NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
652930 | 6jpd | cing | 2-parsed | STAR | entry | full | 178 |
data_6jpd_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_6jpd _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_6jpd 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_6jpd _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6jpd "Master copy" parsed_6jpd stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_6jpd _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 6jpd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6jpd 1 1 6jpd.mr . . XPLOR/CNS 2 distance NOE simple 88 parsed_6jpd 1 1 6jpd.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 12 parsed_6jpd 1 1 6jpd.mr . . XPLOR/CNS 4 distance NOE simple 10 parsed_6jpd 1 1 6jpd.mr . . XPLOR/CNS 5 distance NOE ambi 31 parsed_6jpd 1 1 6jpd.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 37 parsed_6jpd 1 1 6jpd.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6jpd 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_6jpd _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER PROTEIN FIBRIL 26-MAR-19 6JPD *TITLE MOUSE RECEPTOR-INTERACTING PROTEIN KINASE 3 (RIP3) AMYLOID STRUCTURE *TITLE 2 BY SOLID-STATE NMR *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: RECEPTOR-INTERACTING SERINE/THREONINE-PROTEIN KINASE 3; *COMPND 3 CHAIN: A, B, C, D, E; *COMPND 4 SYNONYM: RIP-LIKE PROTEIN KINASE 3,RECEPTOR-INTERACTING PROTEIN 3, *COMPND 5 MRIP3; *COMPND 6 EC: 2.7.11.1; *COMPND 7 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; *SOURCE 3 ORGANISM_COMMON: MOUSE; *SOURCE 4 ORGANISM_TAXID: 10090; *SOURCE 5 GENE: RIPK3, RIP3; *SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); *SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; *SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) *KEYWDS PROGRAMMED NECROSIS, AMYLOID, PROTEIN FIBRIL *EXPDTA SOLID-STATE NMR *NUMMDL 10 *AUTHOR X.L.WU,H.HU,J.ZHANG,X.Q.DONG,J.WANG,C.SCHWIETERS,H.Y.WANG,J.X.LU *REVDAT 1 28-OCT-20 6JPD 0 ; save_ save_CNS/XPLOR_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6jpd _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . parsed_6jpd 1 2 1 . . . parsed_6jpd 1 3 1 . . . parsed_6jpd 1 4 1 . . . parsed_6jpd 1 5 1 . . . parsed_6jpd 1 6 1 . . . parsed_6jpd 1 7 1 . . . parsed_6jpd 1 8 1 . . . parsed_6jpd 1 9 1 . . . parsed_6jpd 1 10 1 . . . parsed_6jpd 1 11 1 . . . parsed_6jpd 1 12 1 . . . parsed_6jpd 1 13 1 . . . parsed_6jpd 1 14 1 . . . parsed_6jpd 1 15 1 . . . parsed_6jpd 1 16 1 . . . parsed_6jpd 1 17 1 . . . parsed_6jpd 1 18 1 . . . parsed_6jpd 1 19 1 . . . parsed_6jpd 1 20 1 . . . parsed_6jpd 1 21 1 . . . parsed_6jpd 1 22 1 . . . parsed_6jpd 1 23 1 . . . parsed_6jpd 1 24 1 . . . parsed_6jpd 1 25 1 . . . parsed_6jpd 1 26 1 . . . parsed_6jpd 1 27 1 . . . parsed_6jpd 1 28 1 . . . parsed_6jpd 1 29 1 . . . parsed_6jpd 1 30 1 . . . parsed_6jpd 1 31 1 . . . parsed_6jpd 1 32 1 . . . parsed_6jpd 1 33 1 . . . parsed_6jpd 1 34 1 . . . parsed_6jpd 1 35 1 . . . parsed_6jpd 1 36 1 . . . parsed_6jpd 1 37 1 . . . parsed_6jpd 1 38 1 . . . parsed_6jpd 1 39 1 . . . parsed_6jpd 1 40 1 . . . parsed_6jpd 1 41 1 . . . parsed_6jpd 1 42 1 . . . parsed_6jpd 1 43 1 . . . parsed_6jpd 1 44 1 . . . parsed_6jpd 1 45 1 . . . parsed_6jpd 1 46 1 . . . parsed_6jpd 1 47 1 . . . parsed_6jpd 1 48 1 . . . parsed_6jpd 1 49 1 . . . parsed_6jpd 1 50 1 . . . parsed_6jpd 1 51 1 . . . parsed_6jpd 1 52 1 . . . parsed_6jpd 1 53 1 . . . parsed_6jpd 1 54 1 . . . parsed_6jpd 1 55 1 . . . parsed_6jpd 1 56 1 . . . parsed_6jpd 1 57 1 . . . parsed_6jpd 1 58 1 . . . parsed_6jpd 1 59 1 . . . parsed_6jpd 1 60 1 . . . parsed_6jpd 1 61 1 . . . parsed_6jpd 1 62 1 . . . parsed_6jpd 1 63 1 . . . parsed_6jpd 1 64 1 . . . parsed_6jpd 1 65 1 . . . parsed_6jpd 1 66 1 . . . parsed_6jpd 1 67 1 . . . parsed_6jpd 1 68 1 . . . parsed_6jpd 1 69 1 . . . parsed_6jpd 1 70 1 . . . parsed_6jpd 1 71 1 . . . parsed_6jpd 1 72 1 . . . parsed_6jpd 1 73 1 . . . parsed_6jpd 1 74 1 . . . parsed_6jpd 1 75 1 . . . parsed_6jpd 1 76 1 . . . parsed_6jpd 1 77 1 . . . parsed_6jpd 1 78 1 . . . parsed_6jpd 1 79 1 . . . parsed_6jpd 1 80 1 . . . parsed_6jpd 1 81 1 . . . parsed_6jpd 1 82 1 . . . parsed_6jpd 1 83 1 . . . parsed_6jpd 1 84 1 . . . parsed_6jpd 1 85 1 . . . parsed_6jpd 1 86 1 . . . parsed_6jpd 1 87 1 . . . parsed_6jpd 1 88 1 . . . parsed_6jpd 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 . . . . . . . . A 6 . CB parsed_6jpd 1 1 1 2 . . . . . . . . A 8 . CB parsed_6jpd 1 2 1 1 . . . . . . . . A 10 . CG2 parsed_6jpd 1 2 1 2 . . . . . . . . A 12 . CA parsed_6jpd 1 3 1 1 . . . . . . . . A 12 . CB parsed_6jpd 1 3 1 2 . . . . . . . . A 14 . CA parsed_6jpd 1 4 1 1 . . . . . . . . A 12 . CA parsed_6jpd 1 4 1 2 . . . . . . . . A 14 . CA parsed_6jpd 1 5 1 1 . . . . . . . . A 9 . CD parsed_6jpd 1 5 1 2 . . . . . . . . A 16 . CG parsed_6jpd 1 6 1 1 . . . . . . . . A 1 . CG# parsed_6jpd 1 6 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 7 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 7 1 2 . . . . . . . . A 13 . CB parsed_6jpd 1 8 1 1 . . . . . . . . A 11 . C parsed_6jpd 1 8 1 2 . . . . . . . . A 12 . CA parsed_6jpd 1 9 1 1 . . . . . . . . A 14 . CA parsed_6jpd 1 9 1 2 . . . . . . . . A 15 . C parsed_6jpd 1 10 1 1 . . . . . . . . A 14 . C parsed_6jpd 1 10 1 2 . . . . . . . . A 15 . CB parsed_6jpd 1 11 1 1 . . . . . . . . A 14 . CA parsed_6jpd 1 11 1 2 . . . . . . . . A 15 . CB parsed_6jpd 1 12 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 12 1 2 . . . . . . . . A 