data_2bc8_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 2bc8 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.303 0 N-CA-C 112.214 -0.355 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.619 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . 0.516 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.4 m -89.58 28.32 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.577 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 25.5 t70 -152.38 140.45 13.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -53.52 -29.52 50.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.726 2.284 . . . . 0.0 113.225 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.631 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 11.9 mtm180 -102.41 16.21 26.93 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.534 0.683 . . . . 0.0 111.792 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.619 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.516 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.19 -45.4 91.94 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.631 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -88.05 35.9 0.76 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.933 176.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 ttm180 -140.84 -10.48 1.02 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.179 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.237 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.958 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -110.84 31.47 5.98 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.653 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 21.8 t70 -152.15 141.66 14.43 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.427 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 62.5 Cg_exo -52.75 -34.69 65.88 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 122.786 2.324 . . . . 0.0 113.283 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.66 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 17.5 mtm180 -92.52 15.39 14.28 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 122.084 0.945 . . . . 0.0 110.998 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.958 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.481 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -62.3 -37.47 85.65 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.66 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.38 37.32 1.19 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.614 176.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -137.83 -32.58 0.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.753 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.481 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.374 0 N-CA-C 112.139 -0.384 . . . . 0.0 112.139 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.569 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.554 ' H ' ' C ' ' A' ' 2' ' ' SEC . 15.5 m -101.66 32.81 3.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.018 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.592 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 14.6 t70 -151.24 140.98 14.17 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 179.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.42 -39.51 87.31 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.483 2.788 . . . . 0.0 115.076 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.526 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 5.2 ptp180 -85.37 -13.47 49.35 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.566 1.174 . . . . 0.0 110.486 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.592 ' HB3' ' HB3' ' A' ' 5' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.567 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -61.14 -33.48 73.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.526 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.3 p-90 -95.01 27.25 3.25 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.422 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' NE ' ' HA ' ' A' ' 11' ' ' ARG . 5.1 mmp_? -127.51 -38.26 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.727 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.567 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.279 0 N-CA-C 112.043 -0.423 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.677 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 m -89.23 22.48 2.83 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.842 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.451 ' OD2' ' HB3' ' A' ' 8' ' ' SEC . 2.3 t70 -152.09 130.3 6.15 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.5 ' O ' ' HB1' ' A' ' 9' ' ' ALA . 32.4 Cg_exo -57.77 -36.55 98.3 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.742 2.295 . . . . 0.0 112.587 -179.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.489 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 11.5 ttp180 -69.22 -33.89 73.99 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.677 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.589 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.26 -20.08 66.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.724 179.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.583 ' CZ3' ' HA ' ' A' ' 8' ' ' SEC . 0.0 OUTLIER -81.25 -14.49 57.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.51 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 11.7 tpt180 -78.25 -41.16 34.96 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.737 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.589 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.862 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -110.5 35.28 3.52 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.616 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 9.0 t70 -152.24 138.94 12.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 78.3 Cg_exo -52.05 -36.11 64.12 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.435 2.757 . . . . 0.0 114.274 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.774 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.01 26.18 6.04 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 122.162 0.982 . . . . 0.0 110.302 179.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.862 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.98 -36.99 85.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.568 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.8 38.21 1.18 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.478 176.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 51.9 ttm-85 -137.15 -31.23 0.83 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.876 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.909 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -110.62 33.11 4.72 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.669 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 6.6 t70 -152.3 141.16 14.0 Favored Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 178.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -50.59 -38.76 55.62 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.543 2.828 . . . . 0.0 115.449 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.54 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.8 ptp180 -90.29 -9.48 47.72 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.535 1.16 . . . . 0.0 110.773 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.909 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.483 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.21 -34.03 76.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.54 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.0 p-90 -95.01 29.7 2.34 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.995 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.639 ' CZ ' ' HA ' ' A' ' 11' ' ' ARG . 1.6 tpm_? -131.04 -31.71 1.67 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.545 -1.207 . . . . 0.0 109.542 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.483 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.008 -0.437 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.908 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 m -104.88 27.78 7.77 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.621 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 7.5 t70 -152.3 141.52 14.27 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.18 -35.34 73.05 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.02 2.48 . . . . 0.0 113.157 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.664 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 30.3 mtm180 -88.16 9.76 21.69 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.022 0.915 . . . . 0.0 111.225 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.908 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.465 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -65.55 -36.96 85.31 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.664 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 2.0 p-90 -95.92 37.54 1.22 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.131 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.48 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 21.8 tpp180 -137.21 -32.94 0.77 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.894 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.465 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.281 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.915 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 m -105.79 28.61 7.37 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.639 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 24.5 t70 -152.38 142.28 14.85 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 121.972 -0.455 . . . . 