 -0.789 . . . . 0.0 109.56 177.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.641 HG13 HD21 ' A' ' 12' ' ' LEU . 59.3 t -60.19 -49.4 84.27 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.794 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 175.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 14.3 pt-20 -73.6 -12.6 60.81 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.643 -178.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 21.9 t -74.6 -31.95 62.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.494 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 81.1 m-70 -71.5 -31.62 67.3 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.417 174.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.0 m0 -70.14 120.88 16.5 Favored 'General case' 0 N--CA 1.384 -3.76 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD3' ' HA ' ' A' ' 35' ' ' LYS . 0.7 OUTLIER -92.7 119.24 31.9 Favored 'General case' 0 N--CA 1.405 -2.719 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.984 -171.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 11.1 p -95.02 141.23 15.39 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.833 0 CA-C-N 113.449 -1.705 . . . . 0.0 113.659 -172.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.514 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 40.3 t -88.27 116.64 66.82 Favored Pre-proline 0 N--CA 1.419 -2.011 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 170.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -58.63 -30.6 92.62 Favored 'Trans proline' 0 C--N 1.323 -0.775 0 C-N-CA 122.714 2.276 . . . . 0.0 112.225 -176.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -86.82 -22.74 25.65 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.444 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.738 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 41.5 m -102.14 -26.08 13.48 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 119.914 -0.715 . . . . 0.0 111.215 179.424 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 51.1 m 66.23 26.2 10.48 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 122.13 0.967 . . . . 0.0 110.046 -176.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 32.4 mt-10 -106.13 129.89 54.12 Favored 'General case' 0 N--CA 1.381 -3.883 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.346 177.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 73.9 mt-30 -100.51 126.37 46.93 Favored 'General case' 1 C--N 1.234 -4.455 0 CA-C-N 112.12 -2.309 . . . . 0.0 108.346 -178.676 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.28 144.14 28.86 Favored Pre-proline 0 C--N 1.287 -2.113 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.152 -178.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.474 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 55.4 Cg_endo -68.04 159.55 52.54 Favored 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 121.51 1.473 . . . . 0.0 111.763 -177.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' ' HB3' ' A' ' 12' ' ' LEU . 73.1 Cg_endo -69.41 -13.0 34.82 Favored 'Trans proline' 0 N--CA 1.485 0.987 0 C-N-CA 123.419 2.746 . . . . 0.0 111.812 -177.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.474 ' OD1' ' HB2' ' A' ' 45' ' ' PRO . 6.6 p-10 -92.11 7.52 42.02 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.64 -179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 1.0 OUTLIER -82.58 178.71 8.07 Favored 'General case' 0 N--CA 1.39 -3.433 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 174.46 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.644 ' HB3' HG22 ' A' ' 52' ' ' VAL . 2.6 t70 -96.48 133.52 40.82 Favored 'General case' 1 C--N 1.238 -4.272 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -176.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.428 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 11.4 tt0 -67.6 -33.56 75.26 Favored 'General case' 0 C--N 1.273 -2.732 0 C-N-CA 119.244 -0.982 . . . . 0.0 109.394 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.566 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 49.8 mt-30 -72.41 -35.3 68.34 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.93 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.644 HG22 ' HB3' ' A' ' 49' ' ' ASP . 19.7 m -72.44 -30.6 35.21 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.02 -45.88 25.74 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 115.146 -0.933 . . . . 0.0 110.819 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 29.1 mm-40 -58.16 -43.88 87.63 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.566 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.2 mpt_? -57.76 -46.11 85.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.911 176.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.571 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 81.7 t60 -56.38 -50.85 70.39 Favored 'General case' 0 C--O 1.213 -0.849 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.309 178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.51 -39.72 84.68 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.037 0 CA-C-O 121.197 0.522 . . . . 0.0 109.792 -176.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -59.12 -40.13 84.47 Favored 'General case' 0 C--O 1.18 -2.562 0 CA-C-N 114.968 -1.015 . . . . 0.0 112.533 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.1 p -63.64 -27.91 69.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.738 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.5 m-70 -70.12 -33.81 72.3 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 177.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -89.44 -31.29 17.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.037 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -72.04 -44.82 62.76 Favored 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 121.798 0.809 . . . . 0.0 109.519 -176.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 56.85 20.47 5.26 Favored 'General case' 0 C--N 1.288 -2.095 0 C-N-CA 126.203 1.801 . . . . 0.0 113.58 173.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 52.7 m-80 -81.45 5.8 16.57 Favored 'General case' 0 N--CA 1.477 0.876 0 O-C-N 121.094 -1.004 . . . . 0.0 111.295 178.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.1 -18.38 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 122.989 1.376 . . . . 0.0 108.361 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.401 HD12 ' OXT' ' A' ' 69' ' ' ASP . 50.1 tp -109.36 103.24 12.14 Favored 'General case' 0 C--N 1.289 -2.056 0 CA-C-N 112.906 -1.952 . . . . 0.0 106.304 175.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -176.79 -55.09 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -62.63 -45.33 93.37 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 113.791 -1.55 . . . . 0.0 106.862 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.401 ' OXT' HD12 ' A' ' 66' ' ' LEU . 34.3 t70 . . . . . 0 N--CA 1.426 -1.674 0 N-CA-C 102.648 -3.093 . . . . 0.0 102.648 174.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.578 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.6 -38.07 94.86 Favored 'Trans proline' 0 C--N 1.361 1.226 0 C-N-CA 122.912 2.408 . . . . 0.0 111.262 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.3 m-70 -94.52 114.27 26.23 Favored 'General case' 0 C--N 1.31 -1.11 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 90.1 mtp -100.39 -176.76 3.3 Favored 'General case' 0 N--CA 1.395 -3.216 0 CA-C-O 121.826 0.822 . . . . 0.0 109.278 -178.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -95.56 108.66 20.93 Favored 'General case' 0 C--N 1.255 -3.519 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.64 -176.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.9 p -157.23 46.84 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.298 -1.653 0 CA-C-O 123.534 1.635 . . . . 0.0 107.586 -175.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -82.14 -5.51 58.5 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 113.473 -1.694 . . . . 0.0 111.871 -175.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -150.2 132.81 15.79 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.408 ' HE3' ' HB2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -133.71 144.75 49.32 Favored 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.2 t -70.13 115.71 37.04 Favored Pre-proline 0 C--N 1.297 -1.709 0 N-CA-C 104.676 -2.342 . . . . 0.0 104.676 169.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -68.92 -11.59 32.23 Favored 'Trans proline' 0 CA--C 1.517 -0.329 0 C-N-CA 121.839 1.693 . . . . 0.0 112.879 -168.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 16.0 mt -101.01 -10.23 20.72 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 120.147 -0.621 . . . . 0.0 112.079 -176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.3 p -134.47 -16.43 2.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.54 -0.864 . . . . 0.0 112.993 175.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 72.7 21.52 3.44 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 125.829 1.652 . . . . 0.0 112.251 -176.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -59.97 129.04 39.82 Favored 'General case' 0 CA--C 1.506 -0.718 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 173.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 85.9 mtp -85.57 125.85 33.43 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.704 -170.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -122.65 147.95 51.94 Favored Pre-proline 0 C--N 1.303 -1.441 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.761 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.3 162.86 33.3 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.514 2.143 . . . . 0.0 110.711 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.99 3.96 3.55 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.49 2.127 . . . . 0.0 112.55 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -112.63 5.38 17.76 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-O 121.498 0.666 . . . . 0.0 109.808 178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -65.07 153.36 41.01 Favored 'General case' 0 N--CA 1.415 -2.217 0 CA-C-O 121.73 0.776 . . . . 0.0 110.405 178.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 18.8 t70 -73.02 125.97 28.87 Favored 'General case' 0 C--N 1.268 -2.956 0 CA-C-N 113.83 -1.532 . . . . 0.0 110.411 -176.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -63.58 -38.98 93.18 Favored 'General case' 0 C--N 1.269 -2.919 0 CA-C-N 113.891 -1.504 . . . . 0.0 112.56 179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.666 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 33.1 t -70.91 -52.04 22.49 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -54.6 -33.44 60.43 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.323 0.649 . . . . 0.0 110.667 179.646 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.542 ' O ' HG23 ' A' ' 30' ' ' VAL . 90.7 t80 -56.82 -51.53 68.61 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 123.423 0.689 . . . . 0.0 109.981 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -72.61 -30.59 64.48 Favored 'General case' 0 CA--C 1.489 -1.399 0 CA-C-N 116.079 -0.509 . . . . 0.0 109.822 -177.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.666 ' HG3' ' O ' ' A' ' 24' ' ' SER . 28.3 mt-10 -68.52 -23.45 64.54 Favored 'General case' 0 CA--C 1.483 -1.611 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.825 177.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.404 ' O ' ' HD2' ' A' ' 29' ' ' HIS . 7.1 t-160 -82.17 -42.36 19.13 Favored 'General case' 0 N--CA 1.408 -2.574 0 C-N-CA 119.381 -0.928 . . . . 0.0 108.621 172.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 26' ' ' PHE . 25.2 t -60.34 -44.71 96.47 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.567 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.7 pt-20 -74.26 -11.94 60.41 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.902 0.382 . . . . 0.0 111.477 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 32.6 t -83.76 -24.57 31.05 Favored 'General case' 0 C--O 1.242 0.693 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 14.6 m-70 -73.17 -36.81 66.68 Favored 'General case' 0 CA--C 1.499 -0.988 0 CA-C-N 115.522 -0.763 . . . . 0.0 108.997 172.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 37.7 m0 -64.68 120.61 12.74 Favored 'General case' 0 N--CA 1.382 -3.874 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.149 178.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -67.65 108.69 3.0 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.551 -175.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.411 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 10.6 p -93.52 127.84 45.33 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.335 0 CA-C-N 113.562 -1.654 . . . . 0.0 110.176 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 33.2 t -83.49 132.61 49.06 Favored Pre-proline 0 N--CA 1.387 -3.578 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.873 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.35 -36.81 65.06 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 123.123 2.549 . . . . 0.0 112.991 -175.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.0 ttm -89.94 -35.76 15.39 Favored 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.53 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.494 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 92.7 m -88.25 -24.09 23.33 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 119.398 -0.921 . . . . 0.0 112.513 -169.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.3 p 61.11 24.49 14.59 Favored 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 125.436 1.494 . . . . 0.0 111.422 -177.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -110.91 137.74 48.17 Favored 'General case' 0 N--CA 1.38 -3.927 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.411 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 93.5 mt-30 -99.55 126.29 45.49 Favored 'General case' 1 C--N 1.232 -4.512 0 CA-C-N 111.93 -2.395 . . . . 0.0 108.861 -175.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -101.01 149.36 36.16 Favored Pre-proline 0 C--N 1.3 -1.579 0 C-N-CA 124.136 0.975 . . . . 0.0 109.914 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -57.98 162.23 11.68 Favored 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 122.897 2.398 . . . . 0.0 113.389 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.453 ' HG3' HD22 ' A' ' 12' ' ' LEU . 30.4 Cg_endo -61.64 -20.92 70.7 Favored 'Trans proline' 0 N--CA 1.482 0.812 0 C-N-CA 123.469 2.779 . . . . 0.0 111.282 178.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -75.27 -12.72 60.34 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.814 -1.085 . . . . 0.0 110.607 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.61 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -83.04 112.91 20.21 Favored 'General case' 0 N--CA 1.403 -2.806 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.541 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 9.0 t70 -66.23 147.41 53.36 Favored 'General case' 0 C--N 1.277 -2.554 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 179.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -66.05 -30.31 70.82 Favored 'General case' 0 C--N 1.265 -3.068 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.39 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.541 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 10.5 pt20 -70.58 -35.38 73.02 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.346 0.593 . . . . 0.0 109.466 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.61 HG12 ' CE2' ' A' ' 48' ' ' TYR . 97.0 t -73.97 -35.93 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.908 0 N-CA-C 108.069 -1.086 . . . . 0.0 108.069 179.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.405 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.7 t80 -68.22 -46.66 69.95 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.778 175.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -59.07 -35.07 72.74 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 120.879 0.371 . . . . 0.0 110.284 177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.05 -41.71 98.42 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 122.836 0.454 . . . . 0.0 109.987 177.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.597 ' O ' HG22 ' A' ' 59' ' ' THR . 35.4 t60 -62.26 -50.34 72.1 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.286 174.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 53' ' ' PHE . 65.0 t -64.14 -43.44 97.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-O 121.993 0.901 . . . . 0.0 109.664 -172.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -67.81 -25.2 65.45 Favored 'General case' 0 C--N 1.292 -1.895 0 CA-C-N 114.915 -1.039 . . . . 0.0 113.143 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.597 HG22 ' O ' ' A' ' 56' ' ' HIS . 12.7 t -78.62 -33.39 47.39 Favored 'General case' 0 N--CA 1.439 -0.977 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.792 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.553 ' HD2' ' O ' ' A' ' 56' ' ' HIS . 1.6 p80 -89.43 -11.2 43.