16 . CA parsed_6jpd 1 13 1 1 . . . . . . . . A 15 . CA parsed_6jpd 1 13 1 2 . . . . . . . . A 16 . CA parsed_6jpd 1 14 1 1 . . . . . . . . A 16 . CA parsed_6jpd 1 14 1 2 . . . . . . . . A 17 . CA parsed_6jpd 1 15 1 1 . . . . . . . . A 16 . CA parsed_6jpd 1 15 1 2 . . . . . . . . A 17 . CG# parsed_6jpd 1 16 1 1 . . . . . . . . A 16 . CB parsed_6jpd 1 16 1 2 . . . . . . . . A 17 . CA parsed_6jpd 1 17 1 1 . . . . . . . . A 1 . CG# parsed_6jpd 1 17 1 2 . . . . . . . . A 2 . CE# parsed_6jpd 1 18 1 1 . . . . . . . . A 1 . CA parsed_6jpd 1 18 1 2 . . . . . . . . A 2 . CG parsed_6jpd 1 19 1 1 . . . . . . . . A 1 . CB parsed_6jpd 1 19 1 2 . . . . . . . . A 2 . CG parsed_6jpd 1 20 1 1 . . . . . . . . A 4 . CA parsed_6jpd 1 20 1 2 . . . . . . . . A 5 . CB parsed_6jpd 1 21 1 1 . . . . . . . . A 4 . CB parsed_6jpd 1 21 1 2 . . . . . . . . A 5 . CA parsed_6jpd 1 22 1 1 . . . . . . . . A 4 . CB parsed_6jpd 1 22 1 2 . . . . . . . . A 5 . CB parsed_6jpd 1 23 1 1 . . . . . . . . A 4 . CA parsed_6jpd 1 23 1 2 . . . . . . . . A 5 . CA parsed_6jpd 1 24 1 1 . . . . . . . . A 4 . CA parsed_6jpd 1 24 1 2 . . . . . . . . A 5 . C parsed_6jpd 1 25 1 1 . . . . . . . . A 4 . CB parsed_6jpd 1 25 1 2 . . . . . . . . A 5 . C parsed_6jpd 1 26 1 1 . . . . . . . . A 5 . C parsed_6jpd 1 26 1 2 . . . . . . . . A 6 . CA parsed_6jpd 1 27 1 1 . . . . . . . . A 6 . CB parsed_6jpd 1 27 1 2 . . . . . . . . A 7 . CA parsed_6jpd 1 28 1 1 . . . . . . . . A 6 . CB parsed_6jpd 1 28 1 2 . . . . . . . . A 7 . CB parsed_6jpd 1 29 1 1 . . . . . . . . A 6 . CB parsed_6jpd 1 29 1 2 . . . . . . . . A 7 . CG parsed_6jpd 1 30 1 1 . . . . . . . . A 6 . CB parsed_6jpd 1 30 1 2 . . . . . . . . A 7 . CD parsed_6jpd 1 31 1 1 . . . . . . . . A 7 . CA parsed_6jpd 1 31 1 2 . . . . . . . . A 8 . CG# parsed_6jpd 1 32 1 1 . . . . . . . . A 7 . CB parsed_6jpd 1 32 1 2 . . . . . . . . A 8 . CG# parsed_6jpd 1 33 1 1 . . . . . . . . A 7 . CB parsed_6jpd 1 33 1 2 . . . . . . . . A 8 . CA parsed_6jpd 1 34 1 1 . . . . . . . . A 8 . CA parsed_6jpd 1 34 1 2 . . . . . . . . A 9 . CA parsed_6jpd 1 35 1 1 . . . . . . . . A 8 . CB parsed_6jpd 1 35 1 2 . . . . . . . . A 9 . CA parsed_6jpd 1 36 1 1 . . . . . . . . A 8 . CG# parsed_6jpd 1 36 1 2 . . . . . . . . A 9 . CA parsed_6jpd 1 37 1 1 . . . . . . . . A 9 . CA parsed_6jpd 1 37 1 2 . . . . . . . . A 10 . CA parsed_6jpd 1 38 1 1 . . . . . . . . A 9 . CD parsed_6jpd 1 38 1 2 . . . . . . . . A 10 . CA parsed_6jpd 1 39 1 1 . . . . . . . . A 9 . CD parsed_6jpd 1 39 1 2 . . . . . . . . A 10 . CB parsed_6jpd 1 40 1 1 . . . . . . . . A 9 . CA parsed_6jpd 1 40 1 2 . . . . . . . . A 10 . CG2 parsed_6jpd 1 41 1 1 . . . . . . . . A 9 . CB parsed_6jpd 1 41 1 2 . . . . . . . . A 10 . CG2 parsed_6jpd 1 42 1 1 . . . . . . . . A 9 . CB parsed_6jpd 1 42 1 2 . . . . . . . . A 10 . CA parsed_6jpd 1 43 1 1 . . . . . . . . A 9 . CG parsed_6jpd 1 43 1 2 . . . . . . . . A 10 . CA parsed_6jpd 1 44 1 1 . . . . . . . . A 9 . C parsed_6jpd 1 44 1 2 . . . . . . . . A 10 . CG# parsed_6jpd 1 45 1 1 . . . . . . . . A 10 . CA parsed_6jpd 1 45 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 46 1 1 . . . . . . . . A 10 . CG1 parsed_6jpd 1 46 1 2 . . . . . . . . A 11 . C parsed_6jpd 1 47 1 1 . . . . . . . . A 10 . CG1 parsed_6jpd 1 47 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 48 1 1 . . . . . . . . A 10 . CG2 parsed_6jpd 1 48 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 49 1 1 . . . . . . . . A 10 . CG2 parsed_6jpd 1 49 1 2 . . . . . . . . A 11 . C parsed_6jpd 1 50 1 1 . . . . . . . . A 10 . CA parsed_6jpd 1 50 1 2 . . . . . . . . A 11 . C parsed_6jpd 1 51 1 1 . . . . . . . . A 10 . CA parsed_6jpd 1 51 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 52 1 1 . . . . . . . . A 10 . C parsed_6jpd 1 52 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 53 1 1 . . . . . . . . A 10 . CB parsed_6jpd 1 53 1 2 . . . . . . . . A 11 . CA parsed_6jpd 1 54 1 1 . . . . . . . . A 10 . CB parsed_6jpd 1 54 1 2 . . . . . . . . A 11 . C parsed_6jpd 1 55 1 1 . . . . . . . . A 11 . CA parsed_6jpd 1 55 1 2 . . . . . . . . A 12 . CA parsed_6jpd 1 56 1 1 . . . . . . . . A 11 . C parsed_6jpd 1 56 1 2 . . . . . . . . A 12 . CB parsed_6jpd 1 57 1 1 . . . . . . . . A 11 . CA parsed_6jpd 1 57 1 2 . . . . . . . . A 12 . CG parsed_6jpd 1 58 1 1 . . . . . . . . A 11 . CA parsed_6jpd 1 58 1 2 . . . . . . . . A 12 . CB parsed_6jpd 1 59 1 1 . . . . . . . . A 12 . CA parsed_6jpd 1 59 1 2 . . . . . . . . A 13 . CA parsed_6jpd 1 60 1 1 . . . . . . . . A 12 . CB parsed_6jpd 1 60 1 2 . . . . . . . . A 13 . CA parsed_6jpd 1 61 1 1 . . . . . . . . A 12 . CA parsed_6jpd 1 61 1 2 . . . . . . . . A 13 . CB parsed_6jpd 1 62 1 1 . . . . . . . . A 12 . CB parsed_6jpd 1 62 1 2 . . . . . . . . A 13 . CB parsed_6jpd 1 63 1 1 . . . . . . . . A 12 . CB parsed_6jpd 1 63 1 2 . . . . . . . . A 13 . CZ parsed_6jpd 1 64 1 1 . . . . . . . . A 12 . CA parsed_6jpd 1 64 1 2 . . . . . . . . A 13 . CZ parsed_6jpd 1 65 1 1 . . . . . . . . A 13 . CA parsed_6jpd 1 65 1 2 . . . . . . . . A 14 . CA parsed_6jpd 1 66 1 1 . . . . . . . . A 13 . CB parsed_6jpd 1 66 1 2 . . . . . . . . A 14 . CA parsed_6jpd 1 67 1 1 . . . . . . . . A 13 . CB parsed_6jpd 1 67 1 2 . . . . . . . . A 14 . CB parsed_6jpd 1 68 1 1 . . . . . . . . A 13 . CG parsed_6jpd 1 68 1 2 . . . . . . . . A 14 . CA parsed_6jpd 1 69 1 1 . . . . . . . . A 13 . CG parsed_6jpd 1 69 1 2 . . . . . . . . A 14 . CB parsed_6jpd 1 70 1 1 . . . . . . . . A 14 . CB parsed_6jpd 1 70 1 2 . . . . . . . . A 15 . CB parsed_6jpd 1 