0.0 109.945 178.399 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -53.01 -34.25 66.54 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.783 2.322 . . . . 0.0 113.272 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.669 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 20.2 mtm180 -91.0 13.7 15.99 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 121.997 0.903 . . . . 0.0 111.165 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.915 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.463 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.5 -37.2 86.72 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.669 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.35 33.38 1.59 Allowed 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.499 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.435 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 43.4 tpt85 -133.87 -30.7 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.553 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.463 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.659 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . 0.415 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.9 m -91.9 31.44 1.24 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.567 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 9.6 t70 -152.49 140.16 13.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.491 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 76.1 Cg_exo -51.12 -32.23 38.87 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 123.094 2.53 . . . . 0.0 114.31 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.593 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 5.8 mtm-85 -106.39 24.93 11.75 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 122.15 0.976 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.72 'SE ' HH21 ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.415 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -60.65 -45.94 92.19 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.593 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -90.67 34.44 0.9 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.052 176.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.72 HH21 'SE ' ' A' ' 8' ' ' SEC . 46.9 ttp85 -149.41 7.13 0.67 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.043 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.929 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.5 m -106.99 30.37 6.23 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.669 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 25.3 t70 -152.34 141.96 14.61 Favored Pre-proline 0 N--CA 1.471 0.601 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 178.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.46 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.4 Cg_endo -53.98 -32.36 67.92 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 122.976 2.451 . . . . 0.0 113.143 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.644 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.6 mtm180 -94.58 20.11 8.93 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 122.268 1.032 . . . . 0.0 110.676 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.929 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.428 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.62 -38.32 90.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.644 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -95.77 38.32 1.17 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.02 175.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.569 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.1 ttt180 -139.22 -30.68 0.72 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.201 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.428 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.918 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.2 m -107.95 30.77 6.05 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.626 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 5.6 t70 -152.35 141.04 13.89 Favored Pre-proline 0 N--CA 1.469 0.519 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 178.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -53.32 -33.45 65.98 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.143 2.562 . . . . 0.0 113.817 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.644 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.7 OUTLIER -94.17 19.72 8.95 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.267 1.032 . . . . 0.0 110.195 179.332 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.918 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.414 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.66 -38.2 90.2 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.644 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.3 p-90 -95.8 37.86 1.2 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.128 175.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.5 ttt180 -138.28 -30.62 0.78 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.185 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.414 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.287 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.661 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.0 m -88.98 18.27 5.03 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.664 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.527 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 10.0 t70 -151.6 135.15 9.33 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.478 ' O ' ' HB2' ' A' ' 9' ' ' ALA . 32.5 Cg_exo -57.61 -31.88 92.95 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.801 2.334 . . . . 0.0 113.173 -179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' O ' ' CE3' ' A' ' 10' ' ' TRP . 56.6 mtm180 -76.45 -30.74 57.48 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 120.838 0.351 . . . . 0.0 110.119 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.661 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.695 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.86 -23.28 66.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.391 179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.52 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -79.69 -17.84 52.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.52 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 45.8 ttt85 -76.75 -40.78 47.3 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.129 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.695 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 112.122 -0.391 . . . . 0.0 112.122 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.88 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -107.56 32.95 4.31 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 9.0 t70 -152.52 141.27 14.02 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.97 -37.63 67.77 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 123.735 2.957 . . . . 0.0 115.225 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.475 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.9 ptp180 -91.56 -4.32 55.52 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.656 1.217 . . . . 0.0 110.938 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.88 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.458 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.96 -34.4 77.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.697 ' HZ3' HH21 ' A' ' 11' ' ' ARG . 8.9 p-90 -95.67 33.47 1.64 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.697 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 20.7 tpp180 -133.98 -32.63 1.08 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.386 -1.279 . . . . 0.0 109.205 179.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.458 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.872 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -100.2 26.36 6.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -177.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.63 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 25.9 t70 -152.36 142.19 14.78 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 122.011 -0.431 . . . . 0.0 109.953 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.429 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -54.12 -33.25 73.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.88 2.387 . . . . 0.0 113.075 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.657 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.9 mtm180 -90.84 13.67 15.77 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.0 0.905 . . . . 0.0 111.155 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.872 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.491 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.07 -36.67 83.82 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.657 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.48 32.36 1.8 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.336 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.7 tpt85 -132.45 -30.63 1.46 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.504 -1.226 . . . . 0.0 109.376 179.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.491 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.307 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.818 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 m -109.07 35.72 3.15 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.63 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 13.3 t70 -152.26 139.09 12.31 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.439 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 74.4 Cg_exo -52.56 -35.91 68.93 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.436 2.758 . . . . 