NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
42472 | 1ywj | 6558 | cing | 2-parsed | STAR | distance | NOE | ambi | 51 |
data_1ywj_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1ywj _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_1ywj 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1ywj _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 1ywj "Master copy" parsed_1ywj stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1ywj _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 1ywj.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ywj 1 1 1ywj.mr . . XPLOR/CNS 2 distance NOE simple 770 parsed_1ywj 1 1 1ywj.mr . . XPLOR/CNS 3 distance NOE ambi 51 parsed_1ywj 1 1 1ywj.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1ywj 1 1 1ywj.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_1ywj 1 1 1ywj.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ywj 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1ywj _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _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 2 . OR parsed_1ywj 1 1 2 . 3 . parsed_1ywj 1 1 3 . 4 . parsed_1ywj 1 1 4 . . . parsed_1ywj 1 2 1 2 . OR parsed_1ywj 1 2 2 . 3 . parsed_1ywj 1 2 3 . 4 . parsed_1ywj 1 2 4 . . . parsed_1ywj 1 3 1 2 . OR parsed_1ywj 1 3 2 . 3 . parsed_1ywj 1 3 3 . . . parsed_1ywj 1 4 1 2 . OR parsed_1ywj 1 4 2 . 3 . parsed_1ywj 1 4 3 . . . parsed_1ywj 1 5 1 2 . OR parsed_1ywj 1 5 2 . 3 . parsed_1ywj 1 5 3 . . . parsed_1ywj 1 6 1 2 . OR parsed_1ywj 1 6 2 . 3 . parsed_1ywj 1 6 3 . . . parsed_1ywj 1 7 1 2 . OR parsed_1ywj 1 7 2 . 3 . parsed_1ywj 1 7 3 . . . parsed_1ywj 1 8 1 2 . OR parsed_1ywj 1 8 2 . 3 . parsed_1ywj 1 8 3 . . . parsed_1ywj 1 9 1 2 . OR parsed_1ywj 1 9 2 . 3 . parsed_1ywj 1 9 3 . 4 . parsed_1ywj 1 9 4 . . . parsed_1ywj 1 10 1 2 . OR parsed_1ywj 1 10 2 . 3 . parsed_1ywj 1 10 3 . . . parsed_1ywj 1 11 1 2 . OR parsed_1ywj 1 11 2 . 3 . parsed_1ywj 1 11 3 . . . parsed_1ywj 1 12 1 2 . OR parsed_1ywj 1 12 2 . 3 . parsed_1ywj 1 12 3 . . . parsed_1ywj 1 13 1 2 . OR parsed_1ywj 1 13 2 . 3 . parsed_1ywj 1 13 3 . . . parsed_1ywj 1 14 1 2 . OR parsed_1ywj 1 14 2 . 3 . parsed_1ywj 1 14 3 . . . parsed_1ywj 1 15 1 2 . OR parsed_1ywj 1 15 2 . 3 . parsed_1ywj 1 15 3 . . . parsed_1ywj 1 16 1 2 . OR parsed_1ywj 1 16 2 . 3 . parsed_1ywj 1 16 3 . . . parsed_1ywj 1 17 1 2 . OR parsed_1ywj 1 17 2 . 3 . parsed_1ywj 1 17 3 . . . parsed_1ywj 1 18 1 2 . OR parsed_1ywj 1 18 2 . 3 . parsed_1ywj 1 18 3 . 4 . parsed_1ywj 1 18 4 . . . parsed_1ywj 1 19 1 2 . OR parsed_1ywj 1 19 2 . 3 . parsed_1ywj 1 19 3 . . . parsed_1ywj 1 20 1 2 . OR parsed_1ywj 1 20 2 . 3 . parsed_1ywj 1 20 3 . . . parsed_1ywj 1 21 1 2 . OR parsed_1ywj 1 21 2 . 3 . parsed_1ywj 1 21 3 . . . parsed_1ywj 1 22 1 2 . OR parsed_1ywj 1 22 2 . 3 . parsed_1ywj 1 22 3 . . . parsed_1ywj 1 23 1 2 . OR parsed_1ywj 1 23 2 . 3 . parsed_1ywj 1 23 3 . . . parsed_1ywj 1 24 1 2 . OR parsed_1ywj 1 24 2 . 3 . parsed_1ywj 1 24 3 . . . parsed_1ywj 1 25 1 2 . OR parsed_1ywj 1 25 2 . 3 . parsed_1ywj 1 25 3 . . . parsed_1ywj 1 26 1 2 . OR parsed_1ywj 1 26 2 . 3 . parsed_1ywj 1 26 3 . . . parsed_1ywj 1 27 1 2 . OR parsed_1ywj 1 27 2 . 3 . parsed_1ywj 1 27 3 . . . parsed_1ywj 1 28 1 2 . OR parsed_1ywj 1 28 2 . 3 . parsed_1ywj 1 28 3 . . . parsed_1ywj 1 29 1 2 . OR parsed_1ywj 1 29 2 . 