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 119.022 -1.071 . . . . 0.0 111.771 175.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 5.2 m-30 -80.17 -35.6 36.23 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 169.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -86.66 -25.48 24.83 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-O 122.256 1.027 . . . . 0.0 109.988 -176.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 57.29 32.94 22.56 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 113.452 -1.704 . . . . 0.0 112.433 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 32.6 p30 -81.81 -16.19 51.7 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.504 175.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.1 t 60.7 70.6 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.545 0 C-N-CA 125.908 1.683 . . . . 0.0 112.774 176.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.9 tp -101.27 83.39 2.47 Favored 'General case' 0 C--N 1.294 -1.812 0 CA-C-N 114.074 -1.421 . . . . 0.0 107.242 173.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -172.61 161.9 5.0 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 105.129 -2.174 . . . . 0.0 105.129 -178.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -116.96 109.18 16.7 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 118.676 -1.209 . . . . 0.0 113.783 -171.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 C--O 1.259 1.601 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.632 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.792 0 N-CA-C 110.523 -1.031 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -86.21 124.42 2.45 Favored 'Trans proline' 0 N--CA 1.437 -1.797 0 C-N-CA 122.251 1.967 . . . . 0.0 110.904 179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 t-80 -80.67 -87.84 0.08 Allowed 'General case' 0 N--CA 1.427 -1.577 0 C-N-CA 119.888 -0.725 . . . . 0.0 109.625 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 tpt 46.52 29.98 1.01 Allowed 'General case' 0 N--CA 1.495 1.804 0 C-N-CA 124.474 1.109 . . . . 0.0 110.33 -179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -89.66 2.71 54.41 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.721 -168.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 23.6 t -135.6 57.77 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.9 t-80 -97.79 -1.52 43.08 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.135 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -86.56 97.5 10.55 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 113.67 -1.604 . . . . 0.0 110.383 -176.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -133.08 145.08 50.42 Favored 'General case' 0 C--N 1.287 -2.147 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 174.053 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 49.5 t -67.87 108.6 2.83 Favored Pre-proline 0 C--N 1.301 -1.53 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 169.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.29 -15.13 13.87 Favored 'Trans proline' 0 N--CA 1.482 0.805 0 C-N-CA 123.396 2.731 . . . . 0.0 114.727 -170.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -91.77 -39.11 11.97 Favored 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.44 -177.108 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.413 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 31.7 p -111.16 -10.16 14.32 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 119.753 -0.779 . . . . 0.0 112.057 -177.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 66.67 19.01 10.81 Favored 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 124.858 1.263 . . . . 0.0 114.003 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 24.4 tp -64.21 123.72 19.83 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 174.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 23.4 ptp -88.8 148.28 24.0 Favored 'General case' 0 C--N 1.291 -1.95 0 O-C-N 124.004 0.815 . . . . 0.0 109.77 -174.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 m-85 -122.62 157.62 58.91 Favored Pre-proline 0 C--N 1.295 -1.793 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.93 152.03 77.42 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 122.156 1.904 . . . . 0.0 109.938 173.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -58.55 -21.84 56.79 Favored 'Trans proline' 0 C--O 1.242 0.715 0 C-N-CA 122.624 2.216 . . . . 0.0 113.94 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -99.58 15.34 26.92 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.016 -0.674 . . . . 0.0 111.735 179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -65.51 152.68 43.43 Favored 'General case' 0 N--CA 1.415 -2.207 0 CA-C-O 121.996 0.903 . . . . 0.0 110.279 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.53 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 7.0 t0 -75.23 123.86 26.05 Favored 'General case' 0 C--N 1.261 -3.253 0 CA-C-N 113.494 -1.684 . . . . 0.0 108.774 -177.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 2.7 tt0 -61.09 -36.51 79.86 Favored 'General case' 0 C--N 1.275 -2.658 0 C-N-CA 124.329 1.051 . . . . 0.0 110.722 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 35.9 t -71.46 -34.46 70.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.53 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 12.0 mptt -76.91 -20.24 56.46 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.183 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.462 ' O ' HG23 ' A' ' 30' ' ' VAL . 49.7 t80 -71.7 -51.72 21.49 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.822 173.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.565 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 47.9 mt-10 -65.88 -38.83 89.81 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.19 -178.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -60.88 -29.28 69.46 Favored 'General case' 0 CA--C 1.475 -1.935 0 CA-C-O 120.83 0.347 . . . . 0.0 110.852 174.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -81.29 -36.68 29.52 Favored 'General case' 0 N--CA 1.397 -3.089 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.574 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 55.7 t -65.98 -43.78 92.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 11.6 mm-40 -63.17 -24.68 68.0 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 121.317 0.579 . . . . 0.0 109.898 177.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.0 t -76.14 -10.38 59.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.309 0.576 . . . . 0.0 110.337 -179.291 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.413 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 15.3 m-70 -89.88 -25.3 21.07 Favored 'General case' 0 CA--C 1.488 -1.427 0 O-C-N 121.848 -0.533 . . . . 0.0 112.224 176.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 12.4 m0 -65.06 120.3 12.39 Favored 'General case' 1 N--CA 1.368 -4.551 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 175.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HB3' ' CE2' ' A' ' 53' ' ' PHE . 13.6 mmmm -70.26 107.29 3.67 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 114.746 -1.115 . . . . 0.0 112.282 -173.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.57 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 8.1 p -95.77 126.83 48.23 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.073 0 CA-C-N 113.194 -1.821 . . . . 0.0 111.776 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.585 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -83.51 124.94 75.01 Favored Pre-proline 0 N--CA 1.426 -1.652 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_endo -60.95 -36.88 80.95 Favored 'Trans proline' 0 C--N 1.324 -0.735 0 C-N-CA 122.139 1.893 . . . . 0.0 111.808 -177.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.2 mpp? -84.86 -15.06 45.94 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 113.491 0.922 . . . . 0.0 113.491 -178.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.758 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 34.0 m -106.71 -28.45 10.18 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.071 -0.652 . . . . 0.0 110.821 178.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.1 t 66.08 23.33 11.07 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.664 1.186 . . . . 0.0 109.379 -176.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 42.3 mt-10 -111.85 137.47 49.76 Favored 'General case' 1 N--CA 1.369 -4.496 0 CA-C-O 122.159 0.98 . . . . 0.0 109.147 -179.322 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.57 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 51.1 mt-30 -99.05 127.43 44.99 Favored 'General case' 1 C--N 1.24 -4.195 0 CA-C-N 111.295 -2.684 . . . . 0.0 110.228 -175.54 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -101.29 147.57 33.95 Favored Pre-proline 0 C--N 1.285 -2.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.928 176.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -65.03 155.35 68.69 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.297 1.998 . . . . 0.0 111.79 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -71.94 1.71 5.58 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 123.031 2.488 . . . . 0.0 110.603 175.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -85.55 -15.7 41.81 Favored 'General case' 0 C--N 1.314 -0.959 0 C-N-CA 125.111 1.364 . . . . 0.0 108.69 176.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -89.2 154.96 19.72 Favored 'General case' 0 N--CA 1.386 -3.666 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.408 ' HB3' HG23 ' A' ' 52' ' ' VAL . 7.8 t70 -83.94 129.11 34.93 Favored 'General case' 0 C--N 1.247 -3.867 0 N-CA-C 106.9 -1.518 . . . . 0.0 106.9 -176.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.589 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 5.4 pt20 -56.68 -38.97 72.99 Favored 'General case' 0 C--N 1.291 -1.976 0 O-C-N 123.898 0.748 . . . . 0.0 110.79 178.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 50' ' ' GLN . 25.7 mt-30 -68.67 -36.22 78.25 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 122.975 0.51 . . . . 0.0 110.504 -177.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.408 HG23 ' HB3' ' A' ' 49' ' ' ASP . 74.0 t -69.56 -36.36 70.66 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 178.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.534 ' CE2' ' HB3' ' A' ' 35' ' ' LYS . 87.4 t80 -71.25 -33.13 69.55 Favored 'General case' 0 N--CA 1.439 -1.007 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.715 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 38.1 mm-40 -61.46 -35.59 78.05 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -67.4 -39.19 85.56 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.338 177.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.547 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 77.4 t60 -57.32 -49.31 76.53 Favored 'General case' 0 C--O 1.205 -1.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.59 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 99.8 t -66.93 -41.01 86.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-O 121.196 0.522 . . . . 0.0 110.276 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.646 ' HA ' HE21 ' A' ' 58' ' ' GLN . 0.0 OUTLIER -59.95 -32.58 70.93 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -179.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.6 p -69.51 -25.62 64.13 Favored 'General case' 0 C--O 1.196 -1.752 0 CA-C-N 117.722 0.237 . . . . 0.0 111.164 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.758 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 32.6 m-70 -75.62 -22.48 56.8 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.441 0.639 . . . . 0.0 109.48 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -91.78 -30.98 15.93 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.177 176.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -97.48 6.25 48.45 Favored 'General case' 0 CA--C 1.481 -1.701 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -68.38 12.4 0.13 Allowed 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -115.11 -14.78 11.76 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 178.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.6 m -94.15 -0.72 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.601 0 CA-C-O 122.216 1.008 . . . . 0.0 109.524 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -102.39 118.15 36.26 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 173.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -85.54 130.35 34.6 Favored 'General case' 0 C--N 1.294 -1.834 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.291 178.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -96.61 14.03 26.22 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 C--N 1.302 -1.457 0 CA-C-N 113.552 -1.658 . . . . 0.0 109.088 178.619 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.562 0 N-CA-C 110.068 -1.213 . . . . 0.0 110.068 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -83.5 -3.75 10.77 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.056 1.837 . . . . 0.0 113.693 -175.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -109.57 -67.44 0.99 Allowed 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.673 -178.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 79.8 mtp 60.66 97.75 0.03 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 124.853 1.261 . . . . 0.0 110.801 -176.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -143.38 171.36 14.23 Favored 'General case' 0 C--N 1.284 -2.28 0 CA-C-O 121.728 0.775 . . . . 0.0 109.852 -175.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.7 t -138.46 33.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.281 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -93.56 -26.64 17.03 Favored 'General case' 0 N--CA 1.417 -2.122 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.402 -172.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 32.2 mmtp -116.82 77.62 1.13 Allowed 'General case' 0 C--N 1.264 -3.137 0 CA-C-O 121.435 0.636 . . . . 0.0 110.895 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.38 133.81 39.1 Favored 'General case' 0 CA--C 1.495 -1.151 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.504 173.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.461 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.0 t -61.64 120.3 55.06 Favored Pre-proline 0 C--N 1.303 -1.449 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -72.94 -5.79 17.84 Favored 'Trans proline' 0 C--N 1.312 -1.388 0 C-N-CA 121.07 1.18 . . . . 0.0 111.956 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.644 HD21 HG13 ' A' ' 30' ' ' VAL . 0.5 OUTLIER -98.18 -48.54 5.06 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.629 -178.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 15' ' ' LEU . 18.6 p -110.78 -4.56 15.24 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 119.649 -0.82 . . . . 0.0 111.493 -178.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' CYS . 42.9 mt-10 63.92 23.98 13.52 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 114.119 -1.4 . . . . 0.0 113.753 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD23 ' CE1' ' A' ' 17' ' ' PHE . 18.3 tp -65.38 127.17 30.7 Favored 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 174.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.4 ttt -96.26 133.16 40.95 Favored 'General case' 0 N--CA 1.41 -2.432 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.488 ' CE1' HD23 ' A' ' 15' ' ' LEU . 85.9 m-85 -111.44 159.57 32.57 Favored Pre-proline 0 C--N 1.287 -2.122 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.99 150.89 61.38 Favored 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 122.064 1.843 . . . . 0.0 110.71 174.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.81 -33.34 70.51 Favored 'Trans proline' 0 CA--C 1.504 -1.019 0 C-N-CA 123.119 2.546 . . . . 0.0 113.145 -178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -89.76 9.6 26.63 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 -176.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.2 t80 -62.73 143.57 57.31 Favored 'General case' 0 N--CA 1.416 -2.171 0 CA-C-O 121.917 0.865 . . . . 0.0 110.586 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.595 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 10.7 t70 -64.83 126.33 27.63 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 112.598 -2.092 . . . . 0.0 110.499 -175.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -69.94 -31.03 68.57 Favored 'General case' 0 C--N 1.268 -2.948 0 CA-C-N 114.534 -1.212 . . . . 0.0 113.661 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 m -78.22 -42.47 31.24 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -178.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.595 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 53.6 mttp -68.26 -24.74 64.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.708 176.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.8 t80 -61.09 -48.41 81.8 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 123.952 0.901 . . . . 0.0 109.331 173.