0.0 114.424 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.782 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -98.43 22.75 9.32 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.912 0.863 . . . . 0.0 110.575 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.818 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.27 83.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.553 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -96.11 38.16 1.2 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.272 176.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -136.83 -31.27 0.85 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.97 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.23 -0.348 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.651 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . 0.439 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 m -89.87 27.46 1.56 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.533 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 5.1 t70 -152.19 140.79 13.73 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.81 -33.92 52.67 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.147 2.565 . . . . 0.0 114.281 -179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.62 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 8.1 mtm-85 -100.26 18.93 17.54 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.774 0.797 . . . . 0.0 111.272 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.651 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.439 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.9 -46.01 89.84 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.62 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -89.77 38.56 0.92 Allowed 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.154 0.978 . . . . 0.0 109.52 176.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.461 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 16.5 tpp85 -144.4 -9.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.575 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.031 -0.428 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.831 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -99.13 27.29 5.18 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.631 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 26.9 t70 -152.5 141.58 14.26 Favored Pre-proline 0 N--CA 1.469 0.503 0 O-C-N 122.112 -0.367 . . . . 0.0 110.095 178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.98 -32.9 70.35 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.766 2.311 . . . . 0.0 113.089 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.639 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 19.0 mtm180 -92.08 16.99 10.11 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 122.043 0.925 . . . . 0.0 110.869 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.831 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -37.93 86.3 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 177.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.639 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -96.52 36.9 1.31 Allowed 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.934 175.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.713 HH11 'SE ' ' A' ' 8' ' ' SEC . 60.8 ttt-85 -140.8 -23.88 0.77 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.069 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.189 -0.365 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.649 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . 0.436 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 m -89.69 29.4 1.16 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.562 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 19.7 t70 -152.39 140.71 13.61 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.436 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 9.8 Cg_endo -53.74 -28.73 48.71 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.999 2.466 . . . . 0.0 113.625 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.609 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.5 OUTLIER -103.7 20.42 18.04 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.791 0.805 . . . . 0.0 110.77 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.681 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.436 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.34 -44.39 95.01 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.609 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -92.53 36.91 1.0 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.297 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.681 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 48.2 ttt85 -144.29 -6.73 0.72 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.77 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.262 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.46 ' HB2' ' HD3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.1 p -89.57 24.59 2.24 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.081 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.485 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 6.7 t70 -151.74 137.83 11.42 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.68 -34.3 51.6 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.811 2.341 . . . . 0.0 114.135 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.55 ' HA ' ' NE ' ' A' ' 7' ' ' ARG . 2.0 tpm_? -79.52 -28.56 41.35 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.495 ' HA ' ' CZ3' ' A' ' 10' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.531 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.55 -20.71 66.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.295 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.552 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -82.56 -8.28 59.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.552 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 75.9 ttt180 -86.23 -37.61 18.45 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.799 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . 0.531 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SEC . . . . . 0.576 ' O ' ' HB2' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SEC . . . . . 0.446 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.6 m -89.79 30.33 1.06 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.823 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' A' ' 8' ' ' SEC . 12.4 t70 -152.0 138.68 12.05 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.473 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 58.1 Cg_exo -52.17 -35.63 63.62 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.916 2.411 . . . . 0.0 114.212 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.764 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -101.06 22.42 12.31 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 121.59 0.709 . . . . 0.0 111.171 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SEC . . . . . 0.576 ' HB2' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.446 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.04 -44.48 96.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.615 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.6 p-90 -89.55 32.86 0.85 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.916 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -138.09 -7.68 1.58 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.125 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.303 0 N-CA-C 112.214 -0.355 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SEC . . . . . 0.545 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.4 m -89.58 28.32 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.447 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.5 t70 -152.38 140.45 13.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -53.52 -29.52 50.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.726 2.284 . . . . 0.0 113.225 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.619 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 11.9 mtm180 -102.41 16.21 26.93 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.534 0.683 . . . . 0.0 111.792 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.404 ' H ' ' H ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.19 -45.4 91.94 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.619 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -88.05 35.9 0.76 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.933 176.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 ttm180 -140.84 -10.48 1.02 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.179 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.237 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SEC . . . . . 0.421 ' O ' ' CB ' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -110.84 31.47 5.98 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.446 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 21.8 t70 -152.15 141.66 14.43 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 62.5 Cg_exo -52.75 -34.69 65.88 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 122.786 2.324 . . . . 0.0 113.283 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.658 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 17.5 mtm180 -92.52 15.39 14.28 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 122.084 0.945 . . . . 0.0 110.998 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.421 ' CB ' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -62.3 -37.47 85.65 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.658 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.38 37.32 1.19 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.614 176.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -137.83 -32.58 0.