3 . parsed_1ywj 1 29 3 . . . parsed_1ywj 1 30 1 2 . OR parsed_1ywj 1 30 2 . 3 . parsed_1ywj 1 30 3 . . . parsed_1ywj 1 31 1 2 . OR parsed_1ywj 1 31 2 . 3 . parsed_1ywj 1 31 3 . 4 . parsed_1ywj 1 31 4 . . . parsed_1ywj 1 32 1 2 . OR parsed_1ywj 1 32 2 . 3 . parsed_1ywj 1 32 3 . . . parsed_1ywj 1 33 1 2 . OR parsed_1ywj 1 33 2 . 3 . parsed_1ywj 1 33 3 . . . parsed_1ywj 1 34 1 2 . OR parsed_1ywj 1 34 2 . 3 . parsed_1ywj 1 34 3 . . . parsed_1ywj 1 35 1 2 . OR parsed_1ywj 1 35 2 . 3 . parsed_1ywj 1 35 3 . . . parsed_1ywj 1 36 1 2 . OR parsed_1ywj 1 36 2 . 3 . parsed_1ywj 1 36 3 . . . parsed_1ywj 1 37 1 2 . OR parsed_1ywj 1 37 2 . 3 . parsed_1ywj 1 37 3 . . . parsed_1ywj 1 38 1 2 . OR parsed_1ywj 1 38 2 . 3 . parsed_1ywj 1 38 3 . . . parsed_1ywj 1 39 1 2 . OR parsed_1ywj 1 39 2 . 3 . parsed_1ywj 1 39 3 . . . parsed_1ywj 1 40 1 2 . OR parsed_1ywj 1 40 2 . 3 . parsed_1ywj 1 40 3 . 4 . parsed_1ywj 1 40 4 . . . parsed_1ywj 1 41 1 2 . OR parsed_1ywj 1 41 2 . 3 . parsed_1ywj 1 41 3 . . . parsed_1ywj 1 42 1 2 . OR parsed_1ywj 1 42 2 . 3 . parsed_1ywj 1 42 3 . . . parsed_1ywj 1 43 1 2 . OR parsed_1ywj 1 43 2 . 3 . parsed_1ywj 1 43 3 . . . parsed_1ywj 1 44 1 2 . OR parsed_1ywj 1 44 2 . 3 . parsed_1ywj 1 44 3 . . . parsed_1ywj 1 45 1 2 . OR parsed_1ywj 1 45 2 . 3 . parsed_1ywj 1 45 3 . . . parsed_1ywj 1 46 1 2 . OR parsed_1ywj 1 46 2 . 3 . parsed_1ywj 1 46 3 . . . parsed_1ywj 1 47 1 2 . OR parsed_1ywj 1 47 2 . 3 . parsed_1ywj 1 47 3 . . . parsed_1ywj 1 48 1 2 . OR parsed_1ywj 1 48 2 . 3 . parsed_1ywj 1 48 3 . . . parsed_1ywj 1 49 1 2 . OR parsed_1ywj 1 49 2 . 3 . parsed_1ywj 1 49 3 . . . parsed_1ywj 1 50 1 2 . OR parsed_1ywj 1 50 2 . 3 . parsed_1ywj 1 50 3 . . . parsed_1ywj 1 51 1 2 . OR parsed_1ywj 1 51 2 . 3 . parsed_1ywj 1 51 3 . . . parsed_1ywj 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 2 1 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 1 2 2 . . . . . . . . " " 23 . HB2 parsed_1ywj 1 1 3 1 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 1 3 2 . . . . . . . . " " 19 . HB1 parsed_1ywj 1 1 4 1 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 1 4 2 . . . . . . . . " " 4 . HB2 parsed_1ywj 1 2 2 1 . . . . . . . . " " 34 . HA parsed_1ywj 1 2 2 2 . . . . . . . . " " 33 . HB1 parsed_1ywj 1 2 3 1 . . . . . . . . " " 34 . HA parsed_1ywj 1 2 3 2 . . . . . . . . " " 36 . HB1 parsed_1ywj 1 2 4 1 . . . . . . . . " " 34 . HA parsed_1ywj 1 2 4 2 . . . . . . . . " " 35 . HB1 parsed_1ywj 1 3 2 1 . . . . . . . . " " 27 . HG2% parsed_1ywj 1 3 2 2 . . . . . . . . " " 26 . HA parsed_1ywj 1 3 3 1 . . . . . . . . " " 27 . HG2% parsed_1ywj 1 3 3 2 . . . . . . . . " " 19 . HA parsed_1ywj 1 4 2 1 . . . . . . . . " " 21 . HB1 parsed_1ywj 1 4 2 2 . . . . . . . . " " 25 . HA2 parsed_1ywj 1 4 3 1 . . . . . . . . " " 21 . HB1 parsed_1ywj 1 4 3 2 . . . . . . . . " " 23 . HD1 parsed_1ywj 1 5 2 1 . . . . . . . . " " 19 . HG1 parsed_1ywj 1 5 2 2 . . . . . . . . " " 28 . HA parsed_1ywj 1 5 3 1 . . . . . . . . " " 19 . HG1 parsed_1ywj 1 5 3 2 . . . . . . . . " " 18 . HA parsed_1ywj 1 6 2 1 . . . . . . . . " " 26 . HG2 parsed_1ywj 1 6 2 2 . . . . . . . . " " 4 . HD1 parsed_1ywj 1 6 3 1 . . . . . . . . " " 26 . HG2 parsed_1ywj 1 6 3 2 . . . . . . . . " " 39 . HB2 parsed_1ywj 1 7 2 1 . . . . . . . . " " 17 . HA parsed_1ywj 1 7 2 2 . . . . . . . . " " 18 . HG2% parsed_1ywj 1 7 3 1 . . . . . . . . " " 17 . HA parsed_1ywj 1 7 3 2 . . . . . . . . " " 42 . HB1 parsed_1ywj 1 8 2 1 . . . . . . . . " " 38 . HG2% parsed_1ywj 1 8 2 2 . . . . . . . . " " 17 . HE3 parsed_1ywj 1 8 3 1 . . . . . . . . " " 38 . HG2% parsed_1ywj 1 8 3 2 . . . . . . . . " " 39 . HD1 parsed_1ywj 1 9 2 1 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 9 2 2 . . . . . . . . " " 39 . HB1 parsed_1ywj 1 9 3 1 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 9 3 2 . . . . . . . . " " 23 . HD1 parsed_1ywj 1 9 4 1 . . . . . . . . " " 29 . HA parsed_1ywj 1 9 4 2 . . . . . . . . " " 16 . HB2 parsed_1ywj 1 10 2 1 . . . . . . . . " " 39 . HA parsed_1ywj 1 10 2 2 . . . . . . . . " " 4 . HB2 parsed_1ywj 1 10 3 1 . . . . . . . . " " 39 . HA parsed_1ywj 1 10 3 2 . . . . . . . . " " 40 . HB2 parsed_1ywj 1 11 2 1 . . . . . . . . " " 32 . HA parsed_1ywj 1 11 2 2 . . . . . . . . " " 35 . HB1 parsed_1ywj 1 11 3 1 . . . . . . . . " " 32 . HA parsed_1ywj 1 11 3 2 . . . . . . . . " " 36 . HB1 parsed_1ywj 1 12 2 1 . . . . . . . . " " 31 . HA parsed_1ywj 1 12 2 2 . . . . . . . . " " 30 . HD% parsed_1ywj 1 12 3 1 . . . . . . . . " " 31 . HA parsed_1ywj 1 12 3 2 . . . . . . . . " " 17 . HZ3 parsed_1ywj 1 13 2 1 . . . . . . . . " " 21 . HG1 parsed_1ywj 1 13 2 2 . . . . . . . . " " 25 . HA2 parsed_1ywj 1 13 3 1 . . . . . . . . " " 21 . HG1 parsed_1ywj 1 13 3 2 . . . . . . . . " " 23 . HD1 parsed_1ywj 1 14 2 1 . . . . . . . . " " 34 . HB parsed_1ywj 1 14 2 2 . . . . . . . . " " 17 . HH2 parsed_1ywj 1 14 3 1 . . . . . . . . " " 38 . HB parsed_1ywj 1 14 3 2 . . . . . . . . " " 17 . HH2 parsed_1ywj 1 15 2 1 . . . . . . . . " " 30 . HD% parsed_1ywj 1 15 2 2 . . . . . . . . " " 36 . HA parsed_1ywj 1 15 3 1 . . . . . . . . " " 30 . HD% parsed_1ywj 1 15 3 2 . . . . . . . . " " 31 . HA parsed_1ywj 1 16 2 1 . . . . . . . . " " 17 . HZ2 parsed_1ywj 1 16 2 2 . . . . . . . . " " 34 . HB parsed_1ywj 1 16 3 1 . . . . . . . . " " 17 . HZ2 parsed_1ywj 1 16 3 2 . . . . . . . . " " 38 . HB parsed_1ywj 1 17 2 1 . . . . . . . . " " 17 . HH2 parsed_1ywj 1 17 2 2 . . . . . . . . " " 40 . HG1 parsed_1ywj 1 17 3 1 . . . . . . . . " " 17 . HH2 parsed_1ywj 1 17 3 2 . . . . . . . . " " 31 . HB1 parsed_1ywj 1 18 2 1 . . . . . . . . " " 17 . HE3 parsed_1ywj 1 18 2 2 . . . . . . . . " " 31 . HB1 parsed_1ywj 1 18 3 1 . . . . . . . . " " 17 . HE3 parsed_1ywj 1 18 3 2 . . . . . . . . " " 40 . HG1 parsed_1ywj 1 18 4 1 . . . . . . . . " " 17 . HE3 parsed_1ywj 1 18 4 2 . . . . . . . . " " 42 . HD2 parsed_1ywj 1 19 2 1 . . . . . . . . " " 17 . HZ2 parsed_1ywj 1 19 2 2 . . . . . . . . " " 31 . HB1 parsed_1ywj 1 19 3 1 . . . . . . . . " " 17 . HZ2 parsed_1ywj 1 19 3 2 . . . . . . . . " " 40 . HG1 parsed_1ywj 1 20 2 1 . . . . . . . . " " 39 . HH2 parsed_1ywj 1 20 2 2 . . . . . . . . " " 28 . HB1 parsed_1ywj 1 20 3 1 . . . . . . . . " " 39 . HH2 parsed_1ywj 1 20 3 2 . . . . . . . . " " 23 . HB1 parsed_1ywj 1 21 2 1 . . . . . . . . " " 39 . HE3 parsed_1ywj 1 21 2 2 . . . . . . . . " " 26 . HG1 parsed_1ywj 1 21 3 1 . . . . . . . . " " 39 . HE3 parsed_1ywj 1 21 3 2 . . . . . . . . " " 4 . HG1 parsed_1ywj 1 22 2 1 . . . . . . . . " " 39 . HH2 parsed_1ywj 1 22 2 2 . . . . . . . . " " 26 . HD1 parsed_1ywj 1 22 3 1 . . . . . . . . " " 39 . HH2 parsed_1ywj 1 22 3 2 . . . . . . . . " " 24 . HB2 parsed_1ywj 1 23 2 1 . . . . . . . . " " 29 . HD% parsed_1ywj 1 23 2 2 . . . . . . . . " " 19 . HA parsed_1ywj 1 23 3 1 . . . . . . . . " " 29 . HD% parsed_1ywj 1 23 3 2 . . . . . . . . " " 40 . HA parsed_1ywj 1 24 2 1 . . . . . . . . " " 28 . HE% parsed_1ywj 1 24 2 2 . . . . . . . . " " 23 . HD1 parsed_1ywj 1 24 3 1 . . . . . . . . " " 28 . HE% parsed_1ywj 1 24 3 2 . . . . . . . . " " 39 . HB1 parsed_1ywj 1 25 2 1 . . . . . . . . " " 18 . HG2% parsed_1ywj 1 25 2 2 . . . . . . . . " " 19 . HA parsed_1ywj 1 25 3 1 . . . . . . . . " " 18 . HG2% parsed_1ywj 1 25 3 2 . . . . . . . . " " 16 . HA parsed_1ywj 1 26 2 1 . . . . . . . . " " 9 . HN parsed_1ywj 1 26 2 2 . . . . . . . . " " 4 . HB1 parsed_1ywj 1 26 3 1 . . . . . . . . " " 9 . HN parsed_1ywj 1 26 3 2 . . . . . . . . " " 40 . HB2 parsed_1ywj 1 27 2 1 . . . . . . . . " " 19 . HN parsed_1ywj 1 27 2 2 . . . . . . . . " " 18 . HN parsed_1ywj 1 27 3 1 . . . . . . . . " " 19 . HN parsed_1ywj 1 27 3 2 . . . . . . . . " " 30 . HN parsed_1ywj 1 28 2 1 . . . . . . . . " " 31 . HN parsed_1ywj 1 28 2 2 . . . . . . . . " " 17 . HZ3 parsed_1ywj 1 28 3 1 . . . . . . . . " " 31 . HN parsed_1ywj 1 28 3 2 . . . . . . . . " " 36 . HE22 parsed_1ywj 1 29 2 1 . . . . . . . . " " 15 . HN parsed_1ywj 1 29 2 2 . . . . . . . . " " 14 . HB1 parsed_1ywj 1 29 3 1 . . . . . . . . " " 15 . HN parsed_1ywj 1 29 3 2 . . . . . . . . " " 16 . HB2 parsed_1ywj 1 30 2 1 . . . . . . . . " " 27 . HN parsed_1ywj 1 30 2 2 . . . . . . . . " " 26 . HG1 parsed_1ywj 1 30 3 1 . . . . . . . . " " 27 . HN parsed_1ywj 1 30 3 2 . . . . . . . . " " 4 . HG1 parsed_1ywj 1 31 2 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 31 2 2 . . . . . . . . " " 16 . HB1 parsed_1ywj 1 31 3 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 31 3 2 . . . . . . . . " " 33 . HB1 parsed_1ywj 1 31 4 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 31 4 2 . . . . . . . . " " 16 . HE% parsed_1ywj 1 32 2 1 . . . . . . . . " " 20 . HN parsed_1ywj 1 32 2 2 . . . . . . . . " " 30 . HB1 parsed_1ywj 1 32 3 1 . . . . . . . . " " 20 . HN parsed_1ywj 1 32 3 2 . . . . . . . . " " 29 . HB2 parsed_1ywj 1 33 2 1 . . . . . . . . " " 30 . HN parsed_1ywj 1 33 2 2 . . . . . . . . " " 28 . HD% parsed_1ywj 1 33 3 1 . . . . . . . . " " 30 . HN parsed_1ywj 1 33 3 2 . . . . . . . . " " 29 . HD% parsed_1ywj 1 34 2 1 . . . . . . . . " " 24 . HN parsed_1ywj 1 34 2 2 . . . . . . . . " " 25 . HA2 parsed_1ywj 1 34 3 1 . . . . . . . . " " 24 . HN parsed_1ywj 1 34 3 2 . . . . . . . . " " 23 . HD1 parsed_1ywj 1 35 2 1 . . . . . . . . " " 12 . HN parsed_1ywj 1 35 2 2 . . . . . . . . " " 13 . HB% parsed_1ywj 1 35 3 1 . . . . . . . . " " 15 . HN parsed_1ywj 1 35 3 2 . . . . . . . . " " 14 . HG1 parsed_1ywj 1 36 2 1 . . . . . . . . " " 37 . HN parsed_1ywj 1 36 2 2 . . . . . . . . " " 35 . HN parsed_1ywj 1 36 3 1 . . . . . . . . " " 37 . HN parsed_1ywj 1 36 3 2 . . . . . . . . " " 39 . HE3 parsed_1ywj 1 37 2 1 . . . . . . . . " " 18 . HN parsed_1ywj 1 37 2 2 . . . . . . . . " " 29 . HB2 parsed_1ywj 1 37 3 1 . . . . . . . . " " 18 . HN parsed_1ywj 1 37 3 2 . . . . . . . . " " 30 . HB1 parsed_1ywj 1 38 2 1 . . . . . . . . " " 39 . HN parsed_1ywj 1 38 2 2 . . . . . . . . " " 40 . HB1 parsed_1ywj 1 38 3 1 . . . . . . . . " " 39 . HN parsed_1ywj 1 