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -63.35 -33.78 76.27 Favored 'General case' 0 C--O 1.202 -1.447 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.774 177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -61.99 -29.08 70.01 Favored 'General case' 0 CA--C 1.49 -1.352 0 CA-C-O 120.567 0.222 . . . . 0.0 111.184 174.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -84.15 -42.29 16.16 Favored 'General case' 0 C--N 1.284 -2.268 0 C-N-CA 119.564 -0.855 . . . . 0.0 109.429 176.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.644 HG13 HD21 ' A' ' 12' ' ' LEU . 80.8 t -58.85 -50.33 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.299 178.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.409 ' HB3' ' NE2' ' A' ' 43' ' ' GLN . 39.8 mt-10 -73.76 -11.65 60.46 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -81.75 -26.49 34.46 Favored 'General case' 0 N--CA 1.445 -0.701 0 C-N-CA 119.747 -0.781 . . . . 0.0 109.8 173.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.4 m-70 -70.67 -31.34 68.22 Favored 'General case' 0 CA--C 1.501 -0.906 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.077 172.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 28.6 m0 -71.15 126.44 29.61 Favored 'General case' 1 N--CA 1.376 -4.136 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 174.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 44' ' ' PHE . 31.5 mmmt -82.12 107.51 14.87 Favored 'General case' 0 C--N 1.276 -2.603 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.673 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.9 p -97.92 130.84 46.07 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.213 0 CA-C-N 113.924 -1.489 . . . . 0.0 112.504 -176.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.6 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 41.2 t -79.61 117.88 69.52 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 104.681 -2.341 . . . . 0.0 104.681 173.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -55.97 -38.55 94.5 Favored 'Trans proline' 0 C--N 1.328 -0.526 0 C-N-CA 122.784 2.322 . . . . 0.0 111.957 -175.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -83.42 -14.73 51.99 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.942 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.764 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 22.3 m -108.06 -25.62 11.05 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 119.861 -0.736 . . . . 0.0 110.931 178.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.3 m 62.25 29.77 17.46 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 122.213 1.006 . . . . 0.0 109.383 -176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.524 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -106.93 125.86 51.56 Favored 'General case' 1 N--CA 1.375 -4.19 0 CA-C-N 114.426 -1.261 . . . . 0.0 108.641 177.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.409 ' NE2' ' HB3' ' A' ' 31' ' ' GLU . 40.7 mt-30 -97.58 126.77 43.07 Favored 'General case' 1 C--N 1.227 -4.719 0 CA-C-N 111.33 -2.668 . . . . 0.0 108.34 -176.186 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.405 ' HD2' ' O ' ' A' ' 35' ' ' LYS . 99.0 m-85 -104.96 156.25 36.33 Favored Pre-proline 0 C--N 1.277 -2.553 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 176.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.81 161.61 41.28 Favored 'Trans proline' 0 CA--C 1.56 1.789 0 C-N-CA 121.287 1.325 . . . . 0.0 110.92 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' HD12 ' A' ' 12' ' ' LEU . 56.4 Cg_endo -67.7 -19.21 47.87 Favored 'Trans proline' 0 N--CA 1.49 1.268 0 C-N-CA 123.019 2.479 . . . . 0.0 111.568 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -101.28 22.25 12.77 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-N 114.888 -1.051 . . . . 0.0 111.799 -177.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -81.97 -168.02 1.77 Allowed 'General case' 0 N--CA 1.403 -2.777 0 N-CA-C 104.24 -2.504 . . . . 0.0 104.24 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.591 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 8.1 t70 -110.14 135.22 51.27 Favored 'General case' 0 C--N 1.26 -3.294 0 N-CA-C 107.51 -1.292 . . . . 0.0 107.51 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.603 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 14.2 mm100 -66.51 -37.08 84.27 Favored 'General case' 0 C--N 1.282 -2.329 0 O-C-N 124.014 0.821 . . . . 0.0 111.606 179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.591 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 26.2 pt20 -71.9 -31.98 66.95 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.141 -0.623 . . . . 0.0 109.791 -178.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 86.7 t -71.92 -31.77 41.92 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.831 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.424 ' O ' HG23 ' A' ' 57' ' ' VAL . 77.7 t80 -73.64 -50.32 21.62 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 114.319 -1.309 . . . . 0.0 110.108 177.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 52.4 mt-10 -59.16 -46.5 88.21 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-O 120.801 0.334 . . . . 0.0 111.072 -177.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.426 ' O ' HG23 ' A' ' 59' ' ' THR . 41.7 mtp180 -62.39 -39.4 93.11 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.95 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.43 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 76.5 t60 -63.79 -48.5 76.64 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.796 176.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 53' ' ' PHE . 96.3 t -66.17 -36.7 78.05 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.848 0 CA-C-O 121.435 0.636 . . . . 0.0 110.202 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -65.03 -21.89 66.91 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 55' ' ' ARG . 61.9 p -71.11 -28.87 64.62 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.764 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 30.4 m-70 -77.19 -29.0 54.13 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 115.078 -0.964 . . . . 0.0 109.14 -179.468 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -81.19 -30.39 34.35 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.823 175.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.536 ' O ' ' HG ' ' A' ' 66' ' ' LEU . 17.8 t70 -72.34 -46.28 56.19 Favored 'General case' 0 CA--C 1.499 -1.006 0 CA-C-O 122.579 1.181 . . . . 0.0 109.233 178.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 66.79 15.57 10.17 Favored 'General case' 0 C--N 1.291 -1.954 0 CA-C-N 112.787 -2.006 . . . . 0.0 111.222 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 63.9 t30 76.77 -25.03 0.21 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 126.194 1.797 . . . . 0.0 112.529 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.2 m -82.53 3.14 2.76 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 62' ' ' ASP . 45.2 mt -104.08 4.44 34.28 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 120.934 0.397 . . . . 0.0 110.45 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -73.36 -55.76 5.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.221 -177.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -113.87 105.06 12.81 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.537 -179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.6 t70 . . . . . 0 CA--C 1.502 -0.888 0 C-N-CA 124.458 1.103 . . . . 0.0 108.498 177.966 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.701 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.4 106.55 1.43 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.159 1.906 . . . . 0.0 110.62 177.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 14.4 p-80 -94.51 20.09 8.87 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.283 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.1 tpt -77.08 84.58 3.58 Favored 'General case' 0 C--O 1.246 0.898 0 CA-C-O 121.715 0.769 . . . . 0.0 110.409 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -158.43 127.8 5.71 Favored 'General case' 0 C--N 1.304 -1.399 0 CA-C-N 114.135 -1.393 . . . . 0.0 111.451 176.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.2 p -155.44 21.4 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.283 -2.305 0 N-CA-C 104.809 -2.293 . . . . 0.0 104.809 170.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -124.12 -22.78 4.71 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 113.928 -1.487 . . . . 0.0 113.446 -170.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.39 78.67 1.16 Allowed 'General case' 0 C--N 1.256 -3.494 0 N-CA-C 107.726 -1.212 . . . . 0.0 107.726 -177.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -133.86 144.77 49.12 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -176.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.857 ' SG ' ' HB3' ' A' ' 15' ' ' LEU 0.277 0.1 OUTLIER -51.56 104.33 0.42 Allowed Pre-proline 0 CA--C 1.576 1.947 0 N-CA-C 102.59 -3.115 . . . . 0.0 102.59 168.354 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -67.3 -31.06 36.16 Favored 'Trans proline' 0 CA--C 1.51 -0.713 0 C-N-CA 121.786 1.658 . . . . 0.0 113.895 -166.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.663 ' HG ' ' CG ' ' A' ' 46' ' ' PRO . 0.3 OUTLIER -102.6 -18.13 15.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-O 122.881 1.324 . . . . 0.0 108.18 -178.468 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.477 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -122.33 1.38 9.62 Favored 'General case' 0 N--CA 1.401 -2.894 0 N-CA-C 117.384 2.365 . . . . 0.0 117.384 -157.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.413 ' N ' ' HB3' ' A' ' 10' ' ' CYS 0.293 65.9 mm-40 65.19 -10.74 0.17 Allowed 'General case' 0 N--CA 1.508 2.461 0 N-CA-C 120.242 3.423 . . . . 0.0 120.242 169.168 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.857 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 1.7 tt -59.27 157.1 11.32 Favored 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 123.671 0.788 . . . . 0.0 109.322 169.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 25.2 ptt? -120.47 151.34 39.47 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 119.014 -1.075 . . . . 0.0 111.532 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.505 ' HZ ' ' ND1' ' A' ' 29' ' ' HIS . 94.7 m-85 -119.68 154.11 54.66 Favored Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.33 146.37 68.81 Favored 'Trans proline' 0 N--CA 1.444 -1.39 0 N-CA-C 108.87 -1.242 . . . . 0.0 108.87 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -61.92 -6.6 7.99 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.216 2.61 . . . . 0.0 113.251 179.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -96.58 0.32 49.84 Favored 'General case' 0 C--N 1.293 -1.869 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.18 -179.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -71.23 152.82 42.95 Favored 'General case' 0 N--CA 1.409 -2.481 0 CA-C-O 121.701 0.763 . . . . 0.0 109.88 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 15.0 t70 -82.49 130.36 35.09 Favored 'General case' 0 C--N 1.268 -2.962 0 CA-C-N 114.191 -1.368 . . . . 0.0 109.825 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.604 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 38.8 mt-30 -64.45 -37.77 88.68 Favored 'General case' 0 C--N 1.269 -2.929 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.307 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 24.2 m -72.71 -31.31 64.89 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 -179.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 75.0 mmtt -72.89 -20.08 61.16 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.159 175.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 30' ' ' VAL . 54.5 t80 -80.73 -34.21 34.62 Favored 'General case' 0 C--N 1.312 -1.05 0 C-N-CA 124.206 1.002 . . . . 0.0 109.913 177.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 10.3 mm-40 -65.18 -36.06 83.04 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 24' ' ' SER . 17.1 mt-10 -65.33 -29.07 69.78 Favored 'General case' 0 CA--C 1.467 -2.232 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.513 178.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.775 ' HE1' ' SG ' ' A' ' 10' ' ' CYS . 0.2 OUTLIER -75.52 -49.58 18.27 Favored 'General case' 0 N--CA 1.392 -3.369 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.663 178.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 26' ' ' PHE . 45.8 t -63.03 -44.26 99.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.732 -176.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 34' ' ' TRP . 54.6 mt-10 -68.03 -20.79 65.02 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.51 0.189 . . . . 0.0 111.51 178.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 51.1 m -87.12 -14.81 40.26 Favored 'General case' 0 N--CA 1.444 -0.738 0 C-N-CA 120.295 -0.562 . . . . 0.0 111.857 178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 82.5 m-70 -75.8 -30.78 59.18 Favored 'General case' 0 CA--C 1.496 -1.116 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.549 171.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.469 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 29.2 m0 -62.39 126.23 26.61 Favored 'General case' 1 N--CA 1.377 -4.093 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.068 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.46 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 46.7 mmtm -76.54 102.19 5.97 Favored 'General case' 0 C--N 1.281 -2.397 0 CA-C-O 121.946 0.879 . . . . 0.0 111.764 -173.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.7 p -99.38 124.34 52.63 Favored 'Isoleucine or valine' 0 C--N 1.271 -2.811 0 CA-C-N 113.824 -1.535 . . . . 0.0 113.192 -176.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 52.3 t -82.81 124.58 76.93 Favored Pre-proline 0 N--CA 1.423 -1.808 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 177.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -73.67 -6.76 19.2 Favored 'Trans proline' 0 C--N 1.325 -0.674 0 C-N-CA 122.241 1.96 . . . . 0.0 111.19 -177.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 35.6 mtm -110.75 -3.36 15.82 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.013 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.774 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 35.9 m -123.69 -29.31 3.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 120.916 0.389 . . . . 0.0 110.165 174.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.8 m 70.09 19.61 6.71 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.43 1.492 . . . . 0.0 109.366 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 43.8 mt-10 -103.58 138.52 40.15 Favored 'General case' 1 N--CA 1.371 -4.409 0 CA-C-N 114.36 -1.291 . . . . 0.0 107.846 -176.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.475 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.9 mt-30 -111.05 127.02 55.41 Favored 'General case' 1 C--N 1.224 -4.852 0 CA-C-N 111.764 -2.471 . . . . 0.0 109.142 -173.608 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.46 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 58.4 m-85 -95.77 151.37 38.38 Favored Pre-proline 0 C--N 1.273 -2.74 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -66.01 158.77 52.57 Favored 'Trans proline' 0 CA--C 1.534 0.509 0 C-N-CA 122.423 2.082 . . . . 0.0 111.681 -176.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.663 ' CG ' ' HG ' ' A' ' 12' ' ' LEU . 23.8 Cg_exo -62.92 -15.62 48.7 Favored 'Trans proline' 0 C--N 1.328 -0.545 0 C-N-CA 123.042 2.495 . . . . 0.0 113.047 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -94.19 11.64 29.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.906 0.384 . . . . 0.0 110.563 -179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -89.07 168.68 12.14 Favored 'General case' 0 N--CA 1.385 -3.694 0 N-CA-C 103.886 -2.635 . . . . 0.0 103.886 176.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.628 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 6.1 t70 -103.53 138.63 39.97 Favored 'General case' 1 C--N 1.24 -4.167 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 -177.543 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.503 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.07 -34.46 78.48 Favored 'General case' 0 C--N 1.283 -2.294 0 O-C-N 123.843 0.714 . . . . 0.0 111.013 -179.818 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.628 ' HG2' ' OD1' ' A' ' 49' ' ' ASP . 4.4 pt20 -71.12 -34.59 71.21 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.392 -178.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 69.1 t -71.28 -36.32 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.739 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 59.2 t80 -68.39 -34.71 76.51 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 114.59 -1.186 . . . . 0.0 110.067 177.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 44.5 mt-10 -57.25 -40.6 77.94 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 177.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -67.57 -37.98 83.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.324 -177.