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.753 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.478 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.374 0 N-CA-C 112.139 -0.384 . . . . 0.0 112.139 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SEC . . . . . 0.501 ' C ' ' H ' ' A' ' 4' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.501 ' H ' ' C ' ' A' ' 2' ' ' SEC . 15.5 m -101.66 32.81 3.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.018 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -151.24 140.98 14.17 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.42 -39.51 87.31 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.483 2.788 . . . . 0.0 115.076 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.521 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 5.2 ptp180 -85.37 -13.47 49.35 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.566 1.174 . . . . 0.0 110.486 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.449 ' CB ' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.562 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -61.14 -33.48 73.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.521 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.3 p-90 -95.01 27.25 3.25 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.422 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.562 ' HA ' ' NE ' ' A' ' 11' ' ' ARG . 5.1 mmp_? -127.51 -38.26 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.727 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.562 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.279 0 N-CA-C 112.043 -0.423 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 m -89.23 22.48 2.83 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.842 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -152.09 130.3 6.15 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.77 -36.55 98.3 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.742 2.295 . . . . 0.0 112.587 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 11.5 ttp180 -69.22 -33.89 73.99 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.597 ' HA ' ' CZ3' ' A' ' 10' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.6 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.26 -20.08 66.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.724 179.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.597 ' CZ3' ' HA ' ' A' ' 8' ' ' SEC . 0.0 OUTLIER -81.25 -14.49 57.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 11.7 tpt180 -78.25 -41.16 34.96 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.737 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.6 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -110.5 35.28 3.52 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 9.0 t70 -152.24 138.94 12.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 78.3 Cg_exo -52.05 -36.11 64.12 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.435 2.757 . . . . 0.0 114.274 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.783 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.01 26.18 6.04 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 122.162 0.982 . . . . 0.0 110.302 179.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.412 'SE ' ' HE ' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.98 -36.99 85.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.568 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.8 38.21 1.18 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.478 176.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HE ' 'SE ' ' A' ' 8' ' ' SEC . 51.9 ttm-85 -137.15 -31.23 0.83 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.876 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -110.62 33.11 4.72 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.406 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 6.6 t70 -152.3 141.16 14.0 Favored Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 178.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 74.8 Cg_exo -50.59 -38.76 55.62 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.543 2.828 . . . . 0.0 115.449 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.535 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.8 ptp180 -90.29 -9.48 47.72 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.535 1.16 . . . . 0.0 110.773 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.475 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.21 -34.03 76.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.535 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.0 p-90 -95.01 29.7 2.34 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.995 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.656 ' CZ ' ' HA ' ' A' ' 11' ' ' ARG . 1.6 tpm_? -131.04 -31.71 1.67 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.545 -1.207 . . . . 0.0 109.542 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.475 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.008 -0.437 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 m -104.88 27.78 7.77 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -152.3 141.52 14.27 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.18 -35.34 73.05 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.02 2.48 . . . . 0.0 113.157 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.661 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 30.3 mtm180 -88.16 9.76 21.69 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.022 0.915 . . . . 0.0 111.225 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.456 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -65.55 -36.96 85.31 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.661 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 2.0 p-90 -95.92 37.54 1.22 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.131 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.499 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 21.8 tpp180 -137.21 -32.94 0.77 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.894 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.456 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.281 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 m -105.79 28.61 7.37 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -152.38 142.28 14.85 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 121.972 -0.455 . . . . 0.0 109.945 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -53.01 -34.25 66.54 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.783 2.322 . . . . 0.0 113.272 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.666 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 20.2 mtm180 -91.0 13.7 15.99 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 121.997 0.903 . . . . 0.0 111.165 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.495 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.457 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.5 -37.2 86.72 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.666 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.35 33.38 1.59 Allowed 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.499 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 43.4 tpt85 -133.87 -30.7 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.553 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.457 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SEC . . . . . 0.436 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.9 m -91.9 31.44 1.24 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 9.6 t70 -152.49 140.16 13.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 76.1 Cg_exo -51.12 -32.23 38.87 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 123.094 2.53 . . . . 0.0 114.31 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.595 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 5.8 mtm-85 -106.39 24.93 11.75 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 122.15 0.976 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.731 'SE ' HH21 ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.436 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -60.65 -45.94 92.19 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -90.67 34.44 0.9 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.052 176.888 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.731 HH21 'SE ' ' A' ' 8' ' ' SEC . 46.9 ttp85 -149.41 7.13 0.67 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.043 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SEC . . . . . 0.4 ' O ' ' CB ' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.5 m -106.99 30.37 6.23 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.45 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.3 t70 -152.34 141.96 14.61 Favored Pre-proline 0 N--CA 1.471 0.601 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 178.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.4 Cg_endo -53.98 -32.36 67.92 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 122.976 2.451 . . . . 0.0 113.143 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.647 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.6 mtm180 -94.58 20.11 8.93 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 122.268 1.032 . . . . 0.0 110.676 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.589 'SE ' ' HD3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.421 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.62 -38.32 90.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -95.77 38.32 1.17 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.02 175.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.589 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.1 ttt180 -139.22 -30.68 0.72 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.201 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.421 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.2 m -107.95 30.77 6.05 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -152.35 141.04 13.89 Favored Pre-proline 0 N--CA 1.469 0.519 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -53.32 -33.45 65.98 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.143 2.562 . . . . 