data_1sp1_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 1sp1 _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' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.276 0.56 . . . . 7.4299999999999997 109.516 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mtpt 53.18 -163.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 5.0499999999999998 109.45 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -95.57 150.04 20.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -0.915 . . . . 3.1099999999999999 109.447 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 6' ' ' PRO . . . 171.48 139.84 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 1.3100000000000001 109.294 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.471 ' SG ' HG12 ' A' ' 22' ' ' ILE . 17.1 t -38.31 100.74 0.21 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.502 -0.749 . . . . 0.89000000000000001 110.61 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 4' ' ' ALA . 2.6 Cg_endo -62.37 -13.34 32.2 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 121.578 1.519 . . . . 1.4099999999999999 108.854 178.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -78.61 -49.29 13.5 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.519 -0.738 . . . . 2.4300000000000002 109.787 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.3 p -117.62 141.77 29.48 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.046 -1.034 . . . . 0.94999999999999996 109.855 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.61 80.18 0.25 Allowed 'Trans proline' 0 C--N 1.314 -1.261 0 C-N-CA 122.388 2.059 . . . . 1.2 110.579 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.482 ' HB3' ' CE1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -124.46 -170.36 2.13 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.817 -1.177 . . . . 2.79 109.321 179.818 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -142.88 139.37 30.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.38 -0.825 . . . . 4.6900000000000004 109.343 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.482 ' CE1' ' HB3' ' A' ' 10' ' ' LYS . 72.3 m-85 -142.52 174.16 10.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.964 . . . . 2.4300000000000002 109.608 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -134.62 42.51 2.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.414 -0.804 . . . . 3.3799999999999999 109.356 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.68 170.59 2.86 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.234 -0.916 . . . . 4.5800000000000001 109.414 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.7 p -108.58 -23.63 11.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.198 -0.939 . . . . 1.72 109.482 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.59 -74.3 0.18 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.268 -0.895 . . . . 2.1699999999999999 109.356 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -29.14 50.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.205 -0.934 . . . . 3.5600000000000001 109.399 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.468 ' O ' HD13 ' A' ' 18' ' ' LEU . 3.3 tp -70.01 -40.96 74.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 2.0 109.315 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 28.4 t -67.33 -52.92 34.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.169 -0.957 . . . . 2.0099999999999998 109.598 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -46.23 -41.31 12.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.75 109.39 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -59.95 -53.1 61.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 1.1499999999999999 109.362 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.471 HG12 ' SG ' ' A' ' 5' ' ' CYS . 49.6 mt -61.66 -17.82 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.327 -0.858 . . . . 1.72 109.767 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.22 -29.74 70.57 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 4.0599999999999996 109.876 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.9 p -81.14 -8.86 59.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 2.3399999999999999 109.437 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -80.18 -21.44 43.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.253 -0.905 . . . . 2.0099999999999998 109.301 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.34 64.81 1.08 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 6.5300000000000002 109.531 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.539 ' O ' ' CG ' ' A' ' 28' ' ' LYS . 20.6 t-20 -56.38 127.59 31.78 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.393 -0.817 . . . . 5.5 109.564 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 27' ' ' ASN . 21.3 pttt 43.89 -171.56 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.528 -0.733 . . . . 7.8899999999999997 109.985 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 28' ' ' LYS . 14.7 ptpt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 117.997 -1.001 . . . . 9.4800000000000004 109.974 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.276 0.56 . . . . 7.0700000000000003 109.516 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mtpt 53.18 -163.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 4.7300000000000004 109.45 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 2.2 p90 -95.57 150.04 20.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -0.915 . . . . 2.2999999999999998 109.447 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 3' ' ' PHE . . . 171.48 139.84 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.84999999999999998 109.294 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' HG12 ' A' ' 22' ' ' ILE . 17.1 t -38.31 100.74 0.21 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.502 -0.749 . . . . 0.89000000000000001 110.61 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 4' ' ' ALA . 2.6 Cg_endo -62.37 -13.34 32.2 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 121.578 1.519 . . . . 1.29 108.854 178.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -78.61 -49.29 13.5 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.519 -0.738 . . . . 2.4300000000000002 109.787 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.3 p -117.62 141.77 29.48 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.046 -1.034 . . . . 0.93000000000000005 109.855 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.61 80.18 0.25 Allowed 'Trans proline' 0 C--N 1.314 -1.261 0 C-N-CA 122.388 2.059 . . . . 1.0800000000000001 110.579 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.508 ' HB3' ' CE1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -124.46 -170.36 2.13 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.817 -1.177 . . . . 2.3199999999999998 109.321 179.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -142.88 139.37 30.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.38 -0.825 . . . . 4.04 109.343 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.508 ' CE1' ' HB3' ' A' ' 10' ' ' LYS . 72.3 m-85 -142.52 174.16 10.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.964 . . . . 1.9299999999999999 109.608 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -134.62 42.51 2.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.414 -0.804 . . . . 3.02 109.356 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.68 170.59 2.86 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.234 -0.916 . . . . 3.9100000000000001 109.414 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.7 p -108.58 -23.63 11.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.198 -0.939 . . . . 