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.636 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 80.6 t60 -62.03 -46.36 89.5 Favored 'General case' 0 C--O 1.192 -1.956 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.619 175.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 92.6 t -69.0 -40.76 81.3 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.171 0 CA-C-O 121.492 0.663 . . . . 0.0 110.361 -176.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -63.99 -35.12 79.67 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.103 -0.953 . . . . 0.0 113.364 -178.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.414 HG22 ' O ' ' A' ' 56' ' ' HIS . 14.2 t -72.51 -18.9 61.61 Favored 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.14 -179.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.774 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 34.5 m-70 -73.93 -32.75 63.66 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 173.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -83.02 -34.39 26.28 Favored 'General case' 0 CA--C 1.506 -0.745 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.639 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -71.37 -46.39 60.5 Favored 'General case' 0 CA--C 1.495 -1.144 0 CA-C-O 122.203 1.002 . . . . 0.0 109.151 -178.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.453 ' HB3' HG12 ' A' ' 65' ' ' VAL . 8.0 tt0 59.28 4.43 0.47 Allowed 'General case' 0 CA--C 1.571 1.776 0 C-N-CA 126.649 1.98 . . . . 0.0 112.701 176.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.5 m-20 73.76 8.21 4.93 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.198 1.399 . . . . 0.0 110.766 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' A' ' 63' ' ' GLN . 13.4 p -95.36 -14.81 7.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 123.109 1.433 . . . . 0.0 108.092 177.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.7 tp -99.98 10.6 41.04 Favored 'General case' 0 C--N 1.286 -2.184 0 CA-C-N 113.19 -1.823 . . . . 0.0 107.861 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -133.51 -179.36 5.47 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 104.954 -2.239 . . . . 0.0 104.954 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -94.81 106.65 18.64 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-O 121.845 0.831 . . . . 0.0 111.351 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.1 t70 . . . . . 0 C--N 1.291 -1.975 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.756 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.099 0 N-CA-C 111.003 -0.839 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -88.83 28.61 0.47 Allowed 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 122.916 2.41 . . . . 0.0 112.44 -177.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.4 t60 -143.04 136.26 28.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 44.9 tpp 64.01 95.33 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 122.147 0.975 . . . . 0.0 112.025 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -81.35 20.33 0.87 Allowed 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -121.7 0.61 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 N-CA-C 105.158 -2.164 . . . . 0.0 105.158 176.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.4 t-80 -115.56 11.72 15.94 Favored 'General case' 0 N--CA 1.399 -2.977 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -96.0 97.37 9.55 Favored 'General case' 0 N--CA 1.408 -2.533 0 CA-C-N 113.424 -1.717 . . . . 0.0 109.478 -178.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 0.0 OUTLIER -125.38 145.76 49.9 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 113.575 -1.648 . . . . 0.0 106.706 178.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.6 t -56.51 109.66 1.84 Allowed Pre-proline 0 C--O 1.21 -1.023 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -57.4 -15.34 18.98 Favored 'Trans proline' 0 N--CA 1.482 0.796 0 C-N-CA 122.926 2.417 . . . . 0.0 114.598 -169.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.622 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -90.86 -40.56 11.68 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 120.575 -0.45 . . . . 0.0 112.145 -176.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.452 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 26.6 p -108.38 -20.61 13.07 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-O 121.693 0.759 . . . . 0.0 111.125 -179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 9' ' ' LYS 0.332 43.8 mt-10 61.81 46.02 7.24 Favored 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.417 1.487 . . . . 0.0 114.34 -174.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 tt -77.44 137.04 38.45 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 105.356 -2.09 . . . . 0.0 105.356 171.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 72.9 mtm -91.62 138.74 31.32 Favored 'General case' 0 C--N 1.289 -2.044 0 O-C-N 123.981 0.801 . . . . 0.0 111.643 -171.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -124.49 149.22 60.99 Favored Pre-proline 0 C--N 1.31 -1.137 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.026 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HD2' ' HB2' ' A' ' 21' ' ' TYR . 83.8 Cg_endo -84.01 170.49 11.02 Favored 'Trans proline' 0 CA--C 1.543 0.936 0 C-N-CA 122.596 2.197 . . . . 0.0 110.606 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -70.74 7.15 1.35 Allowed 'Trans proline' 0 N--CA 1.481 0.774 0 C-N-CA 122.992 2.461 . . . . 0.0 112.966 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -112.49 -0.83 15.13 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.482 -177.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.447 ' HB2' ' HD2' ' A' ' 18' ' ' PRO . 90.7 t80 -75.96 142.99 41.83 Favored 'General case' 0 N--CA 1.396 -3.127 0 CA-C-O 121.716 0.77 . . . . 0.0 110.511 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -62.96 109.62 1.52 Allowed 'General case' 0 C--N 1.289 -2.041 0 CA-C-N 113.541 -1.663 . . . . 0.0 110.494 -178.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -58.93 -35.39 73.01 Favored 'General case' 0 C--N 1.284 -2.248 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.676 -179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.6 t -68.96 -30.58 69.04 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-O 121.556 0.693 . . . . 0.0 109.271 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -78.53 -28.09 46.11 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.133 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.474 ' O ' HG23 ' A' ' 30' ' ' VAL . 91.3 t80 -59.03 -45.48 90.62 Favored 'General case' 0 C--O 1.226 -0.141 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.21 -38.21 89.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.441 179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 29.4 mm-40 -64.12 -38.51 91.31 Favored 'General case' 0 CA--C 1.476 -1.874 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.106 176.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -72.19 -40.55 67.81 Favored 'General case' 0 N--CA 1.4 -2.965 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.696 -178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.622 HG13 HD21 ' A' ' 12' ' ' LEU . 98.5 t -64.49 -43.07 96.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 177.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 9.8 pt-20 -73.72 -14.69 61.18 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.643 -178.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 t -77.16 -19.73 56.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.452 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 9.0 m-70 -81.35 -25.84 36.03 Favored 'General case' 0 CA--C 1.491 -1.305 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.844 176.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.0 m0 -70.49 127.38 32.52 Favored 'General case' 1 N--CA 1.37 -4.471 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 176.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -70.23 103.67 2.43 Favored 'General case' 0 C--N 1.287 -2.113 0 CA-C-N 114.92 -1.036 . . . . 0.0 111.079 -175.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.482 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 7.2 p -94.33 123.65 46.52 Favored 'Isoleucine or valine' 0 C--N 1.265 -3.102 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.818 -178.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.457 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 14.2 t -74.85 133.75 75.85 Favored Pre-proline 0 N--CA 1.396 -3.147 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.698 -177.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.9 -36.06 85.25 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.869 2.379 . . . . 0.0 113.024 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 38.6 ttp -99.7 -21.29 15.87 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 120.467 -0.493 . . . . 0.0 112.316 -177.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.457 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 69.4 m -99.0 -28.72 13.29 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.001 -1.079 . . . . 0.0 111.767 -175.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 67.2 m 65.35 21.9 11.98 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.058 0.943 . . . . 0.0 110.79 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 44.1 mt-10 -95.63 134.36 38.62 Favored 'General case' 1 N--CA 1.366 -4.648 0 N-CA-C 107.362 -1.347 . . . . 0.0 107.362 177.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.422 HE22 ' HB2' ' A' ' 31' ' ' GLU . 51.2 mt-30 -102.92 126.57 50.13 Favored 'General case' 1 C--N 1.212 -5.404 0 CA-C-N 111.825 -2.443 . . . . 0.0 108.317 -175.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -104.22 161.85 21.65 Favored Pre-proline 0 C--N 1.275 -2.648 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -62.61 159.23 37.69 Favored 'Trans proline' 0 CA--C 1.549 1.255 0 C-N-CA 121.243 1.295 . . . . 0.0 111.898 -179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' ' CD1' ' A' ' 12' ' ' LEU . 14.6 Cg_endo -57.73 -28.2 80.93 Favored 'Trans proline' 0 N--CA 1.49 1.315 0 C-N-CA 124.088 3.192 . . . . 0.0 111.926 -179.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -84.97 5.01 30.98 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.559 -1.201 . . . . 0.0 112.974 -177.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.483 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -81.04 115.95 20.75 Favored 'General case' 0 N--CA 1.405 -2.676 0 N-CA-C 106.275 -1.75 . . . . 0.0 106.275 175.581 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.442 ' HB3' HG23 ' A' ' 52' ' ' VAL . 16.9 t70 -62.6 138.95 58.6 Favored 'General case' 0 C--N 1.27 -2.874 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.796 -173.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.599 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -57.38 -37.16 72.23 Favored 'General case' 0 C--N 1.283 -2.288 0 O-C-N 124.22 0.95 . . . . 0.0 112.524 -179.38 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.528 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 mm-40 -69.86 -40.79 75.56 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 121.149 -0.22 . . . . 0.0 110.772 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.483 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.0 t -67.7 -35.98 74.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-O 121.925 0.869 . . . . 0.0 108.797 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -66.84 -45.12 79.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.712 -1.131 . . . . 0.0 110.366 176.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 76.2 mm-40 -61.97 -39.29 91.66 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 120.668 -0.413 . . . . 0.0 110.294 177.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.2 mpt_? -57.01 -42.91 81.23 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.599 175.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.481 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 40.0 t60 -56.86 -53.12 61.49 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.417 174.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.577 ' HA ' ' HE2' ' A' ' 60' ' ' HIS . 60.0 t -63.18 -42.13 95.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 122.094 0.949 . . . . 0.0 109.502 -173.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -68.2 -21.18 64.88 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-N 115.038 -0.983 . . . . 0.0 113.527 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 63' ' ' GLN . 37.8 p -76.46 -46.39 27.06 Favored 'General case' 0 C--O 1.194 -1.825 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.071 179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.577 ' HE2' ' HA ' ' A' ' 57' ' ' VAL 0.311 0.5 OUTLIER -71.44 -9.81 58.76 Favored 'General case' 0 C--O 1.221 -0.433 0 C-N-CA 119.131 -1.028 . . . . 0.0 113.476 178.978 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.525 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 33.5 m-85 -92.83 -18.69 22.54 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.909 169.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -117.75 -12.95 10.18 Favored 'General case' 0 CA--C 1.49 -1.345 0 C-N-CA 118.608 -1.237 . . . . 0.0 113.622 -172.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 59' ' ' THR . 18.6 pt20 -76.41 52.85 0.8 Allowed 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 59.47 29.73 19.32 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.89 1.329 . . . . 0.0 110.899 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -80.62 -3.31 6.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-O 122.53 1.157 . . . . 0.0 110.495 178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.495 ' O ' HD12 ' A' ' 66' ' ' LEU . 3.5 pp -121.92 116.65 24.76 Favored 'General case' 0 C--N 1.278 -2.512 0 CA-C-N 113.945 -1.48 . . . . 0.0 108.6 177.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -92.16 94.49 9.23 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -105.08 -35.65 7.55 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.776 -176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 . . . . . 0 C--N 1.305 -1.362 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 -176.834 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.388 0 CA-C-O 119.281 -0.733 . . . . 0.0 111.567 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.561 ' HA ' ' OD1' ' A' ' 5' ' ' ASP . 44.2 Cg_endo -67.31 86.21 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 123.514 2.809 . . . . 0.0 114.289 -174.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -159.26 -52.59 0.06 Allowed 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.447 ' HA ' ' CE1' ' A' ' 7' ' ' HIS . 76.7 mtp -68.17 -27.89 66.81 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 122.897 1.332 . . . . 0.0 111.453 -175.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.561 ' OD1' ' HA ' ' A' ' 2' ' ' PRO . 7.1 p-10 -82.82 5.44 21.61 Favored 'General case' 0 C--N 1.249 -3.767 0 CA-C-N 112.944 -1.934 . . . . 0.0 111.944 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.1 t -119.62 8.59 6.56 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.449 0 N-CA-C 106.692 -1.596 . . . . 0.0 106.692 -178.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.447 ' CE1' ' HA ' ' A' ' 4' ' ' MET . 41.7 m170 -84.65 -0.62 54.07 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-N 114.861 -1.063 . . . . 0.0 111.813 -177.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -113.1 87.24 2.55 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.906 177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.05 140.05 46.4 Favored 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.371 176.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 14' ' ' GLU . 36.6 t -58.45 115.83 12.9 Favored Pre-proline 0 C--O 1.205 -1.247 0 N-CA-C 106.271 -1.752 . . . . 0.0 106.271 173.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -73.36 3.87 4.36 Favored 'Trans proline' 0 C--N 1.316 -1.136 0 C-N-CA 121.685 1.59 . . . . 0.0 112.522 -173.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HG3' ' A' ' 46' ' ' PRO . 20.2 mt -103.91 -48.49 3.89 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.148 -177.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.1 p -107.84 -14.35 14.8 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 121.836 0.826 . . . . 0.0 110.36 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.404 ' HA ' ' O ' ' A' ' 10' ' ' CYS 0.303 44.9 mt-10 56.65 66.09 1.26 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 125.349 1.459 . . . . 0.0 113.444 -174.303 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.9 tt -102.89 138.35 39.89 Favored 'General case' 0 N--CA 1.428 -1.537 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 174.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 28.0 ttt -87.59 127.5 35.27 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 124.051 0.844 . . . . 0.0 111.51 -172.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -114.97 158.92 39.52 Favored Pre-proline 0 C--N 1.305 -1.351 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 177.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.52 149.47 86.58 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 122.813 2.342 . . . . 