0.0 113.817 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.646 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.7 OUTLIER -94.17 19.72 8.95 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.267 1.032 . . . . 0.0 110.195 179.332 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.578 'SE ' ' HD3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.409 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.66 -38.2 90.2 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.646 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.3 p-90 -95.8 37.86 1.2 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.128 175.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.5 ttt180 -138.28 -30.62 0.78 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.185 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.409 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.287 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.0 m -88.98 18.27 5.03 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.664 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -151.6 135.15 9.33 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.61 -31.88 92.95 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.801 2.334 . . . . 0.0 113.173 -179.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' O ' ' CE3' ' A' ' 10' ' ' TRP . 56.6 mtm180 -76.45 -30.74 57.48 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 120.838 0.351 . . . . 0.0 110.119 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.708 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.86 -23.28 66.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.391 179.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -79.69 -17.84 52.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 45.8 ttt85 -76.75 -40.78 47.3 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.129 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.708 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 112.122 -0.391 . . . . 0.0 112.122 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -107.56 32.95 4.31 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.427 ' OD2' ' HG2' ' A' ' 7' ' ' ARG . 9.0 t70 -152.52 141.27 14.02 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.97 -37.63 67.77 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 123.735 2.957 . . . . 0.0 115.225 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.9 ptp180 -91.56 -4.32 55.52 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.656 1.217 . . . . 0.0 110.938 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.447 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.96 -34.4 77.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.713 ' HZ3' HH21 ' A' ' 11' ' ' ARG . 8.9 p-90 -95.67 33.47 1.64 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.713 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 20.7 tpp180 -133.98 -32.63 1.08 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.386 -1.279 . . . . 0.0 109.205 179.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.447 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -100.2 26.36 6.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -177.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.423 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.9 t70 -152.36 142.19 14.78 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 122.011 -0.431 . . . . 0.0 109.953 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -54.12 -33.25 73.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.88 2.387 . . . . 0.0 113.075 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.653 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.9 mtm180 -90.84 13.67 15.77 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.0 0.905 . . . . 0.0 111.155 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.463 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.07 -36.67 83.82 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.653 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.48 32.36 1.8 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.336 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 43.7 tpt85 -132.45 -30.63 1.46 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.504 -1.226 . . . . 0.0 109.376 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.482 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.307 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 m -109.07 35.72 3.15 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 13.3 t70 -152.26 139.09 12.31 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.456 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 74.4 Cg_exo -52.56 -35.91 68.93 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.436 2.758 . . . . 0.0 114.424 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.79 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -98.43 22.75 9.32 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.912 0.863 . . . . 0.0 110.575 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.27 83.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.549 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -96.11 38.16 1.2 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.272 176.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -136.83 -31.27 0.85 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.97 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.23 -0.348 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SEC . . . . . 0.464 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 m -89.87 27.46 1.56 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -152.19 140.79 13.73 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.81 -33.92 52.67 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.147 2.565 . . . . 0.0 114.281 -179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.622 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 8.1 mtm-85 -100.26 18.93 17.54 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.774 0.797 . . . . 0.0 111.272 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.509 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.464 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.9 -46.01 89.84 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.622 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -89.77 38.56 0.92 Allowed 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.154 0.978 . . . . 0.0 109.52 176.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 16.5 tpp85 -144.4 -9.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.575 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.031 -0.428 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -99.13 27.29 5.18 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -152.5 141.58 14.26 Favored Pre-proline 0 N--CA 1.469 0.503 0 O-C-N 122.112 -0.367 . . . . 0.0 110.095 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.98 -32.9 70.35 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.766 2.311 . . . . 0.0 113.089 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.638 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 19.0 mtm180 -92.08 16.99 10.11 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 122.043 0.925 . . . . 0.0 110.869 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.723 'SE ' HH11 ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -37.93 86.3 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 177.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.638 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -96.52 36.9 1.31 Allowed 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.934 175.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.723 HH11 'SE ' ' A' ' 8' ' ' SEC . 60.8 ttt-85 -140.8 -23.88 0.77 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.069 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.189 -0.365 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SEC . . . . . 0.455 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 m -89.69 29.4 1.16 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 19.7 t70 -152.39 140.71 13.61 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 9.8 Cg_endo -53.74 -28.73 48.71 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.999 2.466 . . . . 0.0 113.625 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.604 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.5 OUTLIER -103.7 20.42 18.04 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.791 0.805 . . . . 0.0 110.77 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.742 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.455 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.34 -44.39 95.01 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.604 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -92.53 36.91 1.0 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.297 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.742 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 48.2 ttt85 -144.29 -6.73 0.72 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.77 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.262 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.1 p -89.57 24.59 2.24 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.081 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -151.74 137.83 11.42 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.68 -34.3 51.6 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.811 2.341 . . . . 0.0 114.135 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.565 ' HA ' ' NE ' ' A' ' 7' ' ' ARG . 2.0 tpm_? -79.52 -28.56 41.35 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 10' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.55 -20.71 66.