1.3799999999999999 109.482 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.59 -74.3 0.18 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.268 -0.895 . . . . 2.1699999999999999 109.356 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -29.14 50.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.205 -0.934 . . . . 2.8599999999999999 109.399 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.793 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tp -70.01 -40.96 74.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 1.3899999999999999 109.315 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 28.4 t -67.33 -52.92 34.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.169 -0.957 . . . . 1.6100000000000001 109.598 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -46.23 -41.31 12.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.23 109.39 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -59.95 -53.1 61.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 1.1499999999999999 109.362 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.481 HG12 ' SG ' ' A' ' 5' ' ' CYS . 49.6 mt -61.66 -17.82 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.327 -0.858 . . . . 1.4099999999999999 109.767 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.22 -29.74 70.57 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 3.6800000000000002 109.876 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.9 p -81.14 -8.86 59.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 1.8200000000000001 109.437 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -80.18 -21.44 43.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.253 -0.905 . . . . 2.0099999999999998 109.301 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.34 64.81 1.08 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 5.7999999999999998 109.531 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.539 ' O ' ' CG ' ' A' ' 28' ' ' LYS . 20.6 t-20 -56.38 127.59 31.78 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.393 -0.817 . . . . 4.7199999999999998 109.564 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 27' ' ' ASN . 21.3 pttt 43.89 -171.56 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.528 -0.733 . . . . 7.4000000000000004 109.985 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 28' ' ' LYS . 14.7 ptpt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 117.997 -1.001 . . . . 9.1099999999999994 109.974 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.276 0.56 . . . . 7.0700000000000003 109.516 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.1 mtpt 53.18 -163.29 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 4.7300000000000004 109.45 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 4' ' ' ALA . 2.2 p90 -95.57 150.04 20.77 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -0.915 . . . . 2.2999999999999998 109.447 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' A' ' 3' ' ' PHE . . . 171.48 139.84 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.287 -0.883 . . . . 0.84999999999999998 109.294 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' HG12 ' A' ' 22' ' ' ILE . 17.1 t -38.31 100.74 0.21 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.502 -0.749 . . . . 0.89000000000000001 110.61 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 4' ' ' ALA . 2.6 Cg_endo -62.37 -13.34 32.2 Favored 'Trans proline' 0 C--N 1.309 -1.551 0 C-N-CA 121.578 1.519 . . . . 1.29 108.854 178.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -78.61 -49.29 13.5 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.519 -0.738 . . . . 2.4300000000000002 109.787 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 31.3 p -117.62 141.77 29.48 Favored Pre-proline 0 N--CA 1.493 1.701 0 O-C-N 121.046 -1.034 . . . . 0.93000000000000005 109.855 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.61 80.18 0.25 Allowed 'Trans proline' 0 C--N 1.314 -1.261 0 C-N-CA 122.388 2.059 . . . . 1.0800000000000001 110.579 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.508 ' HB3' ' CE1' ' A' ' 12' ' ' PHE . 0.0 OUTLIER -124.46 -170.36 2.13 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 120.817 -1.177 . . . . 2.3199999999999998 109.321 179.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.0 mtm-85 -142.88 139.37 30.79 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.38 -0.825 . . . . 4.04 109.343 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.508 ' CE1' ' HB3' ' A' ' 10' ' ' LYS . 72.3 m-85 -142.52 174.16 10.89 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.158 -0.964 . . . . 1.9299999999999999 109.608 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 87.7 mtp -134.62 42.51 2.83 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.414 -0.804 . . . . 3.02 109.356 179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.68 170.59 2.86 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.234 -0.916 . . . . 3.9100000000000001 109.414 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 60.7 p -108.58 -23.63 11.74 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.198 -0.939 . . . . 1.3799999999999999 109.482 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -73.59 -74.3 0.18 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.268 -0.895 . . . . 2.1699999999999999 109.356 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -29.14 50.09 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.205 -0.934 . . . . 2.8599999999999999 109.399 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.793 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.3 tp -70.01 -40.96 74.94 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.273 -0.892 . . . . 1.3899999999999999 109.315 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 28.4 t -67.33 -52.92 34.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.169 -0.957 . . . . 1.6100000000000001 109.598 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -46.23 -41.31 12.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.183 -0.948 . . . . 3.23 109.39 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -59.95 -53.1 61.81 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 1.1499999999999999 109.362 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.481 HG12 ' SG ' ' A' ' 5' ' ' CYS . 49.6 mt -61.66 -17.82 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.327 -0.858 . . . . 1.4099999999999999 109.767 -179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.22 -29.74 70.57 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.205 -0.934 . . . . 3.6800000000000002 109.876 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.9 p -81.14 -8.86 59.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.244 -0.91 . . . . 1.8200000000000001 109.437 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -80.18 -21.44 43.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.253 -0.905 . . . . 2.0099999999999998 109.301 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.34 64.81 1.08 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 5.7999999999999998 109.531 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.539 ' O ' ' CG ' ' A' ' 28' ' ' LYS . 20.6 t-20 -56.38 127.59 31.78 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.393 -0.817 . . . . 4.7199999999999998 109.564 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.539 ' CG ' ' O ' ' A' ' 27' ' ' ASN . 21.3 pttt 43.89 -171.56 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.528 -0.733 . . . . 7.4000000000000004 109.985 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 28' ' ' LYS . 14.7 ptpt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 117.997 -1.001 . . . . 9.1099999999999994 109.974 -179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_