38 3 2 . . . . . . . . " " 4 . HB1 parsed_1ywj 1 39 2 1 . . . . . . . . " " 22 . HN parsed_1ywj 1 39 2 2 . . . . . . . . " " 26 . HB1 parsed_1ywj 1 39 3 1 . . . . . . . . " " 22 . HN parsed_1ywj 1 39 3 2 . . . . . . . . " " 19 . HG1 parsed_1ywj 1 40 2 1 . . . . . . . . " " 28 . HN parsed_1ywj 1 40 2 2 . . . . . . . . " " 21 . HG1 parsed_1ywj 1 40 3 1 . . . . . . . . " " 28 . HN parsed_1ywj 1 40 3 2 . . . . . . . . " " 8 . HB% parsed_1ywj 1 40 4 1 . . . . . . . . " " 28 . HN parsed_1ywj 1 40 4 2 . . . . . . . . " " 32 . HG2% parsed_1ywj 1 41 2 1 . . . . . . . . " " 28 . HN parsed_1ywj 1 41 2 2 . . . . . . . . " " 19 . HA parsed_1ywj 1 41 3 1 . . . . . . . . " " 28 . HN parsed_1ywj 1 41 3 2 . . . . . . . . " " 20 . HA parsed_1ywj 1 42 2 1 . . . . . . . . " " 38 . HN parsed_1ywj 1 42 2 2 . . . . . . . . " " 39 . HN parsed_1ywj 1 42 3 1 . . . . . . . . " " 38 . HN parsed_1ywj 1 42 3 2 . . . . . . . . " " 37 . HN parsed_1ywj 1 43 2 1 . . . . . . . . " " 22 . HN parsed_1ywj 1 43 2 2 . . . . . . . . " " 21 . HN parsed_1ywj 1 43 3 1 . . . . . . . . " " 22 . HN parsed_1ywj 1 43 3 2 . . . . . . . . " " 25 . HN parsed_1ywj 1 44 2 1 . . . . . . . . " " 18 . HN parsed_1ywj 1 44 2 2 . . . . . . . . " " 17 . HN parsed_1ywj 1 44 3 1 . . . . . . . . " " 18 . HN parsed_1ywj 1 44 3 2 . . . . . . . . " " 33 . HN parsed_1ywj 1 45 2 1 . . . . . . . . " " 19 . HN parsed_1ywj 1 45 2 2 . . . . . . . . " " 29 . HD% parsed_1ywj 1 45 3 1 . . . . . . . . " " 19 . HN parsed_1ywj 1 45 3 2 . . . . . . . . " " 28 . HD% parsed_1ywj 1 46 2 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 46 2 2 . . . . . . . . " " 18 . HA parsed_1ywj 1 46 3 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 46 3 2 . . . . . . . . " " 38 . HA parsed_1ywj 1 47 2 1 . . . . . . . . " " 17 . HE1 parsed_1ywj 1 47 2 2 . . . . . . . . " " 43 . HN parsed_1ywj 1 47 3 1 . . . . . . . . " " 17 . HE1 parsed_1ywj 1 47 3 2 . . . . . . . . " " 33 . HN parsed_1ywj 1 48 2 1 . . . . . . . . " " 20 . HN parsed_1ywj 1 48 2 2 . . . . . . . . " " 30 . HN parsed_1ywj 1 48 3 1 . . . . . . . . " " 20 . HN parsed_1ywj 1 48 3 2 . . . . . . . . " " 22 . HN parsed_1ywj 1 49 2 1 . . . . . . . . " " 30 . HN parsed_1ywj 1 49 2 2 . . . . . . . . " " 18 . HA parsed_1ywj 1 49 3 1 . . . . . . . . " " 30 . HN parsed_1ywj 1 49 3 2 . . . . . . . . " " 28 . HA parsed_1ywj 1 50 2 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 50 2 2 . . . . . . . . " " 30 . HD% parsed_1ywj 1 50 3 1 . . . . . . . . " " 32 . HN parsed_1ywj 1 50 3 2 . . . . . . . . " " 17 . HZ3 parsed_1ywj 1 51 2 1 . . . . . . . . " " 21 . HN parsed_1ywj 1 51 2 2 . . . . . . . . " " 28 . HD% parsed_1ywj 1 51 3 1 . . . . . . . . " " 21 . HN parsed_1ywj 1 51 3 2 . . . . . . . . " " 20 . HD2 parsed_1ywj 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 2 . 164 0.14898E-02 . . 3.500 0.000 6.000 parsed_1ywj 1 1 3 . 164 0.14898E-02 . . 3.500 0.000 6.000 parsed_1ywj 1 1 4 . 164 0.14898E-02 . . 3.500 0.000 6.000 parsed_1ywj 1 2 2 . 215 0.71457E-03 . . 3.900 2.000 5.800 parsed_1ywj 1 2 3 . 215 0.71457E-03 . . 3.900 2.000 5.800 parsed_1ywj 1 2 4 . 215 0.71457E-03 . . 3.900 2.000 5.800 parsed_1ywj 1 3 2 . 220 0.65523E-03 . . 4.500 1.900 6.000 parsed_1ywj 1 3 3 . 220 0.65523E-03 . . 4.500 1.900 6.000 parsed_1ywj 1 4 2 . 225 0.60007E-03 . . 