71 1 1 . . . . . . . . A 14 . CB parsed_6jpd 1 71 1 2 . . . . . . . . A 15 . C parsed_6jpd 1 72 1 1 . . . . . . . . A 14 . CA parsed_6jpd 1 72 1 2 . . . . . . . . A 15 . CA parsed_6jpd 1 73 1 1 . . . . . . . . A 14 . CB parsed_6jpd 1 73 1 2 . . . . . . . . A 15 . CA parsed_6jpd 1 74 1 1 . . . . . . . . A 14 . CG parsed_6jpd 1 74 1 2 . . . . . . . . A 15 . CB parsed_6jpd 1 75 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 75 1 2 . . . . . . . . A 16 . CB parsed_6jpd 1 76 1 1 . . . . . . . . A 15 . C parsed_6jpd 1 76 1 2 . . . . . . . . A 16 . CA parsed_6jpd 1 77 1 1 . . . . . . . . A 15 . C parsed_6jpd 1 77 1 2 . . . . . . . . A 16 . CG parsed_6jpd 1 78 1 1 . . . . . . . . A 15 . C parsed_6jpd 1 78 1 2 . . . . . . . . A 16 . CB parsed_6jpd 1 79 1 1 . . . . . . . . A 15 . C parsed_6jpd 1 79 1 2 . . . . . . . . A 16 . CD2 parsed_6jpd 1 80 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 80 1 2 . . . . . . . . A 16 . CD1 parsed_6jpd 1 81 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 81 1 2 . . . . . . . . A 16 . CD2 parsed_6jpd 1 82 1 1 . . . . . . . . A 15 . CB parsed_6jpd 1 82 1 2 . . . . . . . . A 16 . CG parsed_6jpd 1 83 1 1 . . . . . . . . A 15 . CA parsed_6jpd 1 83 1 2 . . . . . . . . A 16 . CD2 parsed_6jpd 1 84 1 1 . . . . . . . . A 16 . CG parsed_6jpd 1 84 1 2 . . . . . . . . A 17 . CA parsed_6jpd 1 85 1 1 . . . . . . . . A 16 . CD2 parsed_6jpd 1 85 1 2 . . . . . . . . A 17 . CG# parsed_6jpd 1 86 1 1 . . . . . . . . A 16 . CD2 parsed_6jpd 1 86 1 2 . . . . . . . . A 17 . CA parsed_6jpd 1 87 1 1 . . . . . . . . A 16 . CD2 parsed_6jpd 1 87 1 2 . . . . . . . . A 17 . CB parsed_6jpd 1 88 1 1 . . . . . . . . A 4 . CA parsed_6jpd 1 88 1 2 . . . . . . . . B 4 . CA parsed_6jpd 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 2 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 3 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 4 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 5 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 6 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 7 1 . . . . . 5.50 4.00 7.00 parsed_6jpd 1 8 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 9 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 10 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 11 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 12 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 13 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 14 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 15 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 16 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 17 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 18 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 19 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 20 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 21 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 22 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 23 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 24 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 25 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 26 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 27 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 28 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 29 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 30 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 31 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 32 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 33 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 34 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 35 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 36 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 37 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 38 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 39 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 40 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 41 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 42 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 43 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 44 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 45 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 46 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 47 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 48 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 49 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 50 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 51 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 52 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 53 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 54 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 55 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 56 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 57 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 58 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 59 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 60 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 61 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 62 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 63 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 64 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 65 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 66 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 67 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 68 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 69 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 70 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 71 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 72 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 73 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 74 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 75 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 76 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 77 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 78 1 . . . . . 