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.295 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.563 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -82.56 -8.28 59.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.563 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 75.9 ttt180 -86.23 -37.61 18.45 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.799 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SEC . . . . . 0.545 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SEC . . . . . 0.471 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.6 m -89.79 30.33 1.06 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.823 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.486 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 12.4 t70 -152.0 138.68 12.05 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 58.1 Cg_exo -52.17 -35.63 63.62 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.916 2.411 . . . . 0.0 114.212 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.772 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -101.06 22.42 12.31 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 121.59 0.709 . . . . 0.0 111.171 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SEC . . . . . 0.404 ' HA ' ' HB2' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.04 -44.48 96.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.606 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.6 p-90 -89.55 32.86 0.85 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.916 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 8' ' ' SEC . 0.2 OUTLIER -138.09 -7.68 1.58 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.125 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.303 0 N-CA-C 112.214 -0.355 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . 0.545 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.4 m -89.58 28.32 1.32 Allowed 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 113.305 0.854 . . . . 0.0 113.305 -178.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.447 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.5 t70 -152.38 140.45 13.39 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.447 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -53.52 -29.52 50.05 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.726 2.284 . . . . 0.0 113.225 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.619 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 11.9 mtm180 -102.41 16.21 26.93 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-O 121.534 0.683 . . . . 0.0 111.792 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.404 ' H ' ' H ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.19 -45.4 91.94 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.619 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -88.05 35.9 0.76 Allowed 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.933 176.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 ttm180 -140.84 -10.48 1.02 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.548 -1.206 . . . . 0.0 109.179 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.237 0 N-CA-C 112.034 -0.426 . . . . 0.0 112.034 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . 0.421 ' O ' ' CB ' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.8 m -110.84 31.47 5.98 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.446 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 21.8 t70 -152.15 141.66 14.43 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.446 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 62.5 Cg_exo -52.75 -34.69 65.88 Favored 'Trans proline' 0 CA--C 1.533 0.446 0 C-N-CA 122.786 2.324 . . . . 0.0 113.283 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.658 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 17.5 mtm180 -92.52 15.39 14.28 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-O 122.084 0.945 . . . . 0.0 110.998 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.421 ' CB ' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.478 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -62.3 -37.47 85.65 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.658 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.38 37.32 1.19 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.614 176.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -137.83 -32.58 0.74 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.475 -1.239 . . . . 0.0 108.753 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.478 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.226 -0.374 0 N-CA-C 112.139 -0.384 . . . . 0.0 112.139 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . 0.501 ' C ' ' H ' ' A' ' 4' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.501 ' H ' ' C ' ' A' ' 2' ' ' SEC . 15.5 m -101.66 32.81 3.21 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.169 -0.469 . . . . 0.0 112.018 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -151.24 140.98 14.17 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.42 -39.51 87.31 Favored 'Trans proline' 0 CA--C 1.535 0.561 0 C-N-CA 123.483 2.788 . . . . 0.0 115.076 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.521 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 5.2 ptp180 -85.37 -13.47 49.35 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.566 1.174 . . . . 0.0 110.486 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.449 ' CB ' ' O ' ' A' ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.562 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -61.14 -33.48 73.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.521 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.3 p-90 -95.01 27.25 3.25 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.422 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.562 ' HA ' ' NE ' ' A' ' 11' ' ' ARG . 5.1 mmp_? -127.51 -38.26 1.93 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.423 -1.262 . . . . 0.0 108.727 177.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.562 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.279 0 N-CA-C 112.043 -0.423 . . . . 0.0 112.043 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 m -89.23 22.48 2.83 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.842 -179.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -152.09 130.3 6.15 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.77 -36.55 98.3 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.742 2.295 . . . . 0.0 112.587 -179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.487 ' HB3' ' HE ' ' A' ' 7' ' ' ARG . 11.5 ttp180 -69.22 -33.89 73.99 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.597 ' HA ' ' CZ3' ' A' ' 10' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.6 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.26 -20.08 66.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.724 179.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.597 ' CZ3' ' HA ' ' A' ' 8' ' ' SEC . 0.0 OUTLIER -81.25 -14.49 57.39 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 11.7 tpt180 -78.25 -41.16 34.96 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.737 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.6 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.16 -0.376 . . . . 0.0 112.16 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.2 m -110.5 35.28 3.52 Favored 'General case' 0 C--N 1.313 -0.981 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.481 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 9.0 t70 -152.24 138.94 12.19 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 110.471 -0.196 . . . . 0.0 110.471 179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.481 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 78.3 Cg_exo -52.05 -36.11 64.12 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 123.435 2.757 . . . . 0.0 114.274 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.783 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -99.01 26.18 6.04 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-O 122.162 0.982 . . . . 0.0 110.302 179.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.412 'SE ' ' HE ' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.98 -36.99 85.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.568 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.8 38.21 1.18 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.113 -0.949 . . . . 0.0 109.478 176.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HE ' 'SE ' ' A' ' 8' ' ' SEC . 51.9 ttm-85 -137.15 -31.23 0.83 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.344 -1.298 . . . . 0.0 108.876 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.0 m -110.62 33.11 4.72 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 113.307 0.854 . . . . 0.0 113.307 -178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.406 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 6.6 t70 -152.3 141.16 14.0 Favored Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 178.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 74.8 Cg_exo -50.59 -38.76 55.62 Favored 'Trans proline' 0 CA--C 1.536 0.583 0 C-N-CA 123.543 2.828 . . . . 0.0 115.449 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.535 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.8 ptp180 -90.29 -9.48 47.72 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.535 1.16 . . . . 0.0 110.773 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.475 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.21 -34.03 76.76 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.535 ' CZ2' ' HB2' ' A' ' 7' ' ' ARG . 11.0 p-90 -95.01 29.7 2.34 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.995 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.656 ' CZ ' ' HA ' ' A' ' 11' ' ' ARG . 