3.400 2.000 4.800 parsed_1ywj 1 4 3 . 225 0.60007E-03 . . 3.400 2.000 4.800 parsed_1ywj 1 5 2 . 250 0.39729E-03 . . 3.900 2.000 5.800 parsed_1ywj 1 5 3 . 250 0.39729E-03 . . 3.900 2.000 5.800 parsed_1ywj 1 6 2 . 264 0.32417E-03 . . 4.900 2.000 6.000 parsed_1ywj 1 6 3 . 264 0.32417E-03 . . 4.900 2.000 6.000 parsed_1ywj 1 7 2 . 270 0.30210E-03 . . 4.500 2.000 6.000 parsed_1ywj 1 7 3 . 270 0.30210E-03 . . 4.500 2.000 6.000 parsed_1ywj 1 8 2 . 277 0.28141E-03 . . 4.900 2.000 6.000 parsed_1ywj 1 8 3 . 277 0.28141E-03 . . 4.900 2.000 6.000 parsed_1ywj 1 9 2 . 280 0.26899E-03 . . 4.600 1.900 6.000 parsed_1ywj 1 9 3 . 280 0.26899E-03 . . 4.600 1.900 6.000 parsed_1ywj 1 9 4 . 280 0.26899E-03 . . 4.600 1.900 6.000 parsed_1ywj 1 10 2 . 303 0.16553E-03 . . 5.200 1.800 6.000 parsed_1ywj 1 10 3 . 303 0.16553E-03 . . 5.200 1.800 6.000 parsed_1ywj 1 11 2 . 306 0.16415E-03 . . 5.000 1.800 6.000 parsed_1ywj 1 11 3 . 306 0.16415E-03 . . 5.000 1.800 6.000 parsed_1ywj 1 12 2 . 311 0.15588E-03 . . 4.800 1.900 6.000 parsed_1ywj 1 12 3 . 311 0.15588E-03 . . 4.800 1.900 6.000 parsed_1ywj 1 13 2 . 322 0.13311E-03 . . 4.800 1.900 6.000 parsed_1ywj 1 13 3 . 322 0.13311E-03 . . 4.800 1.900 6.000 parsed_1ywj 1 14 2 . 326 0.11505E-03 . . 5.600 1.700 6.000 parsed_1ywj 1 14 3 . 326 0.11505E-03 . . 5.600 1.700 6.000 parsed_1ywj 1 15 2 . 359 0.10829E-04 . . 6.000 0.000 6.000 parsed_1ywj 1 15 3 . 359 0.10829E-04 . . 6.000 0.000 6.000 parsed_1ywj 1 16 2 . 367 0.61111E-04 . . 5.500 1.700 6.000 parsed_1ywj 1 16 3 . 367 0.61111E-04 . . 5.500 1.700 6.000 parsed_1ywj 1 17 2 . 375 0.88835E-04 . . 5.200 1.900 6.000 parsed_1ywj 1 17 3 . 375 0.88835E-04 . . 5.200 1.900 6.000 parsed_1ywj 1 18 2 . 378 0.10070E-03 . . 5.700 1.700 6.000 parsed_1ywj 1 18 3 . 378 0.10070E-03 . . 5.700 1.700 6.000 parsed_1ywj 1 18 4 . 378 0.10070E-03 . . 5.700 1.700 6.000 parsed_1ywj 1 19 2 . 380 0.10318E-03 . . 5.300 1.800 6.000 parsed_1ywj 1 19 3 . 380 0.10318E-03 . . 5.300 1.800 6.000 parsed_1ywj 1 20 2 . 381 0.10677E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 20 3 . 381 0.10677E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 21 2 . 384 0.10760E-03 . . 4.300 2.000 6.000 parsed_1ywj 1 21 3 . 384 0.10760E-03 . . 4.300 2.000 6.000 parsed_1ywj 1 22 2 . 400 0.18484E-03 . . 4.400 2.000 6.000 parsed_1ywj 1 22 3 . 400 0.18484E-03 . . 4.400 2.000 6.000 parsed_1ywj 1 23 2 . 424 0.42487E-03 . . 4.300 1.900 6.000 parsed_1ywj 1 23 3 . 424 0.42487E-03 . . 4.300 1.900 6.000 parsed_1ywj 1 24 2 . 426 0.45521E-03 . . 3.300 1.900 4.700 parsed_1ywj 1 24 3 . 426 0.45521E-03 . . 3.300 1.900 4.700 parsed_1ywj 1 25 2 . 468 0.48003E-02 . . 2.700 0.000 6.000 parsed_1ywj 1 25 3 . 468 0.48003E-02 . . 2.700 0.000 6.000 parsed_1ywj 1 26 2 . 8 0.92214E-02 . . 2.900 0.000 6.000 parsed_1ywj 1 26 3 . 8 0.92214E-02 . . 2.900 0.000 6.000 parsed_1ywj 1 27 2 . 100 0.17256E-02 . . 3.500 2.000 5.000 parsed_1ywj 1 27 3 . 100 0.17256E-02 . . 3.500 2.000 5.000 parsed_1ywj 1 28 2 . 103 0.15909E-02 . . 3.300 1.900 4.700 parsed_1ywj 1 28 3 . 103 0.15909E-02 . . 3.300 1.900 4.700 parsed_1ywj 1 29 2 . 112 0.14021E-02 . . 3.400 1.900 4.900 parsed_1ywj 1 29 3 . 112 0.14021E-02 . . 3.400 1.900 4.900 parsed_1ywj 1 30 2 . 115 0.13428E-02 . . 3.500 2.000 5.000 parsed_1ywj 1 30 3 . 115 0.13428E-02 . . 3.500 2.000 5.000 parsed_1ywj 1 31 2 . 