0.0 111.424 175.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.97 -32.12 96.92 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 122.518 2.145 . . . . 0.0 112.976 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -100.23 18.48 18.65 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.036 -177.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -68.83 149.82 48.51 Favored 'General case' 0 N--CA 1.399 -3.024 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 26.1 t70 -70.89 128.94 37.73 Favored 'General case' 0 C--N 1.268 -2.937 0 CA-C-N 114.056 -1.429 . . . . 0.0 111.131 -174.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.6 mt-30 -64.42 -41.51 96.56 Favored 'General case' 0 C--N 1.266 -3.064 0 CA-C-N 113.699 -1.591 . . . . 0.0 113.169 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.532 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 23.9 p -73.3 -37.08 66.33 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 119.656 -0.817 . . . . 0.0 111.484 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.574 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 1.1 mpmm? -66.26 -29.47 69.71 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 121.717 0.77 . . . . 0.0 110.399 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' A' ' 23' ' ' GLN . 42.5 t80 -66.49 -41.17 89.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 124.768 1.227 . . . . 0.0 110.148 175.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 49.9 mt-10 -67.75 -27.74 67.04 Favored 'General case' 0 C--O 1.204 -1.342 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.659 -179.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' HG3' ' O ' ' A' ' 24' ' ' SER . 21.9 mt-10 -70.24 -27.66 64.62 Favored 'General case' 0 CA--C 1.462 -2.422 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 177.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.473 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 15.9 t60 -79.94 -36.16 36.67 Favored 'General case' 0 N--CA 1.416 -2.17 0 C-N-CA 119.276 -0.97 . . . . 0.0 109.483 176.107 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 48.2 t -66.25 -48.07 82.35 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -71.8 -8.44 54.3 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 120.766 0.317 . . . . 0.0 110.995 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.458 ' HB2' ' O ' ' A' ' 28' ' ' GLU . 42.1 t -78.53 -39.34 38.24 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 175.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.473 ' HD2' ' O ' ' A' ' 29' ' ' HIS . 46.7 m-70 -64.78 -28.98 69.94 Favored 'General case' 0 CA--C 1.494 -1.204 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.622 175.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 23.2 m0 -72.93 120.84 19.12 Favored 'General case' 1 N--CA 1.363 -4.811 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.97 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.13 102.57 11.93 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.228 -172.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 11.0 p -95.35 125.25 48.1 Favored 'Isoleucine or valine' 0 C--N 1.275 -2.661 0 CA-C-N 114.022 -1.444 . . . . 0.0 113.607 -175.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 40' ' ' CYS 0.256 86.3 m -70.42 134.7 86.66 Favored Pre-proline 0 N--CA 1.418 -2.025 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.646 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -75.67 -15.72 19.15 Favored 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 121.207 1.272 . . . . 0.0 110.515 177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.588 ' HB2' ' CE1' ' A' ' 60' ' ' HIS . 43.9 mtm -104.65 -29.19 10.77 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.742 -178.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.45 ' HB2' ' HB2' ' A' ' 37' ' ' CYS . 89.8 m -95.79 -27.59 15.16 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.029 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.1 t 67.6 22.86 9.0 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 124.527 1.142 . . . . 0.0 109.017 -175.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.8 mt-10 -101.8 134.81 44.4 Favored 'General case' 1 N--CA 1.376 -4.162 0 CA-C-N 114.509 -1.223 . . . . 0.0 108.128 179.128 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.501 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 96.2 mt-30 -108.21 127.04 53.49 Favored 'General case' 1 C--N 1.215 -5.273 0 CA-C-N 111.536 -2.574 . . . . 0.0 108.2 -176.805 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.534 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 99.0 m-85 -100.88 152.36 37.83 Favored Pre-proline 0 C--N 1.275 -2.636 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 177.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.61 170.36 11.3 Favored 'Trans proline' 0 CA--C 1.552 1.396 0 C-N-CA 122.073 1.849 . . . . 0.0 112.44 -176.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.496 ' HG3' HD22 ' A' ' 12' ' ' LEU . 33.4 Cg_endo -60.43 -22.87 73.15 Favored 'Trans proline' 0 N--CA 1.489 1.233 0 C-N-CA 123.389 2.726 . . . . 0.0 111.82 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.37 2.17 19.55 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.263 -0.88 . . . . 0.0 111.084 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.45 111.83 23.55 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 176.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HB2' HG23 ' A' ' 52' ' ' VAL . 15.8 m-20 -66.75 141.04 57.87 Favored 'General case' 0 N--CA 1.404 -2.744 0 CA-C-N 113.436 -1.711 . . . . 0.0 107.835 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.611 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 1.1 pt20 -61.56 -36.46 80.69 Favored 'General case' 0 C--O 1.164 -3.403 0 O-C-N 123.976 0.798 . . . . 0.0 110.146 -178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.454 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 80.0 mm-40 -63.64 -30.86 71.91 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.429 HG23 ' HB2' ' A' ' 49' ' ' ASP . 90.3 t -70.55 -40.78 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 174.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.425 ' O ' HG23 ' A' ' 57' ' ' VAL . 78.3 t80 -70.71 -36.22 73.13 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.435 -1.257 . . . . 0.0 110.784 -178.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 43.6 mm-40 -58.13 -44.92 88.03 Favored 'General case' 0 CA--C 1.51 -0.559 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.454 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.8 mpt_? -64.75 -35.02 79.74 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.569 177.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 59' ' ' THR . 46.6 t60 -68.51 -41.55 79.8 Favored 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.461 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 53' ' ' PHE . 93.7 t -65.2 -38.2 82.07 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.79 0 CA-C-O 121.794 0.806 . . . . 0.0 108.911 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -72.49 -32.94 66.59 Favored 'General case' 0 N--CA 1.419 -2.024 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.67 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 56' ' ' HIS . 6.3 t -72.29 -24.21 61.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 118.092 0.406 . . . . 0.0 109.908 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.588 ' CE1' ' HB2' ' A' ' 39' ' ' MET . 40.6 m-70 -61.0 -41.85 97.3 Favored 'General case' 0 C--N 1.355 0.838 0 N-CA-C 108.496 -0.928 . . . . 0.0 108.496 171.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.52 -31.64 37.03 Favored 'General case' 0 CA--C 1.506 -0.73 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.653 -177.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.495 ' HB3' ' HA ' ' A' ' 59' ' ' THR . 26.8 t70 -69.28 -21.22 63.9 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 122.356 1.074 . . . . 0.0 109.024 177.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 54.66 20.37 2.91 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 127.994 2.517 . . . . 0.0 113.734 178.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 68.38 16.46 9.24 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 124.517 1.127 . . . . 0.0 110.545 177.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 45.3 t 52.74 71.06 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.115 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 3.7 pp -155.64 160.44 40.42 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.776 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -111.89 102.5 10.75 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-O 122.031 0.919 . . . . 0.0 111.573 179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -89.71 70.5 7.75 Favored 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 175.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 C--N 1.302 -1.495 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.168 -174.646 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.958 0 N-CA-C 110.514 -1.034 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -77.31 103.66 1.77 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.407 2.071 . . . . 0.0 111.505 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -112.86 128.07 56.36 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 121.218 0.532 . . . . 0.0 110.69 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 23.9 ttp -99.03 29.98 3.62 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -146.87 155.1 42.06 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 113.293 -1.776 . . . . 0.0 108.267 -174.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.3 p -145.8 45.7 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.74 0 CA-C-O 124.275 1.988 . . . . 0.0 106.383 177.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 m-70 67.21 39.12 3.15 Favored 'General case' 0 N--CA 1.428 -1.555 0 CA-C-N 111.174 -2.739 . . . . 0.0 110.369 -176.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -126.11 95.89 4.54 Favored 'General case' 0 C--N 1.291 -1.965 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 1.0 OUTLIER -122.34 145.98 47.75 Favored 'General case' 0 C--N 1.286 -2.193 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 178.739 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.467 ' CB ' ' HB2' ' A' ' 13' ' ' CYS . 1.0 OUTLIER -58.06 107.06 0.81 Allowed Pre-proline 0 C--N 1.315 -0.915 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 164.479 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 43.7 Cg_endo -72.97 -16.9 25.55 Favored 'Trans proline' 0 CA--C 1.504 -0.993 0 C-N-CA 120.993 1.129 . . . . 0.0 110.098 -174.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.58 ' HB2' ' CE1' ' A' ' 33' ' ' HIS . 5.4 mt -102.06 -8.66 21.25 Favored 'General case' 0 N--CA 1.415 -2.193 0 CA-C-N 114.396 -1.274 . . . . 0.0 110.179 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.62 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 89.2 m -113.08 -87.57 0.56 Allowed 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 171.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 158.7 -10.39 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 126.351 1.86 . . . . 0.0 109.343 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 10.2 mp -51.53 157.06 1.15 Allowed 'General case' 0 CA--C 1.487 -1.47 0 C-N-CA 122.92 0.488 . . . . 0.0 112.083 176.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 70.4 mtm -125.04 134.5 52.52 Favored 'General case' 0 C--N 1.274 -2.692 0 CA-C-N 114.636 -1.165 . . . . 0.0 109.156 -177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -119.9 126.91 26.65 Favored Pre-proline 0 C--N 1.293 -1.849 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.098 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -74.86 169.32 22.86 Favored 'Trans proline' 0 CA--C 1.555 1.551 0 C-N-CA 123.045 2.496 . . . . 0.0 111.959 -179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -64.32 -8.6 17.21 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 123.35 2.7 . . . . 0.0 114.906 -176.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 p-10 -99.91 3.18 44.34 Favored 'General case' 0 C--N 1.295 -1.775 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.347 179.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -78.54 153.7 31.04 Favored 'General case' 0 N--CA 1.409 -2.479 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.456 ' HB3' ' CG ' ' A' ' 25' ' ' LYS . 11.6 t70 -98.36 133.24 43.04 Favored 'General case' 0 C--N 1.253 -3.616 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.926 -175.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 27' ' ' GLU . 52.3 mt-30 -61.07 -43.36 99.01 Favored 'General case' 0 C--N 1.274 -2.713 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.899 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.8 p -75.52 -27.89 58.9 Favored 'General case' 0 C--N 1.313 -1.004 0 C-N-CA 119.847 -0.741 . . . . 0.0 109.622 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.548 ' HA ' ' OE2' ' A' ' 28' ' ' GLU . 2.5 mmmp? -75.39 -19.59 59.44 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.007 176.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -86.02 -49.0 8.15 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 123.675 0.79 . . . . 0.0 109.853 176.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 23' ' ' GLN . 25.9 mm-40 -60.0 -33.24 71.72 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 123.577 0.751 . . . . 0.0 111.344 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' OE2' ' HA ' ' A' ' 25' ' ' LYS . 12.8 pt-20 -65.03 -30.95 71.96 Favored 'General case' 0 CA--C 1.487 -1.474 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 175.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -76.31 -39.22 54.69 Favored 'General case' 0 N--CA 1.414 -2.239 0 C-N-CA 118.93 -1.108 . . . . 0.0 108.175 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 33' ' ' HIS . 18.7 t -62.29 -37.52 78.82 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.581 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.118 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -71.96 -24.78 61.66 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-O 120.852 0.358 . . . . 0.0 111.038 175.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.4 m -74.4 -29.91 61.72 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 174.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.62 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 27.9 m-70 -61.77 -42.07 98.51 Favored 'General case' 0 CA--C 1.509 -0.62 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.387 174.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 35.5 m0 -59.43 117.64 5.08 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -69.95 109.35 4.46 Favored 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 114.504 -1.225 . . . . 0.0 111.312 -172.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 8.9 p -93.61 126.68 46.01 Favored 'Isoleucine or valine' 0 C--N 1.253 -3.593 0 CA-C-N 113.331 -1.759 . . . . 0.0 109.29 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.543 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 32.5 t -81.71 136.68 47.98 Favored Pre-proline 0 N--CA 1.381 -3.924 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.013 -178.066 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -58.43 -48.63 14.68 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.501 2.134 . . . . 0.0 112.509 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.7 ttm -82.8 -34.04 27.11 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.377 -176.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 90.6 m -87.14 -28.54 22.4 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 118.79 -1.164 . . . . 0.0 111.147 -171.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 50.2 m 62.58 25.86 15.37 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 124.464 1.105 . . . . 0.0 110.962 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 36.4 mt-10 -112.1 134.72 53.48 Favored 'General case' 1 N--CA 1.365 -4.719 0 CA-C-N 114.285 -1.325 . . . . 0.0 108.23 179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.41 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 50.0 mt-30 -90.67 126.43 35.97 Favored 'General case' 1 C--N 1.236 -4.357 0 CA-C-N 111.888 -2.414 . . . . 0.0 108.745 -179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -101.27 144.4 28.49 Favored Pre-proline 0 C--N 1.276 -2.623 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.45 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.34 163.89 30.37 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.185 1.923 . . . . 0.0 111.624 -177.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.427 ' HB3' HD13 ' A' ' 12' ' ' LEU . 30.6 Cg_endo -64.77 -8.27 17.23 Favored 'Trans proline' 0 N--CA 1.486 1.034 0 C-N-CA 123.16 2.573 . . . . 0.0 111.943 177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -77.19 -8.58 57.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.992 0.901 . . . . 0.0 109.215 176.