3.50 1.00 6.00 parsed_6jpd 1 79 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 80 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 81 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 82 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 83 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 84 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 85 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 86 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 87 1 . . . . . 5.50 3.00 8.00 parsed_6jpd 1 88 1 . . . . . 4.75 4.65 4.85 parsed_6jpd 1 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 ; echo=false wrnlev=0 ; 2 1 3 16 parsed_6jpd 1 2 ; echo=false wrnlev=0 ; 107 1 108 16 parsed_6jpd 1 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "# Restraints file 1: intrasheet_unambig15_u.tbl" 1 1 1 47 parsed_6jpd 1 2 "# Restraints file 2: parallel_sheet9_u.tbl" 106 122 106 163 parsed_6jpd 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6jpd _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 3 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . parsed_6jpd 2 2 1 . . . parsed_6jpd 2 3 1 . . . parsed_6jpd 2 4 1 . . . parsed_6jpd 2 5 1 . . . parsed_6jpd 2 6 1 . . . parsed_6jpd 2 7 1 . . . parsed_6jpd 2 8 1 . . . parsed_6jpd 2 9 1 . . . parsed_6jpd 2 10 1 . . . parsed_6jpd 2 11 1 . . . parsed_6jpd 2 12 1 . . . parsed_6jpd 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 . . . . . . . . A 4 . HN parsed_6jpd 2 1 1 2 . . . . . . . . B 3 . O parsed_6jpd 2 2 1 1 . . . . . . . . A 4 . N parsed_6jpd 2 2 1 2 . . . . . . . . B 3 . O parsed_6jpd 2 3 1 1 . . . . . . . . A 5 . HN parsed_6jpd 2 3 1 2 . . . . . . . . B 4 . O parsed_6jpd 2 4 1 1 . . . . . . . . A 5 . N parsed_6jpd 2 4 1 2 . . . . . . . . B 4 . O parsed_6jpd 2 5 1 1 . . . . . . . . A 8 . CA parsed_6jpd 2 5 1 2 . . . . . . . . B 8 . CA parsed_6jpd 2 6 1 1 . . . . . . . . A 11 . HN parsed_6jpd 2 6 1 2 . . . . . . . . B 10 . O parsed_6jpd 2 7 1 1 . . . . . . . . A 11 . N parsed_6jpd 2 7 1 2 . . . . . . . . B 10 . O parsed_6jpd 2 8 1 1 . . . . . . . . A 9 . HN parsed_6jpd 2 8 1 2 . . . . . . . . B 8 . O parsed_6jpd 2 9 1 1 . . . . . . . . A 9 . N parsed_6jpd 2 9 1 2 . . . . . . . . B 8 . O parsed_6jpd 2 10 1 1 . . . . . . . . A 15 . C parsed_6jpd 2 10 1 2 . . . . . . . . B 15 . C parsed_6jpd 2 11 1 1 . . . . . . . . A 16 . HN parsed_6jpd 2 11 1 2 . . . . . . . . B 15 . O parsed_6jpd 2 12 1 1 . . . . . . . . A 16 . N parsed_6jpd 2 12 1 2 . . . . . . . . B 15 . O parsed_6jpd 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.30 2.20 2.40 parsed_6jpd 2 2 1 . . . . . 3.30 3.20 3.40 parsed_6jpd 2 3 1 . . . . . 2.30 2.20 2.40 parsed_6jpd 2 4 1 . . . . . 3.30 3.20 3.40 parsed_6jpd 2 5 1 . . . . . 4.75 4.65 4.85 parsed_6jpd 2 6 1 . . . . . 2.30 2.20 2.40 parsed_6jpd 2 7 1 . . . . . 3.30 3.20 3.40 parsed_6jpd 2 8 1 . . . . . 2.30 2.20 2.40 parsed_6jpd 2 9 1 . . . . . 3.30 3.20 3.40 parsed_6jpd 2 10 1 . . . . . 4.75 4.65 4.85 parsed_6jpd 2 11 1 . . . . . 2.30 2.20 2.40 parsed_6jpd 2 12 1 . . . . . 3.30 3.20 3.40 parsed_6jpd 2 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6jpd _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 4 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . parsed_6jpd 3 2 1 . . . parsed_6jpd 3 3 1 . . . parsed_6jpd 3 4 1 . . . parsed_6jpd 3 5 1 . . . parsed_6jpd 3 6 1 . . . parsed_6jpd 3 7 1 . . . parsed_6jpd 3 8 1 . . . parsed_6jpd 3 9 1 . . . parsed_6jpd 3 10 1 . . . parsed_6jpd 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 . . . . . . . . A 1 . N parsed_6jpd 3 1 1 2 . . . . . . . . A 2 . CA parsed_6jpd 3 2 1 1 . . . . . . . . A 2 . N parsed_6jpd 3 2 1 2 . . . . . . . . A 1 . CB parsed_6jpd 3 3 1 1 . . . . . . . . A 2 . N parsed_6jpd 3 3 1 2 . . . . . . . . A 3 . CA parsed_6jpd 3 4 1 1 . . . . . . . . A 9 . Ne2 parsed_6jpd 3 4 1 2 . . . . . . . . A 8 . CA parsed_6jpd 3 5 1 1 . . . . . . . . A 15 . N parsed_6jpd 3 5 1 2 . . . . . . . . A 14 . CB parsed_6jpd 3 6 1 1 . . . . . . . . A 15 . N parsed_6jpd 3 6 1 2 . . . . . . . . A 16 . C parsed_6jpd 3 7 1 1 . . . . . . . . A 17 . N parsed_6jpd 3 7 1 2 . . . . . . . . A 16 . CG parsed_6jpd 3 8 1 1 . . . . . . . . A 17 . N parsed_6jpd 3 8 1 2 . . . . . . . . A 16 . CD2 parsed_6jpd 3 9 1 1 . . . . . . . . A 14 . Nd2 parsed_6jpd 3 9 1 2 . . . . . . . . A 11 . CA parsed_6jpd 3 10 1 1 . . . . . . . . A 9 . Ne2 parsed_6jpd 3 10 1 2 . . . . . . . . A 16 . CG parsed_6jpd 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 2 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 3 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 4 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 5 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 6 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 7 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 8 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 9 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 10 1 . . . . . 