120 0.12565E-02 . . 4.000 2.000 6.000 parsed_1ywj 1 31 3 . 120 0.12565E-02 . . 4.000 2.000 6.000 parsed_1ywj 1 31 4 . 120 0.12565E-02 . . 4.000 2.000 6.000 parsed_1ywj 1 32 2 . 138 0.10084E-02 . . 4.100 2.000 6.000 parsed_1ywj 1 32 3 . 138 0.10084E-02 . . 4.100 2.000 6.000 parsed_1ywj 1 33 2 . 141 0.97067E-03 . . 3.800 2.000 5.600 parsed_1ywj 1 33 3 . 141 0.97067E-03 . . 3.800 2.000 5.600 parsed_1ywj 1 34 2 . 143 0.97067E-03 . . 4.600 1.900 6.000 parsed_1ywj 1 34 3 . 143 0.97067E-03 . . 4.600 1.900 6.000 parsed_1ywj 1 35 2 . 149 0.87901E-03 . . 4.000 2.000 6.000 parsed_1ywj 1 35 3 . 149 0.87901E-03 . . 4.000 2.000 6.000 parsed_1ywj 1 36 2 . 182 0.66868E-03 . . 3.100 0.000 6.000 parsed_1ywj 1 36 3 . 182 0.66868E-03 . . 3.100 0.000 6.000 parsed_1ywj 1 37 2 . 184 0.64711E-03 . . 3.500 1.900 5.100 parsed_1ywj 1 37 3 . 184 0.64711E-03 . . 3.500 1.900 5.100 parsed_1ywj 1 38 2 . 203 0.52147E-03 . . 3.800 2.000 5.600 parsed_1ywj 1 38 3 . 203 0.52147E-03 . . 3.800 2.000 5.600 parsed_1ywj 1 39 2 . 212 0.45678E-03 . . 5.000 1.800 6.000 parsed_1ywj 1 39 3 . 212 0.45678E-03 . . 5.000 1.800 6.000 parsed_1ywj 1 40 2 . 231 0.34783E-03 . . 3.400 0.000 6.000 parsed_1ywj 1 40 3 . 231 0.34783E-03 . . 3.400 0.000 6.000 parsed_1ywj 1 40 4 . 231 0.34783E-03 . . 3.400 0.000 6.000 parsed_1ywj 1 41 2 . 234 0.33111E-03 . . 4.700 1.900 6.000 parsed_1ywj 1 41 3 . 234 0.33111E-03 . . 4.700 1.900 6.000 parsed_1ywj 1 42 2 . 241 0.29714E-03 . . 4.700 2.000 6.000 parsed_1ywj 1 42 3 . 241 0.29714E-03 . . 4.700 2.000 6.000 parsed_1ywj 1 43 2 . 245 0.28204E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 43 3 . 245 0.28204E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 44 2 . 249 0.26478E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 44 3 . 249 0.26478E-03 . . 5.000 1.900 6.000 parsed_1ywj 1 45 2 . 259 0.23782E-03 . . 5.400 1.700 6.000 parsed_1ywj 1 45 3 . 259 0.23782E-03 . . 5.400 1.700 6.000 parsed_1ywj 1 46 2 . 262 0.22272E-03 . . 3.500 0.000 6.000 parsed_1ywj 1 46 3 . 262 0.22272E-03 . . 3.500 0.000 6.000 parsed_1ywj 1 47 2 . 273 0.19683E-03 . . 4.800 2.000 6.000 parsed_1ywj 1 47 3 . 273 0.19683E-03 . . 4.800 2.000 6.000 parsed_1ywj 1 48 2 . 282 0.18443E-03 . . 5.500 1.800 6.000 parsed_1ywj 1 48 3 . 282 0.18443E-03 . . 5.500 1.800 6.000 parsed_1ywj 1 49 2 . 292 0.16933E-03 . . 5.100 1.900 6.000 parsed_1ywj 1 49 3 . 292 0.16933E-03 . . 5.100 1.900 6.000 parsed_1ywj 1 50 2 . 301 0.14938E-03 . . 5.200 1.800 6.000 parsed_1ywj 1 50 3 . 301 0.14938E-03 . . 5.200 1.800 6.000 parsed_1ywj 1 51 2 . 320 0.83047E-04 . . 6.000 0.900 6.000 parsed_1ywj 1 51 3 . 320 0.83047E-04 . . 6.000 0.900 6.000 parsed_1ywj 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 1 164 4 7 4 7 parsed_1ywj 1 2 164 8 5 8 5 parsed_1ywj 1 3 164 11 5 11 5 parsed_1ywj 1 4 "Ambiguous distance restraints" 2 1 2 32 parsed_1ywj 1 5 215 14 7 14 7 parsed_1ywj 1 6 215 18 5 18 5 parsed_1ywj 1 7 215 21 5 21 5 parsed_1ywj 1 8 220 24 7 24 7 parsed_1ywj 1 9 220 28 5 28 5 parsed_1ywj 1 10 225 31 7 31 7 parsed_1ywj 1 11 225 35 5 35 5 parsed_1ywj 1 12 250 38 7 38 7 parsed_1ywj 1 13 250 42 5 42 5 parsed_1ywj 1 14 264 45 7 45 7 parsed_1ywj 1 15 264 49 5 49 5 parsed_1ywj 1 16 270 52 7 52 7 parsed_1ywj 1 17 270 56 5 56 5 parsed_1ywj 1 18 277 59 7 59 7 parsed_1ywj 1 19 277 63 5 63 5 parsed_1ywj 1 20 