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -94.82 112.7 24.41 Favored 'General case' 0 N--CA 1.401 -2.918 0 CA-C-N 114.883 -1.053 . . . . 0.0 109.303 175.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.598 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 11.2 t70 -69.29 152.07 45.47 Favored 'General case' 0 N--CA 1.413 -2.311 0 CA-C-N 113.644 -1.616 . . . . 0.0 107.905 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -63.66 -37.11 86.11 Favored 'General case' 0 C--N 1.268 -2.955 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 13.4 pt20 -72.2 -36.97 69.35 Favored 'General case' 0 C--N 1.307 -1.266 0 C-N-CA 120.019 -0.672 . . . . 0.0 109.576 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.409 HG23 ' HB3' ' A' ' 49' ' ' ASP . 88.0 t -67.19 -43.22 88.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.238 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.412 ' O ' ' HB3' ' A' ' 56' ' ' HIS . 84.2 t80 -66.02 -40.86 91.44 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.776 178.39 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 49.0 mm-40 -66.67 -34.99 79.09 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.051 178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.614 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.7 mpt_? -62.37 -40.26 95.88 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 175.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.587 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 36.1 t60 -56.12 -54.08 49.4 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 124.148 0.905 . . . . 0.0 110.843 174.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.404 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 72.9 t -61.98 -41.38 90.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 122.066 0.936 . . . . 0.0 109.335 -173.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -74.55 -17.19 60.77 Favored 'General case' 0 C--N 1.288 -2.099 0 CA-C-N 114.753 -1.112 . . . . 0.0 113.614 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 56' ' ' HIS . 13.0 t -87.25 -36.83 17.71 Favored 'General case' 0 N--CA 1.427 -1.62 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.214 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.587 ' HD2' ' O ' ' A' ' 56' ' ' HIS 0.262 1.6 p80 -81.07 -13.1 59.09 Favored 'General case' 0 C--N 1.345 0.405 0 C-N-CA 118.48 -1.288 . . . . 0.0 111.862 174.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -80.31 -13.89 58.82 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 168.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.486 ' HB3' ' O ' ' A' ' 59' ' ' THR . 28.7 t70 -90.49 -70.55 0.67 Allowed 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.168 178.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 179.3 -31.51 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.731 0 C-N-CA 126.073 1.749 . . . . 0.0 108.959 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 68.54 73.88 0.28 Allowed 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.922 1.289 . . . . 0.0 111.945 176.041 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m 37.69 50.27 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.676 1.99 . . . . 0.0 114.293 175.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 44.8 tp -85.31 -2.91 58.59 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.06 -174.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 61.77 -106.91 0.24 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 -178.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -144.72 73.1 1.36 Allowed 'General case' 0 C--O 1.243 0.719 0 CA-C-N 117.956 0.344 . . . . 0.0 110.438 -176.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.255 1.359 0 O-C-N 124.281 0.988 . . . . 0.0 110.803 -179.653 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.89 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -66.88 -32.09 36.92 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.303 2.002 . . . . 0.0 112.751 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.0 m80 62.95 14.74 7.77 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.438 1.095 . . . . 0.0 110.935 -176.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 47.2 ttm -137.54 121.51 17.75 Favored 'General case' 0 N--CA 1.412 -2.353 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.053 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -125.62 114.86 19.26 Favored 'General case' 0 C--N 1.274 -2.715 0 CA-C-N 114.552 -1.204 . . . . 0.0 108.077 175.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.7 t -131.79 39.58 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.293 -1.891 0 N-CA-C 104.168 -2.53 . . . . 0.0 104.168 175.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -91.32 1.98 56.72 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 113.54 -1.664 . . . . 0.0 110.374 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -102.89 92.06 4.41 Favored 'General case' 0 N--CA 1.421 -1.877 0 CA-C-N 114.605 -1.179 . . . . 0.0 108.949 174.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -124.85 144.91 50.05 Favored 'General case' 0 N--CA 1.423 -1.821 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.1 t -69.17 108.36 3.01 Favored Pre-proline 0 C--N 1.3 -1.547 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 172.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -66.28 -9.82 25.2 Favored 'Trans proline' 0 CA--C 1.515 -0.443 0 C-N-CA 122.22 1.947 . . . . 0.0 112.066 -172.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 30' ' ' VAL . 15.4 mt -93.86 -16.7 23.81 Favored 'General case' 0 N--CA 1.421 -1.92 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.847 -175.494 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.464 ' HB3' ' HE1' ' A' ' 33' ' ' HIS . 30.1 p -137.09 -13.35 1.62 Allowed 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 174.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 75.64 17.94 2.29 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 125.918 1.687 . . . . 0.0 113.172 179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.4 134.99 51.06 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 174.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 63.3 mtm -97.98 132.89 43.15 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 124.259 0.974 . . . . 0.0 111.722 -171.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.419 ' HZ ' ' HD1' ' A' ' 29' ' ' HIS . 58.6 m-85 -114.97 157.91 42.1 Favored Pre-proline 0 C--N 1.3 -1.546 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 179.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -78.44 157.29 29.02 Favored 'Trans proline' 0 N--CA 1.445 -1.356 0 C-N-CA 121.443 1.429 . . . . 0.0 109.572 171.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.21 -20.76 62.66 Favored 'Trans proline' 0 CA--C 1.51 -0.719 0 C-N-CA 122.608 2.206 . . . . 0.0 113.653 -176.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -99.79 17.94 19.47 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-O 121.316 0.579 . . . . 0.0 111.658 -176.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -80.67 153.21 28.05 Favored 'General case' 0 N--CA 1.41 -2.442 0 C-N-CA 123.605 0.762 . . . . 0.0 109.301 177.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 28.6 m-20 -62.7 117.51 6.39 Favored 'General case' 0 C--N 1.29 -2.008 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.259 -178.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.463 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 47.9 mt-30 -62.17 -34.35 76.25 Favored 'General case' 0 C--N 1.288 -2.095 0 CA-C-N 114.562 -1.199 . . . . 0.0 111.356 178.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 7.4 p -64.98 -46.76 80.13 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.217 178.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 22' ' ' ASP . 73.4 mmtt -69.01 -23.32 64.08 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.636 178.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.536 ' O ' HG23 ' A' ' 30' ' ' VAL . 39.7 t80 -62.68 -44.7 95.59 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 172.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 31' ' ' GLU . 28.2 mt-10 -71.74 -34.88 69.9 Favored 'General case' 0 C--O 1.18 -2.554 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.53 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.58 ' HG3' ' O ' ' A' ' 24' ' ' SER . 47.8 mt-10 -63.96 -23.69 67.44 Favored 'General case' 0 CA--C 1.492 -1.26 0 CA-C-O 120.723 0.297 . . . . 0.0 111.413 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.419 ' HD1' ' HZ ' ' A' ' 17' ' ' PHE . 18.3 t-160 -85.47 -41.09 15.68 Favored 'General case' 0 N--CA 1.408 -2.557 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 174.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 26' ' ' PHE . 53.2 t -65.01 -43.37 96.13 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 O-C-N 122.378 -0.201 . . . . 0.0 110.827 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.476 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 26.7 mm-40 -59.19 -28.82 66.99 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.381 1.073 . . . . 0.0 109.972 176.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 65.3 m -77.55 -11.43 59.86 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.464 ' HE1' ' HB3' ' A' ' 13' ' ' CYS . 21.2 m-70 -91.23 -23.45 20.19 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 120.798 0.332 . . . . 0.0 111.03 175.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' GLU . 11.5 m95 -60.32 116.05 3.98 Favored 'General case' 0 N--CA 1.406 -2.663 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 169.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.43 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 47.9 mmtm -64.66 98.44 0.26 Allowed 'General case' 0 C--N 1.291 -1.95 0 CA-C-N 113.348 -1.751 . . . . 0.0 113.129 -168.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 42' ' ' GLU . 13.9 p -95.85 126.23 48.46 Favored 'Isoleucine or valine' 0 N--CA 1.396 -3.172 0 CA-C-N 113.299 -1.773 . . . . 0.0 111.348 -178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.623 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 53.1 t -89.41 123.62 66.42 Favored Pre-proline 0 N--CA 1.415 -2.177 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.56 -41.5 63.98 Favored 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.246 1.964 . . . . 0.0 111.401 -175.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.46 ' SD ' ' HB3' ' A' ' 60' ' ' HIS . 28.5 mtm -78.03 -27.54 48.86 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.023 -0.989 . . . . 0.0 113.34 -177.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.785 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 19.1 m -92.9 -26.9 17.41 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.375 178.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.7 p 55.69 33.55 21.55 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-O 122.604 1.193 . . . . 0.0 110.399 -172.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.4 mt-10 -112.89 138.01 50.4 Favored 'General case' 0 N--CA 1.379 -3.994 0 CA-C-N 113.918 -1.492 . . . . 0.0 107.385 178.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -106.22 127.26 53.1 Favored 'General case' 1 C--N 1.23 -4.617 0 CA-C-N 111.815 -2.448 . . . . 0.0 108.245 -178.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.43 ' HB2' ' HB2' ' A' ' 35' ' ' LYS . 94.9 m-85 -103.76 154.97 37.6 Favored Pre-proline 0 C--N 1.265 -3.094 0 CA-C-N 114.801 -1.091 . . . . 0.0 108.261 177.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -63.06 159.42 38.79 Favored 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 122.102 1.868 . . . . 0.0 111.73 -178.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -63.13 -16.18 52.76 Favored 'Trans proline' 0 N--CA 1.482 0.819 0 C-N-CA 122.503 2.135 . . . . 0.0 111.312 175.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -78.65 -8.25 58.47 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.723 -1.126 . . . . 0.0 110.816 178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -76.06 126.95 31.96 Favored 'General case' 0 N--CA 1.398 -3.075 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -64.73 137.92 58.08 Favored 'General case' 0 C--N 1.259 -3.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 109.806 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.519 HE21 ' HA ' ' A' ' 50' ' ' GLN . 0.0 OUTLIER -59.63 -38.99 82.86 Favored 'General case' 0 C--N 1.28 -2.419 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.209 178.985 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.0 mm-40 -74.75 -28.25 60.69 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 83.6 t -76.04 -39.67 36.8 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.003 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -74.0 -45.95 46.7 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.602 -0.727 . . . . 0.0 111.7 -178.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 73.7 mm-40 -63.94 -38.48 91.25 Favored 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 120.026 -0.67 . . . . 0.0 110.752 -176.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.493 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 10.0 mpt_? -70.47 -37.21 74.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.33 178.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.531 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 77.0 t60 -55.88 -49.24 73.91 Favored 'General case' 0 C--O 1.21 -0.984 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.96 -39.9 87.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-O 121.361 0.601 . . . . 0.0 109.587 -176.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.9 mm-40 -62.97 -28.83 70.36 Favored 'General case' 0 C--O 1.205 -1.263 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 70.1 p -73.77 -17.93 61.03 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.773 179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.785 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 37.1 m-70 -81.03 -23.38 38.63 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -91.34 -21.03 21.23 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.197 174.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.415 ' OD2' HG22 ' A' ' 65' ' ' VAL . 16.3 t70 -80.39 -60.76 2.2 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 121.803 0.811 . . . . 0.0 109.634 -176.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 60.35 28.17 17.77 Favored 'General case' 0 C--N 1.292 -1.919 0 CA-C-N 113.526 -1.67 . . . . 0.0 112.645 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.273 53.6 m-80 81.71 70.71 0.02 OUTLIER 'General case' 0 CA--C 1.503 -0.836 0 C-N-CA 126.38 1.872 . . . . 0.0 113.225 178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.415 HG22 ' OD2' ' A' ' 62' ' ' ASP . 20.4 m -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 CA-C-O 121.983 0.896 . . . . 0.0 108.877 173.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -70.64 106.57 3.55 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 105.833 -1.914 . . . . 0.0 105.833 175.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -87.42 117.55 26.27 Favored 'General case' 0 C--N 1.288 -2.105 0 N-CA-C 114.202 1.186 . . . . 0.0 114.202 -168.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -93.19 -45.39 7.89 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 107.083 -1.451 . . . . 0.0 107.083 170.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.0 t70 . . . . . 0 C--N 1.308 -1.232 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 179.797 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.416 ' HA2' ' HD3' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.503 -0.68 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.416 ' HD3' ' HA2' ' A' ' 1' ' ' GLY . 9.8 Cg_endo -82.0 84.05 1.95 Allowed 'Trans proline' 0 N--CA 1.437 -1.808 0 C-N-CA 122.081 1.854 . . . . 0.0 112.458 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 -85.85 99.94 11.73 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 176.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.1 mmt 67.78 -85.0 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.139 0.976 . . . . 0.0 109.761 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -157.15 114.57 3.1 Favored 'General case' 0 C--N 1.259 -3.345 0 CA-C-N 113.811 -1.541 . . . . 0.0 107.115 175.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.6 p -131.63 23.43 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.289 -2.027 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.3 m80 -101.58 8.14 41.96 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.692 -1.594 . . . . 0.0 109.929 -173.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' HG3' ' OH ' ' A' ' 21' ' ' TYR . 32.3 mmmt -80.16 101.1 8.6 Favored 'General case' 0 C--N 1.29 -1.99 0 CA-C-O 122.452 1.12 . . . . 0.0 112.02 -176.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -103.78 144.34 31.61 Favored 'General case' 0 C--N 1.265 -3.1 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 175.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 41.5 t -59.24 117.92 25.96 Favored Pre-proline 0 C--N 1.305 -1.339 0 N-CA-C 105.743 -1.947 . . . . 0.0 105.743 169.