4.50 2.00 7.00 parsed_6jpd 3 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 ; echo=false wrnlev=0 ; 2 1 3 16 parsed_6jpd 3 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "# Restraints file 3: TEDOR_unambig2_u.tbl" 1 1 1 41 parsed_6jpd 3 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_6jpd _Distance_constraint_list.ID 4 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 5 _Distance_constraint_list.Details "Generated by Wattos" loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 2 . OR parsed_6jpd 4 1 2 . 3 . parsed_6jpd 4 1 3 . 4 . parsed_6jpd 4 1 4 . . . parsed_6jpd 4 2 1 2 . OR parsed_6jpd 4 2 2 . 3 . parsed_6jpd 4 2 3 . . . parsed_6jpd 4 3 1 2 . OR parsed_6jpd 4 3 2 . 3 . parsed_6jpd 4 3 3 . . . parsed_6jpd 4 4 1 2 . OR parsed_6jpd 4 4 2 . 3 . parsed_6jpd 4 4 3 . . . parsed_6jpd 4 5 1 2 . OR parsed_6jpd 4 5 2 . 3 . parsed_6jpd 4 5 3 . . . parsed_6jpd 4 6 1 2 . OR parsed_6jpd 4 6 2 . 3 . parsed_6jpd 4 6 3 . . . parsed_6jpd 4 7 1 2 . OR parsed_6jpd 4 7 2 . 3 . parsed_6jpd 4 7 3 . . . parsed_6jpd 4 8 1 2 . OR parsed_6jpd 4 8 2 . 3 . parsed_6jpd 4 8 3 . . . parsed_6jpd 4 9 1 2 . OR parsed_6jpd 4 9 2 . 3 . parsed_6jpd 4 9 3 . . . parsed_6jpd 4 10 1 2 . OR parsed_6jpd 4 10 2 . 3 . parsed_6jpd 4 10 3 . . . parsed_6jpd 4 11 1 2 . OR parsed_6jpd 4 11 2 . 3 . parsed_6jpd 4 11 3 . . . parsed_6jpd 4 12 1 2 . OR parsed_6jpd 4 12 2 . 3 . parsed_6jpd 4 12 3 . . . parsed_6jpd 4 13 1 2 . OR parsed_6jpd 4 13 2 . 3 . parsed_6jpd 4 13 3 . . . parsed_6jpd 4 14 1 2 . OR parsed_6jpd 4 14 2 . 3 . parsed_6jpd 4 14 3 . . . parsed_6jpd 4 15 1 2 . OR parsed_6jpd 4 15 2 . 3 . parsed_6jpd 4 15 3 . . . parsed_6jpd 4 16 1 2 . OR parsed_6jpd 4 16 2 . 3 . parsed_6jpd 4 16 3 . . . parsed_6jpd 4 17 1 2 . OR parsed_6jpd 4 17 2 . 3 . parsed_6jpd 4 17 3 . . . parsed_6jpd 4 18 1 2 . OR parsed_6jpd 4 18 2 . 3 . parsed_6jpd 4 18 3 . . . parsed_6jpd 4 19 1 2 . OR parsed_6jpd 4 19 2 . 3 . parsed_6jpd 4 19 3 . . . parsed_6jpd 4 20 1 2 . OR parsed_6jpd 4 20 2 . 3 . parsed_6jpd 4 20 3 . . . parsed_6jpd 4 21 1 2 . OR parsed_6jpd 4 21 2 . 3 . parsed_6jpd 4 21 3 . . . parsed_6jpd 4 22 1 2 . OR parsed_6jpd 4 22 2 . 3 . parsed_6jpd 4 22 3 . . . parsed_6jpd 4 23 1 2 . OR parsed_6jpd 4 23 2 . 3 . parsed_6jpd 4 23 3 . 4 . parsed_6jpd 4 23 4 . 5 . parsed_6jpd 4 23 5 . . . parsed_6jpd 4 24 1 2 . OR parsed_6jpd 4 24 2 . 3 . parsed_6jpd 4 24 3 . 4 . parsed_6jpd 4 24 4 . . . parsed_6jpd 4 25 1 2 . OR parsed_6jpd 4 25 2 . 3 . parsed_6jpd 4 25 3 . 4 . parsed_6jpd 4 25 4 . . . parsed_6jpd 4 26 1 2 . OR parsed_6jpd 4 26 2 . 3 . parsed_6jpd 4 26 3 . 4 . parsed_6jpd 4 26 4 . 5 . parsed_6jpd 4 26 5 . 6 . parsed_6jpd 4 26 6 . . . parsed_6jpd 4 27 1 2 . OR parsed_6jpd 4 27 2 . 3 . parsed_6jpd 4 27 3 . 4 . parsed_6jpd 4 27 4 . 5 . parsed_6jpd 4 27 5 . . . parsed_6jpd 4 28 1 2 . OR parsed_6jpd 4 28 2 . 3 . parsed_6jpd 4 28 3 . 4 . parsed_6jpd 4 28 4 . 5 . parsed_6jpd 4 28 5 . . . parsed_6jpd 4 29 1 2 . OR parsed_6jpd 4 29 2 . 3 . parsed_6jpd 4 29 3 . 4 . parsed_6jpd 4 29 4 . 5 . parsed_6jpd 4 29 5 . . . parsed_6jpd 4 30 1 2 . OR parsed_6jpd 4 30 2 . 3 . parsed_6jpd 4 30 3 . 4 . parsed_6jpd 4 30 4 . 5 . parsed_6jpd 4 30 5 . . . parsed_6jpd 4 31 1 2 . OR parsed_6jpd 4 31 2 . 3 . parsed_6jpd 4 31 3 . 4 . parsed_6jpd 4 31 4 . 5 . parsed_6jpd 4 31 5 . . . parsed_6jpd 4 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Assembly_atom_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Seq_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Resonance_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 2 1 . . . . . . . . A 1 . CG# parsed_6jpd 4 1 2 2 . . . . . . . . A 10 . CB parsed_6jpd 4 1 3 1 . . . . . . . . A 1 . CG# parsed_6jpd 4 1 3 2 . . . . . . . . A 14 . CB parsed_6jpd 4 1 4 1 . . . . . . . . A 8 . CG# parsed_6jpd 4 1 4 2 . . . . . . . . A 10 . CB parsed_6jpd 4 2 2 1 . . . . . . . . A 1 . CG# parsed_6jpd 4 2 2 2 . . . . . . . . A 2 . CB parsed_6jpd 4 2 3 1 . . . . . . . . A 1 . CG# parsed_6jpd 4 2 3 2 . . . . . . . . A 12 . CB parsed_6jpd 4 3 2 1 . . . . . . . . A 9 . CB parsed_6jpd 4 3 2 2 . . . . . . . . A 10 . CB parsed_6jpd 4 3 3 1 . . . . . . . . A 9 . CB parsed_6jpd 4 3 3 2 . . . . . . . . A 14 . CB parsed_6jpd 4 4 2 1 . . . . . . . . A 9 . CG parsed_6jpd 4 4 2 2 . . . . . . . . A 10 . CB parsed_6jpd 4 4 3 1 . . . . . . . . A 9 . CG parsed_6jpd 4 4 3 2 . . . . . . . . A 14 . CB parsed_6jpd 4 5 2 1 . . . . . . . . A 9 . CG parsed_6jpd 4 5 2 2 . . . . . . . . A 11 . C parsed_6jpd 4 5 3 1 . . . . . . . . A 17 . CB parsed_6jpd 4 5 3 2 . . . . . . . . A 11 . C parsed_6jpd 4 6 2 1 . . . . . . . . A 9 . CD parsed_6jpd 4 6 2 2 . . . . . . . . A 15 . CA parsed_6jpd 4 6 3 1 . . . . . . . . A 9 . CD parsed_6jpd 4 6 3 2 . . . . . . . . A 7 . CA parsed_6jpd 4 7 2 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 7 2 2 . . . . . . . . A 8 . CG# parsed_6jpd 4 7 3 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 7 3 2 . . . . . . . . A 1 . CG# parsed_6jpd 4 8 2 1 . . . . . . . . A 10 . CD1 parsed_6jpd 4 8 2 2 . . . . . . . . A 8 . CG# parsed_6jpd 4 8 3 1 . . . . . . . . A 10 . CD1 parsed_6jpd 4 8 3 2 . . . . . . . . A 1 . CG# parsed_6jpd 4 9 2 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 9 2 2 . . . . . . . . A 9 . CD parsed_6jpd 4 9 3 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 9 3 2 . . . . . . . . A 12 . CG parsed_6jpd 4 10 2 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 10 2 2 . . . . . . . . A 12 . CB parsed_6jpd 4 10 3 