280 66 7 66 7 parsed_1ywj 1 21 280 70 5 70 5 parsed_1ywj 1 22 287 77 5 77 5 parsed_1ywj 1 23 ; ASSI { 287} (( segid " " and resid 29 and name HA )) (( segid " " and resid 4 and name HB1 )) 4.100 2.100 1.900 peak 287 spectrum 1 weight 0.10000E+01 volume 0.22899E-03 ppm1 5.305 ppm2 1.840 CV 1 ; 73 1 76 139 parsed_1ywj 1 24 303 80 7 80 7 parsed_1ywj 1 25 303 84 5 84 5 parsed_1ywj 1 26 306 87 7 87 7 parsed_1ywj 1 27 306 91 5 91 5 parsed_1ywj 1 28 311 94 7 94 7 parsed_1ywj 1 29 311 98 5 98 5 parsed_1ywj 1 30 322 101 7 101 7 parsed_1ywj 1 31 322 105 5 105 5 parsed_1ywj 1 32 326 108 7 108 7 parsed_1ywj 1 33 326 112 5 112 5 parsed_1ywj 1 34 359 115 7 115 7 parsed_1ywj 1 35 359 119 5 119 5 parsed_1ywj 1 36 367 122 7 122 7 parsed_1ywj 1 37 367 126 5 126 5 parsed_1ywj 1 38 375 129 7 129 7 parsed_1ywj 1 39 375 133 5 133 5 parsed_1ywj 1 40 378 136 7 136 7 parsed_1ywj 1 41 378 140 5 140 5 parsed_1ywj 1 42 378 143 5 143 5 parsed_1ywj 1 43 380 146 7 146 7 parsed_1ywj 1 44 380 150 5 150 5 parsed_1ywj 1 45 381 153 7 153 7 parsed_1ywj 1 46 381 157 5 157 5 parsed_1ywj 1 47 384 160 7 160 7 parsed_1ywj 1 48 384 164 5 164 5 parsed_1ywj 1 49 400 167 7 167 7 parsed_1ywj 1 50 400 171 5 171 5 parsed_1ywj 1 51 424 174 7 174 7 parsed_1ywj 1 52 424 178 5 178 5 parsed_1ywj 1 53 426 181 7 181 7 parsed_1ywj 1 54 426 185 5 185 5 parsed_1ywj 1 55 468 188 7 188 7 parsed_1ywj 1 56 468 192 5 192 5 parsed_1ywj 1 57 8 195 7 195 7 parsed_1ywj 1 58 8 199 5 199 5 parsed_1ywj 1 59 100 202 7 202 7 parsed_1ywj 1 60 100 206 5 206 5 parsed_1ywj 1 61 103 209 7 209 7 parsed_1ywj 1 62 103 213 5 213 5 parsed_1ywj 1 63 112 216 7 216 7 parsed_1ywj 1 64 112 220 5 220 5 parsed_1ywj 1 65 115 223 7 223 7 parsed_1ywj 1 66 115 227 5 227 5 parsed_1ywj 1 67 120 230 7 230 7 parsed_1ywj 1 68 120 234 5 234 5 parsed_1ywj 1 69 120 237 5 237 5 parsed_1ywj 1 70 138 240 7 240 7 parsed_1ywj 1 71 138 244 5 244 5 parsed_1ywj 1 72 141 247 7 247 7 parsed_1ywj 1 73 141 251 5 251 5 parsed_1ywj 1 74 143 254 7 254 7 parsed_1ywj 1 75 143 258 5 258 5 parsed_1ywj 1 76 149 261 7 261 7 parsed_1ywj 1 77 149 265 5 265 5 parsed_1ywj 1 78 182 268 7 268 7 parsed_1ywj 1 79 182 272 5 272 5 parsed_1ywj 1 80 184 275 7 275 7 parsed_1ywj 1 81 184 279 5 279 5 parsed_1ywj 1 82 203 282 7 282 7 parsed_1ywj 1 83 203 286 5 286 5 parsed_1ywj 1 84 212 289 7 289 7 parsed_1ywj 1 85 212 293 5 293 5 parsed_1ywj 1 86 231 296 7 296 7 parsed_1ywj 1 87 231 300 5 300 5 parsed_1ywj 1 88 231 303 5 303 5 parsed_1ywj 1 89 234 306 7 306 7 parsed_1ywj 1 90 234 310 5 310 5 parsed_1ywj 1 91 241 313 7 313 7 parsed_1ywj 1 92 241 317 5 317 5 parsed_1ywj 1 93 245 320 7 320 7 parsed_1ywj 1 94 245 324 5 324 5 parsed_1ywj 1 95 249 327 7 327 7 parsed_1ywj 1 96 249 331 5 331 5 parsed_1ywj 1 97 259 334 7 334 7 parsed_1ywj 1 98 259 338 5 338 5 parsed_1ywj 1 99 262 341 7 341 7 parsed_1ywj 1 100 262 345 5 345 5 parsed_1ywj 1 101 273 348 7 348 7 parsed_1ywj 1 102 273 352 5 352 5 parsed_1ywj 1 103 282 355 7 355 7 parsed_1ywj 1 104 282 359 5 359 5 parsed_1ywj 1 105 292 362 7 362 7 parsed_1ywj 1 106 292 366 5 366 5 parsed_1ywj 1 107 301 369 7 369 7 parsed_1ywj 1 108 301 373 5 373 5 parsed_1ywj 1 109 320 376 7 376 7 parsed_1ywj 1 110 320 380 5 380 5 parsed_1ywj 1 stop_ save_
Contact the webmaster for help, if required. Saturday, June 8, 2024 7:18:47 AM GMT (wattos1)