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -58.84 -15.2 25.63 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.436 2.091 . . . . 0.0 112.202 -177.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.523 HD21 HG13 ' A' ' 30' ' ' VAL . 0.3 OUTLIER -100.69 -61.08 1.41 Allowed 'General case' 0 N--CA 1.417 -2.101 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.489 -177.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 18.8 p -96.6 -9.11 30.06 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 -172.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 71.55 18.74 5.31 Favored 'General case' 0 C--N 1.308 -1.199 0 C-N-CA 124.604 1.162 . . . . 0.0 113.75 -177.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.8 tt -64.12 137.88 58.18 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 172.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 27.6 ttt -90.28 126.05 35.71 Favored 'General case' 0 N--CA 1.426 -1.651 0 C-N-CA 122.894 0.478 . . . . 0.0 111.442 -173.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.413 ' HB3' ' CD2' ' A' ' 21' ' ' TYR . 84.7 m-85 -110.0 117.0 52.85 Favored Pre-proline 0 C--N 1.302 -1.47 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.105 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.603 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 72.6 Cg_endo -85.48 154.98 10.59 Favored 'Trans proline' 0 N--CA 1.449 -1.144 0 C-N-CA 122.64 2.227 . . . . 0.0 109.601 176.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -54.02 -4.63 0.27 Allowed 'Trans proline' 0 N--CA 1.507 2.312 0 C-N-CA 124.821 3.681 . . . . 0.0 117.145 -170.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -86.77 -9.65 55.38 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.262 178.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.603 ' HD2' ' O ' ' A' ' 18' ' ' PRO . 32.1 p90 -65.29 151.91 45.05 Favored 'General case' 0 N--CA 1.432 -1.359 0 CA-C-O 121.768 0.794 . . . . 0.0 109.713 179.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 19.4 t70 -87.45 136.71 32.83 Favored 'General case' 0 C--N 1.257 -3.441 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.48 ' O ' ' HG3' ' A' ' 27' ' ' GLU . 1.6 mp0 -54.81 -46.62 74.55 Favored 'General case' 0 C--N 1.28 -2.413 0 C-N-CA 124.048 0.939 . . . . 0.0 111.581 179.14 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 m -70.65 -36.17 73.25 Favored 'General case' 0 C--N 1.307 -1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 19.1 mtpp -69.15 -19.81 64.01 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.322 178.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 30' ' ' VAL . 67.0 t80 -80.43 -48.57 12.68 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 174.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 23' ' ' GLN . 43.6 mt-10 -62.51 -41.16 98.65 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.34 -177.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' LYS . 9.9 pt-20 -63.71 -24.51 67.8 Favored 'General case' 0 CA--C 1.487 -1.458 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 177.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.441 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 9.4 t60 -84.15 -39.61 19.21 Favored 'General case' 0 N--CA 1.401 -2.913 0 C-N-CA 119.398 -0.921 . . . . 0.0 108.873 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.523 HG13 HD21 ' A' ' 12' ' ' LEU . 60.4 t -63.51 -51.29 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.295 178.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 27' ' ' GLU . 7.6 mm-40 -67.87 -16.0 63.88 Favored 'General case' 0 CA--C 1.553 1.068 0 O-C-N 123.438 0.461 . . . . 0.0 111.063 -177.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 66.6 m -85.76 -24.05 27.04 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.439 -0.788 . . . . 0.0 111.724 177.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.483 ' CE1' ' HB3' ' A' ' 13' ' ' CYS . 44.5 m-70 -67.86 -27.57 66.8 Favored 'General case' 0 CA--C 1.496 -1.114 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.825 171.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.443 ' HB3' ' HB3' ' A' ' 43' ' ' GLN . 20.3 m0 -71.6 128.85 37.15 Favored 'General case' 1 N--CA 1.353 -5.301 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.913 175.392 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -76.82 105.03 7.64 Favored 'General case' 0 C--N 1.287 -2.124 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.766 -176.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.51 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.2 p -93.92 123.67 46.11 Favored 'Isoleucine or valine' 0 C--N 1.259 -3.332 0 CA-C-N 113.522 -1.672 . . . . 0.0 111.753 -175.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 22.6 t -77.24 132.73 69.47 Favored Pre-proline 0 N--CA 1.395 -3.196 0 CA-C-N 115.23 -0.895 . . . . 0.0 109.556 -177.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -61.59 -37.09 72.26 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.911 2.407 . . . . 0.0 112.982 -175.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 39.7 ttp -102.42 -11.07 18.88 Favored 'General case' 0 N--CA 1.421 -1.891 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 62.1 m -106.0 -28.2 10.7 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.17 -1.012 . . . . 0.0 111.916 -179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.2 m 63.26 25.08 14.59 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-O 122.348 1.071 . . . . 0.0 110.719 -176.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -105.9 132.68 51.72 Favored 'General case' 1 N--CA 1.37 -4.462 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 176.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.51 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 72.9 mt-30 -103.85 126.63 51.12 Favored 'General case' 1 C--N 1.222 -4.965 0 CA-C-N 111.917 -2.401 . . . . 0.0 109.289 -174.18 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.402 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 48.2 m-85 -102.19 159.71 28.55 Favored Pre-proline 0 C--N 1.284 -2.241 0 C-N-CA 124.679 1.191 . . . . 0.0 108.951 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.78 163.68 24.01 Favored 'Trans proline' 0 CA--C 1.548 1.205 0 C-N-CA 121.888 1.726 . . . . 0.0 111.865 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.51 ' HG3' HD12 ' A' ' 12' ' ' LEU . 51.7 Cg_endo -66.83 -12.68 36.96 Favored 'Trans proline' 0 N--CA 1.482 0.818 0 C-N-CA 122.934 2.423 . . . . 0.0 111.032 178.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -71.52 -15.97 62.32 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.981 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.596 ' CE2' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -78.43 114.0 16.94 Favored 'General case' 0 N--CA 1.407 -2.608 0 CA-C-O 122.048 0.927 . . . . 0.0 109.462 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HB3' HG23 ' A' ' 52' ' ' VAL . 9.0 t70 -65.69 150.65 48.13 Favored 'General case' 0 C--N 1.28 -2.436 0 CA-C-N 112.959 -1.928 . . . . 0.0 107.754 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.62 ' O ' ' HG2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -65.08 -36.25 83.73 Favored 'General case' 0 C--N 1.278 -2.534 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.82 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -67.77 -41.94 82.49 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 123.91 0.884 . . . . 0.0 109.715 179.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.596 HG12 ' CE2' ' A' ' 48' ' ' TYR . 84.8 t -69.02 -35.88 71.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.08 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -64.96 -40.71 95.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.385 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.62 ' HG2' ' O ' ' A' ' 50' ' ' GLN . 21.3 mm-40 -59.32 -42.43 91.4 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.433 177.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.52 ' O ' HG23 ' A' ' 59' ' ' THR . 8.6 mpt_? -59.52 -42.64 92.73 Favored 'General case' 0 CA--C 1.5 -0.976 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.195 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . 0.456 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 46.4 t60 -60.54 -55.05 38.11 Favored 'General case' 0 N--CA 1.445 -0.682 0 O-C-N 123.775 0.672 . . . . 0.0 110.429 175.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.592 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 98.2 t -63.03 -42.82 98.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.341 1.067 . . . . 0.0 110.246 -171.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -72.68 -16.16 61.69 Favored 'General case' 0 C--N 1.273 -2.754 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -176.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.52 HG23 ' O ' ' A' ' 55' ' ' ARG . 39.0 p -75.62 -45.73 35.69 Favored 'General case' 0 CA--C 1.493 -1.227 0 CA-C-N 118.752 0.706 . . . . 0.0 110.282 177.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.592 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.272 1.2 p80 -75.07 -18.45 60.29 Favored 'General case' 0 N--CA 1.433 -1.288 0 C-N-CA 119.795 -0.762 . . . . 0.0 112.623 -179.066 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.507 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 26.7 m-85 -82.57 -28.06 31.18 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.647 172.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -81.09 -41.42 22.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 CA-C-O 122.296 1.046 . . . . 0.0 109.761 -178.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 69.8 -7.01 0.96 Allowed 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 126.343 1.857 . . . . 0.0 112.517 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.1 t30 72.65 6.42 5.41 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.093 1.357 . . . . 0.0 109.614 -176.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.9 t -119.17 20.2 6.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.935 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 81.1 mt 73.74 152.89 0.13 Allowed 'General case' 0 C--O 1.24 0.595 0 C-N-CA 125.384 1.474 . . . . 0.0 110.828 -175.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -59.49 -36.81 76.74 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.343 -178.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.0 t80 56.03 84.7 0.08 Allowed 'General case' 0 C--O 1.243 0.761 0 C-N-CA 124.283 1.033 . . . . 0.0 111.767 176.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.488 -1.408 0 CA-C-N 114.7 -1.137 . . . . 0.0 111.684 -178.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.381 0 N-CA-C 111.122 -0.791 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.82 45.37 1.3 Allowed 'Trans proline' 0 CA--C 1.551 1.334 0 C-N-CA 123.795 2.997 . . . . 0.0 112.716 -179.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 69.1 t60 -68.69 -36.14 78.1 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 123.813 0.845 . . . . 0.0 109.81 -178.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.3 tpt -131.89 102.51 5.88 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 175.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.625 ' HA ' ' SD ' ' A' ' 16' ' ' MET . 11.8 t70 -129.36 150.54 50.68 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 105.755 -1.942 . . . . 0.0 105.755 -177.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 14.7 t -125.62 25.1 3.06 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 123.344 1.545 . . . . 0.0 109.647 -174.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.335 44.5 m80 69.04 5.3 4.99 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 172.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 10.6 mmmm -82.65 79.27 9.11 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 172.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 66.6 mttm -118.68 145.01 45.83 Favored 'General case' 0 CA--C 1.483 -1.63 0 CA-C-N 114.871 -1.059 . . . . 0.0 110.024 -175.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 43.7 t -63.99 119.71 57.53 Favored Pre-proline 0 C--N 1.298 -1.645 0 N-CA-C 106.176 -1.787 . . . . 0.0 106.176 168.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -64.12 -18.73 64.59 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 121.78 1.653 . . . . 0.0 111.564 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.549 HD21 HG13 ' A' ' 30' ' ' VAL . 0.2 OUTLIER -93.49 -40.45 10.32 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.429 -177.807 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.636 ' SG ' ' HE1' ' A' ' 33' ' ' HIS . 77.8 m -85.75 -88.03 0.12 Allowed 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 152.67 -16.82 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 128.321 2.648 . . . . 0.0 106.186 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 9' ' ' LYS . 7.8 tt -40.19 133.47 1.76 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.068 1.747 . . . . 0.0 111.194 175.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 5' ' ' ASP . 23.8 ttt -96.57 130.84 43.67 Favored 'General case' 0 N--CA 1.413 -2.28 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.348 -176.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -106.57 151.58 40.44 Favored Pre-proline 0 C--N 1.283 -2.288 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 173.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.98 147.93 31.6 Favored 'Trans proline' 0 CA--C 1.555 1.53 0 C-N-CA 122.486 2.124 . . . . 0.0 112.253 176.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -41.86 -53.79 3.22 Favored 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 124.103 3.202 . . . . 0.0 114.283 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -94.83 17.83 12.94 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 111.741 -174.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.39 139.99 58.55 Favored 'General case' 0 N--CA 1.418 -2.029 0 CA-C-O 121.951 0.882 . . . . 0.0 111.124 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.604 ' HB3' ' HB2' ' A' ' 25' ' ' LYS . 23.6 t70 -53.57 129.44 32.66 Favored 'General case' 0 C--N 1.281 -2.404 0 CA-C-N 111.602 -2.544 . . . . 0.0 111.583 -174.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 23.1 mm-40 -63.85 -41.52 97.79 Favored 'General case' 0 C--N 1.275 -2.666 0 CA-C-N 113.83 -1.532 . . . . 0.0 111.624 178.118 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.512 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 14.4 m -68.51 -44.9 73.67 Favored 'General case' 0 C--N 1.311 -1.104 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB3' ' A' ' 22' ' ' ASP . 67.3 mttm -63.09 -31.49 72.64 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.994 0.518 . . . . 0.0 111.924 175.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.45 ' O ' HG23 ' A' ' 30' ' ' VAL . 71.0 t80 -68.87 -49.42 58.46 Favored 'General case' 0 C--N 1.311 -1.08 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 176.191 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.11 -30.04 70.95 Favored 'General case' 0 C--O 1.209 -1.06 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.69 179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 24' ' ' SER . 26.6 mm-40 -62.56 -29.08 70.31 Favored 'General case' 0 CA--C 1.481 -1.693 0 CA-C-O 121.022 0.439 . . . . 0.0 110.302 172.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . 0.523 ' O ' ' HD2' ' A' ' 33' ' ' HIS . 12.7 t60 -85.35 -43.1 13.97 Favored 'General case' 0 N--CA 1.408 -2.543 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.544 177.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.549 HG13 HD21 ' A' ' 12' ' ' LEU . 93.3 t -59.9 -51.94 66.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.167 0.587 . . . . 0.0 110.99 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -67.45 -19.93 65.42 Favored 'General case' 0 C--N 1.314 -0.939 0 O-C-N 123.185 0.303 . . . . 0.0 111.657 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 70.2 m -77.55 -21.38 52.63 Favored 'General case' 0 N--CA 1.441 -0.922 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.484 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.636 ' HE1' ' SG ' ' A' ' 13' ' ' CYS . 41.3 m-70 -74.5 -31.25 62.12 Favored 'General case' 0 CA--C 1.494 -1.18 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.597 170.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.438 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 30.2 m0 -69.02 122.05 17.9 Favored 'General case' 1 N--CA 1.369 -4.489 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 176.403 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -73.86 117.63 15.88 Favored 'General case' 0 N--CA 1.417 -2.115 0 C-N-CA 124.864 1.266 . . . . 0.0 109.556 -175.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.515 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.6 p -94.16 130.97 42.32 Favored 'Isoleucine or valine' 0 C--N 1.247 -3.886 0 CA-C-N 113.433 -1.712 . . . . 0.0 110.557 -176.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 9.2 t -77.48 131.07 72.35 Favored Pre-proline 0 N--CA 1.395 -3.178 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 178.