1 . . . . . . . . A 10 . CG2 parsed_6jpd 4 10 3 2 . . . . . . . . A 2 . CB parsed_6jpd 4 11 2 1 . . . . . . . . A 11 . C parsed_6jpd 4 11 2 2 . . . . . . . . A 9 . CA parsed_6jpd 4 11 3 1 . . . . . . . . A 11 . C parsed_6jpd 4 11 3 2 . . . . . . . . A 14 . CA parsed_6jpd 4 12 2 1 . . . . . . . . A 11 . C parsed_6jpd 4 12 2 2 . . . . . . . . A 10 . CB parsed_6jpd 4 12 3 1 . . . . . . . . A 11 . C parsed_6jpd 4 12 3 2 . . . . . . . . A 14 . CB parsed_6jpd 4 13 2 1 . . . . . . . . A 12 . CA parsed_6jpd 4 13 2 2 . . . . . . . . A 14 . CB parsed_6jpd 4 13 3 1 . . . . . . . . A 12 . CA parsed_6jpd 4 13 3 2 . . . . . . . . A 10 . CB parsed_6jpd 4 14 2 1 . . . . . . . . A 13 . CG parsed_6jpd 4 14 2 2 . . . . . . . . A 15 . CA parsed_6jpd 4 14 3 1 . . . . . . . . A 13 . CG parsed_6jpd 4 14 3 2 . . . . . . . . A 7 . CA parsed_6jpd 4 15 2 1 . . . . . . . . A 15 . CB parsed_6jpd 4 15 2 2 . . . . . . . . A 9 . CG parsed_6jpd 4 15 3 1 . . . . . . . . A 15 . CB parsed_6jpd 4 15 3 2 . . . . . . . . A 17 . CB parsed_6jpd 4 16 2 1 . . . . . . . . A 15 . CB parsed_6jpd 4 16 2 2 . . . . . . . . A 17 . CG# parsed_6jpd 4 16 3 1 . . . . . . . . A 15 . CB parsed_6jpd 4 16 3 2 . . . . . . . . A 8 . CG# parsed_6jpd 4 17 2 1 . . . . . . . . A 15 . CB parsed_6jpd 4 17 2 2 . . . . . . . . A 13 . CA parsed_6jpd 4 17 3 1 . . . . . . . . A 15 . CB parsed_6jpd 4 17 3 2 . . . . . . . . A 10 . CA parsed_6jpd 4 18 2 1 . . . . . . . . A 16 . CG parsed_6jpd 4 18 2 2 . . . . . . . . A 9 . CG parsed_6jpd 4 18 3 1 . . . . . . . . A 16 . CG parsed_6jpd 4 18 3 2 . . . . . . . . A 17 . CB parsed_6jpd 4 19 2 1 . . . . . . . . A 16 . CD2 parsed_6jpd 4 19 2 2 . . . . . . . . A 14 . CA parsed_6jpd 4 19 3 1 . . . . . . . . A 16 . CD2 parsed_6jpd 4 19 3 2 . . . . . . . . A 9 . CA parsed_6jpd 4 20 2 1 . . . . . . . . A 16 . CD2 parsed_6jpd 4 20 2 2 . . . . . . . . A 14 . CB parsed_6jpd 4 20 3 1 . . . . . . . . A 16 . CD2 parsed_6jpd 4 20 3 2 . . . . . . . . A 10 . CB parsed_6jpd 4 21 2 1 . . . . . . . . A 16 . CA parsed_6jpd 4 21 2 2 . . . . . . . . A 14 . CB parsed_6jpd 4 21 3 1 . . . . . . . . A 16 . CA parsed_6jpd 4 21 3 2 . . . . . . . . A 10 . CB parsed_6jpd 4 22 2 1 . . . . . . . . A 6 . N parsed_6jpd 4 22 2 2 . . . . . . . . A 8 . CG# parsed_6jpd 4 22 3 1 . . . . . . . . A 15 . N parsed_6jpd 4 22 3 2 . . . . . . . . A 17 . CG# parsed_6jpd 4 23 2 1 . . . . . . . . A 1 . CB parsed_6jpd 4 23 2 2 . . . . . . . . A 11 . C parsed_6jpd 4 23 3 1 . . . . . . . . A 8 . CB parsed_6jpd 4 23 3 2 . . . . . . . . A 11 . C parsed_6jpd 4 23 4 1 . . . . . . . . A 13 . CB parsed_6jpd 4 23 4 2 . . . . . . . . A 11 . C parsed_6jpd 4 23 5 1 . . . . . . . . A 7 . CG parsed_6jpd 4 23 5 2 . . . . . . . . A 11 . C parsed_6jpd 4 24 2 1 . . . . . . . . A 2 . CA parsed_6jpd 4 24 2 2 . . . . . . . . A 11 . C parsed_6jpd 4 24 3 1 . . . . . . . . A 7 . CA parsed_6jpd 4 24 3 2 . . . . . . . . A 11 . C parsed_6jpd 4 24 4 1 . . . . . . . . A 15 . CA parsed_6jpd 4 24 4 2 . . . . . . . . A 11 . C parsed_6jpd 4 25 2 1 . . . . . . . . A 2 . CG parsed_6jpd 4 25 2 2 . . . . . . . . A 10 . CG1 parsed_6jpd 4 25 3 1 . . . . . . . . A 2 . CG parsed_6jpd 4 25 3 2 . . . . . . . . A 16 . CD1 parsed_6jpd 4 25 4 1 . . . . . . . . A 2 . CG parsed_6jpd 4 25 4 2 . . . . . . . . A 7 . CB parsed_6jpd 4 26 2 1 . . . . . . . . A 11 . CA parsed_6jpd 4 26 2 2 . . . . . . . . A 13 . CB parsed_6jpd 4 26 3 1 . . . . . . . . A 11 . CA parsed_6jpd 4 26 3 2 . . . . . . . . A 1 . CB parsed_6jpd 4 26 4 1 . . . . . . . . A 16 . CB parsed_6jpd 4 26 4 2 . . . . . . . . A 13 . CB parsed_6jpd 4 26 5 1 . . . . . . . . A 16 . CB parsed_6jpd 4 26 5 2 . . . . . . . . A 8 . CB parsed_6jpd 4 26 6 1 . . . . . . . . A 16 . CB parsed_6jpd 4 26 6 2 . . . . . . . . A 7 . CG parsed_6jpd 4 27 2 1 . . . . . . . . A 9 . CG parsed_6jpd 4 27 2 2 . . . . . . . . A 16 . CB parsed_6jpd 4 27 3 1 . . . . . . . . A 17 . CB parsed_6jpd 4 27 3 2 . . . . . . . . A 16 . CB parsed_6jpd 4 27 4 1 . . . . . . . . A 9 . CG parsed_6jpd 4 27 4 2 . . . . . . . . A 11 . CA parsed_6jpd 4 27 5 1 . . . . . . . . A 17 . CB parsed_6jpd 4 27 5 2 . . . . . . . . A 11 . CA parsed_6jpd 4 28 2 1 . . . . . . . . A 8 . CB parsed_6jpd 4 28 2 2 . . . . . . . . A 9 . CB parsed_6jpd 4 28 3 1 . . . . . . . . A 7 . CG parsed_6jpd 4 28 3 2 . . . . . . . . A 9 . CB parsed_6jpd 4 28 4 1 . . . . . . . . A 8 . CB parsed_6jpd 4 28 4 2 . . . . . . . . A 17 . CB parsed_6jpd 4 28 5 1 . . . . . . . . A 7 . CG parsed_6jpd 4 28 5 2 . . . . . . . . A 17 . CB parsed_6jpd 4 29 2 1 . . . . . . . . A 8 . CA parsed_6jpd 4 29 2 2 . . . . . . . . A 9 . CD parsed_6jpd 4 29 3 1 . . . . . . . . A 10 . CA parsed_6jpd 4 29 3 2 . . . . . . . . A 9 . CD parsed_6jpd 4 29 4 1 . . . . . . . . A 8 . CA parsed_6jpd 4 29 4 2 . . . . . . . . A 12 . CG parsed_6jpd 4 29 5 1 . . . . . . . . A 10 . CA parsed_6jpd 4 29 5 2 . . . . . . . . A 12 . CG parsed_6jpd 4 30 2 1 . . . . . . . . A 9 . CA parsed_6jpd 4 30 2 2 . . . . . . . . A 11 . CA parsed_6jpd 4 30 3 1 . . . . . . . . A 9 . CA parsed_6jpd 4 30 3 2 . . . . . . . . A 16 . CB parsed_6jpd 4 30 4 1 . . . . . . . . A 14 . CA parsed_6jpd 4 30 4 2 . . . . . . . . A 11 . CA parsed_6jpd 4 30 5 1 . . . . . . . . A 14 . CA parsed_6jpd 4 30 5 2 . . . . . . . . A 16 . CB parsed_6jpd 4 31 2 1 . . . . . . . . A 9 . CD parsed_6jpd 4 31 2 2 . . . . . . . . A 16 . CB parsed_6jpd 4 31 3 1 . . . . . . . . A 12 . CG parsed_6jpd 4 31 3 2 . . . . . . . . A 16 . CB parsed_6jpd 4 31 4 1 . . . . . . . . A 9 . CD parsed_6jpd 4 31 4 2 . . . . . . . . A 11 . CA parsed_6jpd 4 31 5 1 . . . . . . . . A 12 . CG parsed_6jpd 4 31 5 2 . . . . . . . . A 11 . CA parsed_6jpd 4 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 1 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 1 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 2 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 2 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 3 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 3 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 4 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 4 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 5 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 5 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 6 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 6 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 7 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 7 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 8 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 8 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 9 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 9 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 10 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 10 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 11 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 11 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 12 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 12 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 13 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 13 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 14 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 14 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 15 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 15 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 16 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 16 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 17 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 17 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 18 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 18 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 19 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 19 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 20 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 20 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 21 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 21 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 22 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 22 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 23 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 23 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 23 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 23 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 24 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 24 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 24 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 25 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 25 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 25 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 26 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 26 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 26 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 26 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 26 6 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 27 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 27 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 27 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 27 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 28 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 28 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 28 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 28 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 29 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 29 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 29 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 29 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 30 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 30 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 30 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 30 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 31 2 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 31 3 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 31 4 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 31 5 . . . . . 5.50 3.00 8.00 parsed_6jpd 4 stop_ loop_ _Dist_constraint_comment_org.ID _Dist_constraint_comment_org.Comment_text _Dist_constraint_comment_org.Comment_begin_line _Dist_constraint_comment_org.Comment_begin_column _Dist_constraint_comment_org.Comment_end_line _Dist_constraint_comment_org.Comment_end_column _Dist_constraint_comment_org.Entry_ID _Dist_constraint_comment_org.Distance_constraint_list_ID 1 ; echo=false wrnlev=0 ; 2 1 3 16 parsed_6jpd 4 2 ; echo=false wrnlev=0 ; 102 1 103 16 parsed_6jpd 4 stop_ loop_ _Dist_constraint_parse_err.ID _Dist_constraint_parse_err.Content _Dist_constraint_parse_err.Begin_line _Dist_constraint_parse_err.Begin_column _Dist_constraint_parse_err.End_line _Dist_constraint_parse_err.End_column _Dist_constraint_parse_err.Entry_ID _Dist_constraint_parse_err.Distance_constraint_list_ID 1 "# Restraints file 4: DARR-TEDOR-ambig8_u.tbl" 1 1 1 44 parsed_6jpd 4 2 "# Restraints file 5: high_ambig_u_5.tbl" 101 1 101 39 parsed_6jpd 4 3 "# Restraints file 6: CDIH10.tbl" 154 92 154 122 parsed_6jpd 4 stop_ save_ save_CNS/XPLOR_dihedral_6 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_6jpd _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 6 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.4 -71.4 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_6jpd 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.8 164.8 . . 