1.6 tpm_? -131.04 -31.71 1.67 Allowed 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.545 -1.207 . . . . 0.0 109.542 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.475 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.355 0 N-CA-C 112.008 -0.437 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 m -104.88 27.78 7.77 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -177.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -152.3 141.52 14.27 Favored Pre-proline 0 N--CA 1.471 0.589 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.18 -35.34 73.05 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.02 2.48 . . . . 0.0 113.157 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.661 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 30.3 mtm180 -88.16 9.76 21.69 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.022 0.915 . . . . 0.0 111.225 179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.456 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -65.55 -36.96 85.31 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 177.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.661 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 2.0 p-90 -95.92 37.54 1.22 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.131 175.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.499 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 21.8 tpp180 -137.21 -32.94 0.77 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.894 179.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.456 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.281 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 m -105.79 28.61 7.37 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 -177.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -152.38 142.28 14.85 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 121.972 -0.455 . . . . 0.0 109.945 178.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_exo -53.01 -34.25 66.54 Favored 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 122.783 2.322 . . . . 0.0 113.272 -179.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.666 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 20.2 mtm180 -91.0 13.7 15.99 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-O 121.997 0.903 . . . . 0.0 111.165 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.495 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.457 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.5 -37.2 86.72 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.666 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -95.35 33.38 1.59 Allowed 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.054 -0.976 . . . . 0.0 109.499 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.495 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 43.4 tpt85 -133.87 -30.7 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.501 -1.227 . . . . 0.0 109.553 179.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.457 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . 0.436 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.9 m -91.9 31.44 1.24 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 -178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.505 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 9.6 t70 -152.49 140.16 13.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 76.1 Cg_exo -51.12 -32.23 38.87 Favored 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 123.094 2.53 . . . . 0.0 114.31 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.595 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 5.8 mtm-85 -106.39 24.93 11.75 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 122.15 0.976 . . . . 0.0 110.922 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.731 'SE ' HH21 ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.436 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -60.65 -45.94 92.19 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.595 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 0.9 OUTLIER -90.67 34.44 0.9 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.052 176.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.731 HH21 'SE ' ' A' ' 8' ' ' SEC . 46.9 ttp85 -149.41 7.13 0.67 Allowed 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.043 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.532 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . 0.4 ' O ' ' CB ' ' A' ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.5 m -106.99 30.37 6.23 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.45 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.3 t70 -152.34 141.96 14.61 Favored Pre-proline 0 N--CA 1.471 0.601 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 178.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.4 Cg_endo -53.98 -32.36 67.92 Favored 'Trans proline' 0 CA--C 1.534 0.493 0 C-N-CA 122.976 2.451 . . . . 0.0 113.143 -179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.647 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.6 mtm180 -94.58 20.11 8.93 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-O 122.268 1.032 . . . . 0.0 110.676 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.589 'SE ' ' HD3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.421 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.62 -38.32 90.62 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 177.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -95.77 38.32 1.17 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.02 175.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.589 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.1 ttt180 -139.22 -30.68 0.72 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.299 -1.319 . . . . 0.0 109.201 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.421 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.497 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.2 m -107.95 30.77 6.05 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.794 1.035 . . . . 0.0 113.794 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -152.35 141.04 13.89 Favored Pre-proline 0 N--CA 1.469 0.519 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_exo -53.32 -33.45 65.98 Favored 'Trans proline' 0 CA--C 1.536 0.604 0 C-N-CA 123.143 2.562 . . . . 0.0 113.817 -179.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.646 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.7 OUTLIER -94.17 19.72 8.95 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 122.267 1.032 . . . . 0.0 110.195 179.332 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.578 'SE ' ' HD3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.409 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.66 -38.2 90.2 Favored 'General case' 0 CA--C 1.515 -0.388 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 177.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.646 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.3 p-90 -95.8 37.86 1.2 Allowed 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.128 175.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.578 ' HD3' 'SE ' ' A' ' 8' ' ' SEC . 78.5 ttt180 -138.28 -30.62 0.78 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 114.305 -1.316 . . . . 0.0 109.185 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.409 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.287 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.0 m -88.98 18.27 5.03 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.664 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -151.6 135.15 9.33 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.61 -31.88 92.95 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.801 2.334 . . . . 0.0 113.173 -179.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.416 ' O ' ' CE3' ' A' ' 10' ' ' TRP . 56.6 mtm180 -76.45 -30.74 57.48 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 120.838 0.351 . . . . 0.0 110.119 178.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.708 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.86 -23.28 66.0 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.391 179.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -79.69 -17.84 52.71 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 179.596 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 45.8 ttt85 -76.75 -40.78 47.3 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.644 -1.162 . . . . 0.0 110.129 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.708 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.397 0 N-CA-C 112.122 -0.391 . . . . 0.0 112.122 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -107.56 32.95 4.31 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.427 ' OD2' ' HG2' ' A' ' 7' ' ' ARG . 9.0 t70 -152.52 141.27 14.02 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.97 -37.63 67.77 Favored 'Trans proline' 0 CA--C 1.537 0.628 0 C-N-CA 123.735 2.957 . . . . 0.0 115.225 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 10' ' ' TRP . 4.9 ptp180 -91.56 -4.32 55.52 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 122.656 1.217 . . . . 0.0 110.938 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.447 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -63.96 -34.4 77.89 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.713 ' HZ3' HH21 ' A' ' 11' ' ' ARG . 8.9 p-90 -95.67 33.47 1.64 Allowed 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.762 176.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.713 HH21 ' HZ3' ' A' ' 10' ' ' TRP . 20.7 tpp180 -133.98 -32.63 1.08 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 114.386 -1.279 . . . . 0.0 109.205 179.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.447 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.588 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -100.2 26.36 6.59 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 114.306 1.225 . . . . 