data_5d9e_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 5d9e _Structure_validation_residue.Date_analyzed 2016-10-12 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 ecloud orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 N-CA-C 116.664 1.426 . . . . 5.9500000000000002 116.664 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -134.63 167.34 21.0 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 122.047 0.927 . . . . 6.3899999999999997 110.886 173.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -80.41 -6.16 57.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 113.675 -1.602 . . . . 6.5199999999999996 114.432 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.8 p -83.6 167.42 28.62 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 117.985 0.357 . . . . 6.71 111.662 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.48 165.62 26.57 Favored 'Trans proline' 0 C--O 1.238 0.506 0 N-CA-C 109.983 -0.814 . . . . 7.8399999999999999 109.983 165.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 139.54 -148.17 19.79 Favored Glycine 0 CA--C 1.506 -0.49 0 C-N-CA 121.112 -0.566 . . . . 5.8700000000000001 113.683 169.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 mt -76.59 141.65 69.45 Favored Pre-proline 0 C--N 1.323 -0.559 0 C-N-CA 120.642 -0.423 . . . . 13.33 109.986 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.06 145.93 96.01 Favored 'Trans proline' 0 C--N 1.347 0.457 0 O-C-N 122.491 0.732 . . . . 8.4600000000000009 110.984 170.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -86.42 158.01 19.7 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 123.397 0.679 . . . . 7.0800000000000001 110.409 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -69.26 -46.64 66.77 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.35 -0.94 . . . . 11.779999999999999 113.11 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -119.96 -9.32 9.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 114.361 1.245 . . . . 8.8599999999999994 114.361 -162.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.2 mt -130.11 154.63 81.34 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 107.602 -1.258 . . . . 7.2699999999999996 107.602 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.47 178.47 3.76 Favored 'Trans proline' 0 C--O 1.244 0.795 0 N-CA-C 108.819 -1.262 . . . . 7.8700000000000001 108.819 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.85 -170.28 41.59 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 109.31 -1.516 . . . . 7.3799999999999999 109.31 -173.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -144.05 174.57 10.74 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.22 -1.03 . . . . 8.2300000000000004 108.22 -168.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -147.37 152.05 37.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 10.960000000000001 110.765 174.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 53.5 mtm . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 106.791 -1.559 . . . . 11.81 106.791 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -73.52 153.41 49.61 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 121.587 1.525 . . . . 9.4000000000000004 112.088 174.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-O 117.221 -1.877 . . . . 12.65 114.97 173.325 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 N-CA-C 116.664 1.426 . . . . 4.9500000000000002 116.664 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -134.63 167.34 21.0 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 122.047 0.927 . . . . 5.3200000000000003 110.886 173.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -80.41 -6.16 57.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 113.675 -1.602 . . . . 5.4299999999999997 114.432 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.8 p -83.6 167.42 28.62 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 117.985 0.357 . . . . 5.5899999999999999 111.662 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.48 165.62 26.57 Favored 'Trans proline' 0 C--O 1.238 0.506 0 N-CA-C 109.983 -0.814 . . . . 6.5300000000000002 109.983 165.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 139.54 -148.17 19.79 Favored Glycine 0 CA--C 1.506 -0.49 0 C-N-CA 121.112 -0.566 . . . . 5.8700000000000001 113.683 169.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 mt -76.59 141.65 69.45 Favored Pre-proline 0 C--N 1.323 -0.559 0 C-N-CA 120.642 -0.423 . . . . 11.109999999999999 109.986 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.06 145.93 96.01 Favored 'Trans proline' 0 C--N 1.347 0.457 0 O-C-N 122.491 0.732 . . . . 7.0499999999999998 110.984 170.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -86.42 158.01 19.7 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 123.397 0.679 . . . . 7.0800000000000001 110.409 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -69.26 -46.64 66.77 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.35 -0.94 . . . . 11.779999999999999 113.11 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -119.96 -9.32 9.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 114.361 1.245 . . . . 7.3799999999999999 114.361 -162.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.2 mt -130.11 154.63 81.34 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 107.602 -1.258 . . . . 6.0599999999999996 107.602 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.47 178.47 3.76 Favored 'Trans proline' 0 C--O 1.244 0.795 0 N-CA-C 108.819 -1.262 . . . . 6.5599999999999996 108.819 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.85 -170.28 41.59 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 109.31 -1.516 . . . . 6.5300000000000002 109.31 -173.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -144.05 174.57 10.74 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.22 -1.03 . . . . 6.8499999999999996 108.22 -168.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -147.37 152.05 37.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 9.1300000000000008 110.765 174.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 53.5 mtm . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 106.791 -1.559 . . . . 9.8399999999999999 106.791 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -73.52 153.41 49.61 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 121.587 1.525 . . . . 7.8300000000000001 112.088 174.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-O 117.221 -1.877 . . . . 12.65 114.97 173.325 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.863 0 N-CA-C 116.664 1.426 . . . . 4.95 116.664 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -134.63 167.34 21.0 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 122.047 0.927 . . . . 5.32 110.886 173.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 77.6 mt -80.41 -6.16 57.62 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 113.675 -1.602 . . . . 5.43 114.432 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.8 p -83.6 167.42 28.62 Favored Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 117.985 0.357 . . . . 5.59 111.662 -172.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -67.48 165.62 26.57 Favored 'Trans proline' 0 C--O 1.238 0.506 0 N-CA-C 109.983 -0.814 . . . . 6.53 109.983 165.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 139.54 -148.17 19.79 Favored Glycine 0 CA--C 1.506 -0.49 0 C-N-CA 121.112 -0.566 . . . . 5.87 113.683 169.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 38.8 mt -76.59 141.65 69.45 Favored Pre-proline 0 C--N 1.323 -0.559 0 C-N-CA 120.642 -0.423 . . . . 11.11 109.986 -177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.06 145.93 96.01 Favored 'Trans proline' 0 C--N 1.347 0.457 0 O-C-N 122.491 0.732 . . . . 7.05 110.984 170.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -86.42 158.01 19.7 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 123.397 0.679 . . . . 7.08 110.409 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -69.26 -46.64 66.77 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 119.35 -0.94 . . . . 11.78 113.11 -175.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -119.96 -9.32 9.67 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 114.361 1.245 . . . . 7.38 114.361 -162.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 96.2 mt -130.11 154.63 81.34 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 107.602 -1.258 . . . . 6.06 107.602 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -68.47 178.47 3.76 Favored 'Trans proline' 0 C--O 1.244 0.795 0 N-CA-C 108.819 -1.262 . . . . 6.56 108.819 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.85 -170.28 41.59 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 109.31 -1.516 . . . . 6.53 109.31 -173.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 64.7 m80 -144.05 174.57 10.74 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.22 -1.03 . . . . 6.85 108.22 -168.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.5 p90 -147.37 152.05 37.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.427 0.632 . . . . 9.13 110.765 174.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SME . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 53.5 mtm . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 106.791 -1.559 . . . . 9.84 106.791 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -73.52 153.41 49.61 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 121.587 1.525 . . . . 7.83 112.088 174.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.85 0 CA-C-O 117.221 -1.877 . . . . 12.65 114.97 173.325 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_