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.17 -38.31 95.71 Favored 'Trans proline' 0 C--O 1.221 -0.332 0 C-N-CA 123.499 2.799 . . . . 0.0 113.635 -174.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.5 ttm -93.21 -33.05 14.14 Favored 'General case' 0 N--CA 1.426 -1.669 0 CA-C-O 121.058 0.456 . . . . 0.0 111.156 -178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 37' ' ' CYS . 73.0 m -88.61 -28.14 20.87 Favored 'General case' 0 C--N 1.317 -0.843 0 C-N-CA 118.902 -1.119 . . . . 0.0 112.023 -170.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.9 m 66.47 22.53 10.65 Favored 'General case' 0 C--N 1.317 -0.828 0 C-N-CA 124.327 1.051 . . . . 0.0 110.298 -177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 37.0 mt-10 -100.43 130.35 46.51 Favored 'General case' 1 N--CA 1.371 -4.403 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.515 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 49.5 mt-30 -100.72 126.79 47.28 Favored 'General case' 1 C--N 1.226 -4.79 0 CA-C-N 111.752 -2.476 . . . . 0.0 109.287 -173.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 96.0 m-85 -113.19 150.09 42.45 Favored Pre-proline 0 C--N 1.294 -1.818 0 C-N-CA 124.606 1.162 . . . . 0.0 109.308 -177.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -60.63 160.8 23.1 Favored 'Trans proline' 0 CA--C 1.563 1.959 0 C-N-CA 121.986 1.791 . . . . 0.0 112.503 -177.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.512 ' HG3' HD12 ' A' ' 12' ' ' LEU . 49.3 Cg_endo -64.9 -16.95 57.96 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 C-N-CA 123.345 2.697 . . . . 0.0 112.749 -177.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -89.34 -1.81 58.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.188 179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 52' ' ' VAL . 2.1 t80 -73.51 119.98 18.48 Favored 'General case' 0 N--CA 1.405 -2.7 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 175.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.674 ' HB3' HG22 ' A' ' 52' ' ' VAL . 3.8 t70 -56.61 133.3 53.58 Favored 'General case' 0 C--N 1.268 -2.97 0 CA-C-N 113.461 -1.699 . . . . 0.0 109.301 -173.224 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mm100 -53.72 -39.54 65.33 Favored 'General case' 0 C--N 1.28 -2.432 0 O-C-N 123.885 0.741 . . . . 0.0 111.367 176.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 74.8 mm-40 -73.64 -35.43 65.29 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 179.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.674 HG22 ' HB3' ' A' ' 49' ' ' ASP . 30.4 m -72.67 -31.4 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 119.67 -0.812 . . . . 0.0 108.851 179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.439 ' O ' HG23 ' A' ' 57' ' ' VAL . 84.3 t80 -71.05 -49.57 43.3 Favored 'General case' 0 N--CA 1.427 -1.577 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.56 177.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -61.15 -46.21 91.47 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.184 178.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.528 ' O ' HG23 ' A' ' 59' ' ' THR . 0.0 OUTLIER -59.6 -38.11 80.37 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.694 178.341 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -57.01 -54.33 48.0 Favored 'General case' 0 C--O 1.218 -0.57 0 O-C-N 123.641 0.588 . . . . 0.0 110.138 172.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.704 ' HA ' ' NE2' ' A' ' 60' ' ' HIS . 97.0 t -62.66 -37.95 80.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 122.392 1.091 . . . . 0.0 110.481 -172.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -72.01 -17.06 62.07 Favored 'General case' 0 C--N 1.274 -2.689 0 CA-C-N 114.772 -1.104 . . . . 0.0 113.782 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 55' ' ' ARG . 76.7 p -73.55 -41.82 62.46 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 118.694 0.679 . . . . 0.0 109.594 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.704 ' NE2' ' HA ' ' A' ' 57' ' ' VAL 0.265 0.7 OUTLIER -79.87 -16.89 54.48 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.454 179.112 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.474 ' HD1' ' O ' ' A' ' 57' ' ' VAL . 23.3 m-85 -83.35 -23.58 32.42 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 121.311 0.577 . . . . 0.0 109.657 170.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -80.9 -36.53 31.07 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.13 178.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.426 ' HB3' ' CD2' ' A' ' 66' ' ' LEU . 11.0 mm100 75.03 0.08 3.45 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-N 113.42 -1.718 . . . . 0.0 113.131 -179.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.9 m120 71.36 21.46 4.61 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 124.227 1.011 . . . . 0.0 113.533 174.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 41.7 t 64.24 83.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.174 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.31 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.426 ' CD2' ' HB3' ' A' ' 63' ' ' GLN . 3.4 mm? -72.22 118.06 14.62 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.311 -0.858 . . . . 0.0 108.944 172.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -111.61 99.38 8.13 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-O 120.847 0.356 . . . . 0.0 110.823 178.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -69.41 -47.32 64.52 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.039 -1.837 . . . . 0.0 106.039 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.1 t70 . . . . . 0 C--O 1.243 0.735 0 C-N-CA 126.319 1.848 . . . . 0.0 114.744 173.49 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.289 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -83.21 28.82 0.56 Allowed 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.307 2.671 . . . . 0.0 112.211 -178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -144.88 93.38 2.39 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.726 0.774 . . . . 0.0 111.285 -177.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 71.7 mtp -132.64 96.26 3.78 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 115.117 -0.947 . . . . 0.0 108.902 177.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -138.28 165.62 26.27 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 -176.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 5.6 t -119.45 25.97 4.05 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.902 0 CA-C-O 123.8 1.762 . . . . 0.0 107.052 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.283 75.3 m-70 75.69 4.55 3.95 Favored 'General case' 0 C--N 1.285 -2.224 0 CA-C-N 111.847 -2.433 . . . . 0.0 115.849 174.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 17' ' ' PHE . 0.7 OUTLIER -95.14 78.28 3.51 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 118.969 -1.092 . . . . 0.0 109.703 177.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.406 ' O ' ' HE1' ' A' ' 26' ' ' PHE . 44.3 mtpt -134.25 131.73 38.83 Favored 'General case' 0 CA--C 1.486 -1.509 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 47.7 t -66.33 112.64 9.75 Favored Pre-proline 0 C--N 1.293 -1.864 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -69.74 -8.61 24.05 Favored 'Trans proline' 0 N--CA 1.477 0.514 0 C-N-CA 121.889 1.726 . . . . 0.0 113.236 -170.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.499 ' HB2' ' CD2' ' A' ' 33' ' ' HIS . 5.3 mp -89.38 -33.22 16.95 Favored 'General case' 0 C--N 1.297 -1.694 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.355 -177.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 26.5 p -117.94 -23.19 7.56 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.318 0.58 . . . . 0.0 111.806 177.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.351 18.8 mt-10 67.73 34.16 4.55 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.468 1.907 . . . . 0.0 113.923 -173.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 40.7 tp -67.36 133.97 50.62 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 169.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . . . . . . . . . 88.7 mtp -95.7 133.62 39.57 Favored 'General case' 0 C--N 1.289 -2.049 0 O-C-N 123.764 0.665 . . . . 0.0 110.943 -171.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.507 ' HB2' ' HB3' ' A' ' 8' ' ' LYS . 46.8 m-85 -122.54 151.71 60.36 Favored Pre-proline 0 N--CA 1.425 -1.678 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -67.28 160.92 45.37 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 122.515 2.143 . . . . 0.0 111.424 177.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.97 -31.85 91.07 Favored 'Trans proline' 0 CA--C 1.51 -0.72 0 C-N-CA 123.056 2.504 . . . . 0.0 114.314 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -81.21 -5.2 57.48 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 119.81 -0.756 . . . . 0.0 111.94 -174.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -62.51 138.56 58.5 Favored 'General case' 0 N--CA 1.414 -2.252 0 CA-C-O 121.935 0.874 . . . . 0.0 109.883 179.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -86.11 144.7 27.38 Favored 'General case' 0 C--N 1.258 -3.383 0 CA-C-N 113.568 -1.651 . . . . 0.0 109.941 -172.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 26' ' ' PHE . 46.3 tt0 -63.77 -35.07 79.4 Favored 'General case' 0 C--N 1.263 -3.187 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.528 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.6 m -66.38 -33.75 76.43 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 28' ' ' GLU . 3.0 tmtm? -80.32 -22.69 41.26 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.424 1.107 . . . . 0.0 108.493 -178.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 30' ' ' VAL . 63.9 t80 -73.94 -52.62 12.27 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 124.547 1.139 . . . . 0.0 109.737 176.183 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -64.95 -31.78 73.18 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.189 -178.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.438 ' HA ' ' HG2' ' A' ' 31' ' ' GLU . 12.2 pt-20 -68.32 -23.23 64.69 Favored 'General case' 0 CA--C 1.493 -1.219 0 CA-C-O 120.745 0.307 . . . . 0.0 110.455 175.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -84.58 -40.97 16.9 Favored 'General case' 0 N--CA 1.412 -2.328 0 C-N-CA 119.046 -1.062 . . . . 0.0 109.036 175.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 26' ' ' PHE . 47.9 t -60.53 -45.16 97.52 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.063 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 28' ' ' GLU . 10.8 pt-20 -69.98 -16.56 63.21 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.912 179.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 t -80.96 -27.84 35.86 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 -178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.499 ' CD2' ' HB2' ' A' ' 12' ' ' LEU . 27.2 m-70 -71.58 -32.88 68.54 Favored 'General case' 0 CA--C 1.48 -1.74 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.838 174.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 44' ' ' PHE . 21.0 m0 -64.69 117.32 7.28 Favored 'General case' 1 N--CA 1.358 -5.052 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 173.256 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.646 ' HB3' ' CD1' ' A' ' 53' ' ' PHE . 46.7 mmtm -67.85 98.02 0.7 Allowed 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 114.867 -1.06 . . . . 0.0 111.494 -169.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.563 ' HB ' ' HG2' ' A' ' 43' ' ' GLN . 7.1 p -95.91 114.16 31.97 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.409 0 CA-C-N 113.262 -1.79 . . . . 0.0 112.108 -175.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.668 ' HB3' ' HB2' ' A' ' 40' ' ' CYS . 45.5 t -82.03 123.79 79.49 Favored Pre-proline 0 N--CA 1.418 -2.038 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.81 -27.13 80.16 Favored 'Trans proline' 0 N--CA 1.482 0.849 0 C-N-CA 123.0 2.467 . . . . 0.0 112.284 -174.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.8 mtm -95.61 -25.57 16.1 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.785 -178.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.774 ' SG ' ' HE1' ' A' ' 60' ' ' HIS . 38.9 m -95.01 -24.89 16.72 Favored 'General case' 0 N--CA 1.442 -0.865 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.037 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.8 m 64.85 21.05 12.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.839 1.256 . . . . 0.0 110.446 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.37 129.33 55.78 Favored 'General case' 1 N--CA 1.365 -4.714 0 CA-C-O 121.833 0.825 . . . . 0.0 109.23 -178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.563 ' HG2' ' HB ' ' A' ' 36' ' ' VAL . 84.6 mt-30 -101.02 127.19 47.64 Favored 'General case' 0 C--N 1.244 -3.985 0 CA-C-N 111.214 -2.721 . . . . 0.0 109.0 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.457 ' O ' ' HA ' ' A' ' 34' ' ' TRP . 78.6 m-85 -101.22 151.18 37.65 Favored Pre-proline 0 C--N 1.288 -2.079 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.468 ' O ' ' HB2' ' A' ' 48' ' ' TYR . 31.1 Cg_endo -60.19 159.17 27.37 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 122.843 2.362 . . . . 0.0 113.044 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -45.0 -37.05 12.02 Favored 'Trans proline' 0 C--N 1.36 1.147 0 C-N-CA 124.24 3.294 . . . . 0.0 114.472 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -76.16 -1.88 28.4 Favored 'General case' 0 C--O 1.244 0.807 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -177.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' PRO . 0.2 OUTLIER -76.79 114.21 15.3 Favored 'General case' 0 N--CA 1.406 -2.639 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 172.594 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.649 ' OD1' ' HG2' ' A' ' 51' ' ' GLN . 7.3 t0 -64.05 149.13 48.15 Favored 'General case' 0 C--N 1.269 -2.924 0 CA-C-N 113.064 -1.88 . . . . 0.0 110.092 -174.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.635 ' O ' ' HG3' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -62.82 -41.68 99.41 Favored 'General case' 0 C--N 1.277 -2.557 0 CA-C-N 114.64 -1.164 . . . . 0.0 110.269 176.49 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.753 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 26.6 pt20 -68.17 -40.31 82.32 Favored 'General case' 0 C--O 1.216 -0.704 0 O-C-N 123.448 0.467 . . . . 0.0 109.942 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 50.8 t -61.65 -43.38 97.0 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.809 0.814 . . . . 0.0 108.917 177.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.646 ' CD1' ' HB3' ' A' ' 35' ' ' LYS . 53.6 t80 -65.89 -43.86 87.0 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.948 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLN . 59.6 mt-10 -58.87 -41.13 86.35 Favored 'General case' 0 C--O 1.206 -1.195 0 CA-C-O 120.808 0.337 . . . . 0.0 110.186 179.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.753 ' HD3' ' O ' ' A' ' 51' ' ' GLN . 9.6 mpt_? -65.19 -23.58 67.13 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 116.369 -0.378 . . . . 0.0 112.005 -177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' HIS . . . . . . . . . . . . . 64.7 t60 -83.27 -49.4 9.44 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 97.5 t -70.56 -36.8 67.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.665 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.86 -16.59 63.37 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.3 p -76.79 -39.33 51.87 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.774 ' HE1' ' SG ' ' A' ' 40' ' ' CYS . 40.7 m-70 -63.71 -32.68 74.25 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 114.684 -1.143 . . . . 0.0 109.689 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -90.33 -15.53 30.97 Favored 'General case' 0 CA--C 1.496 -1.129 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.113 178.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -84.08 -73.32 0.43 Allowed 'General case' 0 CA--C 1.477 -1.835 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 49.79 16.39 0.21 Allowed 'General case' 0 C--N 1.297 -1.689 0 C-N-CA 126.413 1.885 . . . . 0.0 112.815 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.3 t30 -107.36 -33.35 7.41 Favored 'General case' 0 C--N 1.308 -1.213 0 C-N-CA 124.258 1.023 . . . . 0.0 110.379 -171.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.4 m -81.29 22.59 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.491 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 6.0 mp 56.75 77.55 0.25 Allowed 'General case' 0 CA--C 1.513 -0.479 0 C-N-CA 123.46 0.704 . . . . 0.0 109.13 -174.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -87.74 106.31 17.97 Favored 'General case' 0 C--N 1.298 -1.672 0 C-N-CA 120.293 -0.563 . . . . 0.0 109.835 -175.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 -87.69 93.71 9.52 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.317 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--N 1.298 -1.646 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.265 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_