0.0 114.306 -177.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.423 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 25.9 t70 -152.36 142.19 14.78 Favored Pre-proline 0 N--CA 1.47 0.552 0 O-C-N 122.011 -0.431 . . . . 0.0 109.953 178.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 10.6 Cg_endo -54.12 -33.25 73.37 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 122.88 2.387 . . . . 0.0 113.075 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.653 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 18.9 mtm180 -90.84 13.67 15.77 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-O 122.0 0.905 . . . . 0.0 111.155 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.463 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.482 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -66.07 -36.67 83.82 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 177.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.653 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.5 p-90 -95.48 32.36 1.8 Allowed 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.336 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.463 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 43.7 tpt85 -132.45 -30.63 1.46 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.504 -1.226 . . . . 0.0 109.376 179.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.482 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.227 -0.307 0 N-CA-C 112.13 -0.388 . . . . 0.0 112.13 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 m -109.07 35.72 3.15 Favored 'General case' 0 C--N 1.313 -1.021 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.456 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 13.3 t70 -152.26 139.09 12.31 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.456 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 74.4 Cg_exo -52.56 -35.91 68.93 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 123.436 2.758 . . . . 0.0 114.424 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.79 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -98.43 22.75 9.32 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.912 0.863 . . . . 0.0 110.575 179.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.28 -36.27 83.55 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.549 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.7 p-90 -96.11 38.16 1.2 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 114.905 -1.043 . . . . 0.0 109.272 176.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.6 tpp85 -136.83 -31.27 0.85 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.373 -1.285 . . . . 0.0 108.97 179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.23 -0.348 . . . . 0.0 112.23 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . 0.464 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 m -89.87 27.46 1.56 Allowed 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -152.19 140.79 13.73 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.81 -33.92 52.67 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.147 2.565 . . . . 0.0 114.281 -179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.622 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 8.1 mtm-85 -100.26 18.93 17.54 Favored 'General case' 0 CA--C 1.507 -0.691 0 CA-C-O 121.774 0.797 . . . . 0.0 111.272 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.509 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.464 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.9 -46.01 89.84 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 177.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.622 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -89.77 38.56 0.92 Allowed 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 122.154 0.978 . . . . 0.0 109.52 176.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.509 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 16.5 tpp85 -144.4 -9.24 0.66 Allowed 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.378 -1.283 . . . . 0.0 109.575 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.031 -0.428 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -99.13 27.29 5.18 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 114.201 1.186 . . . . 0.0 114.201 -177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -152.5 141.58 14.26 Favored Pre-proline 0 N--CA 1.469 0.503 0 O-C-N 122.112 -0.367 . . . . 0.0 110.095 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.98 -32.9 70.35 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 122.766 2.311 . . . . 0.0 113.089 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.638 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 19.0 mtm180 -92.08 16.99 10.11 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 122.043 0.925 . . . . 0.0 110.869 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.723 'SE ' HH11 ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.42 -37.93 86.3 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 177.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.638 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.2 p-90 -96.52 36.9 1.31 Allowed 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 114.662 -1.154 . . . . 0.0 108.934 175.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.723 HH11 'SE ' ' A' ' 8' ' ' SEC . 60.8 ttt-85 -140.8 -23.88 0.77 Allowed 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 114.674 -1.148 . . . . 0.0 110.069 -179.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.189 -0.365 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . 0.455 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.1 m -89.69 29.4 1.16 Allowed 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -178.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 19.7 t70 -152.39 140.71 13.61 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 9.8 Cg_endo -53.74 -28.73 48.71 Favored 'Trans proline' 0 CA--C 1.535 0.565 0 C-N-CA 122.999 2.466 . . . . 0.0 113.625 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.604 ' HA ' ' CZ2' ' A' ' 10' ' ' TRP . 0.5 OUTLIER -103.7 20.42 18.04 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.791 0.805 . . . . 0.0 110.77 179.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.742 ' HA ' ' HB3' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.455 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -63.34 -44.39 95.01 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 177.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.604 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.1 p-90 -92.53 36.91 1.0 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.297 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.742 ' HB3' ' HA ' ' A' ' 8' ' ' SEC . 48.2 ttt85 -144.29 -6.73 0.72 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.552 -1.203 . . . . 0.0 109.77 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.262 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.1 p -89.57 24.59 2.24 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.081 -179.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -151.74 137.83 11.42 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.68 -34.3 51.6 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.811 2.341 . . . . 0.0 114.135 -178.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.565 ' HA ' ' NE ' ' A' ' 7' ' ' ARG . 2.0 tpm_? -79.52 -28.56 41.35 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 178.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.504 ' HA ' ' CZ3' ' A' ' 10' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.545 ' HA ' 'SE ' ' A' ' 12' ' ' SEC . . . -64.55 -20.71 66.4 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.295 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.563 ' CZ3' ' HB2' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -82.56 -8.28 59.61 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.783 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.563 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 75.9 ttt180 -86.23 -37.61 18.45 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 114.99 -1.005 . . . . 0.0 109.799 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . 0.545 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SEC . . . . . 0.471 'SE ' ' HA ' ' A' ' 9' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.6 m -89.79 30.33 1.06 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.549 -0.75 . . . . 0.0 112.823 -178.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.486 ' OD1' ' HD2' ' A' ' 6' ' ' PRO . 12.4 t70 -152.0 138.68 12.05 Favored Pre-proline 0 C--N 1.327 -0.389 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.486 ' HD2' ' OD1' ' A' ' 5' ' ' ASP . 58.1 Cg_exo -52.17 -35.63 63.62 Favored 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.916 2.411 . . . . 0.0 114.212 -179.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.772 ' NH1' ' HB2' ' A' ' 7' ' ' ARG . 0.1 OUTLIER -101.06 22.42 12.31 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-O 121.59 0.709 . . . . 0.0 111.171 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SEC . . . . . 0.404 ' HA ' ' HB2' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.471 ' HA ' 'SE ' ' A' ' 3' ' ' SEC . . . -62.04 -44.48 96.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 177.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.606 ' CZ2' ' HA ' ' A' ' 7' ' ' ARG . 1.6 p-90 -89.55 32.86 0.85 Allowed 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.019 -0.992 . . . . 0.0 109.916 176.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 8' ' ' SEC . 0.2 OUTLIER -138.09 -7.68 1.58 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.839 -1.073 . . . . 0.0 109.125 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_