2 . N . 2 . CA . 2 . C . 3 . N parsed_6jpd 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.7 -7.3 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_6jpd 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.5 176.7 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_6jpd 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.0 -41.8 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_6jpd 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -188.6 -48.2 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_6jpd 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.9 198.9 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_6jpd 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21.4 91.4 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_6jpd 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6.7 76.7 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_6jpd 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.7 -94.1 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_6jpd 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.3 180.9 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_6jpd 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.0 -69.4 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_6jpd 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.6 176.6 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_6jpd 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -78.6 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_6jpd 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.5 159.5 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_6jpd 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.6 221.0 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_6jpd 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.0 -26.8 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_6jpd 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.2 192.2 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_6jpd 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 28.6 98.6 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_6jpd 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10.6 67.6 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_6jpd 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.2 -41.2 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_6jpd 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.8 -60.0 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_6jpd 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 74.8 181.2 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_6jpd 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.8 -60.8 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_6jpd 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.6 164.6 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_6jpd 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 86.0 182.8 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_6jpd 1 27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.2 -23.4 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_6jpd 1 28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.6 194.2 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_6jpd 1 29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.4 -26.4 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_6jpd 1 30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.4 182.4 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_6jpd 1 31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.4 -29.4 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_6jpd 1 32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.1 186.1 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_6jpd 1 33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.7 -51.5 . . 10 . n . 10 . ca . 10 . cb . 10 . cg1 parsed_6jpd 1 34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.2 -40.6 . . 13 . n . 13 . ca . 13 . cb . 13 . cg parsed_6jpd 1 35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81.2 -57.6 . . 14 . n . 14 . ca . 14 . cb . 14 . cg parsed_6jpd 1 36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 169.9 185.9 . . 16 . n . 16 . ca . 16 . cb . 16 . cg parsed_6jpd 1 37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.6 -160.6 . . 17 . n . 17 . ca . 17 . cb . 17 . cg1 parsed_6jpd 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 ; Phi/Psi Angles From 'Strong' TALOS-N Predictions (from CDIH4.tbl) and Chi: error margins are set to conservative default values of double the standard deviation observed in TALOS-N capped at a minimum of +/-20 degree. removed values not consistent with TALOS+ more than +/- 20 degree. add 15 degree error for the rest. remove ones with error bigger than 100 ; 1 1 4 142 parsed_6jpd 1 2 ; !chi !10 ; 77 1 79 7 parsed_6jpd 1 3 !13 82 3 82 7 parsed_6jpd 1 4 !14 85 3 85 7 parsed_6jpd 1 5 !16 89 3 89 7 parsed_6jpd 1 6 !17 92 3 92 7 parsed_6jpd 1 stop_ save_
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