NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
30004 | 1bnx | cing | 2-parsed | STAR | entry | full | 255 |
data_1bnx_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_1bnx _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_1bnx 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_1bnx _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 1bnx "Master copy" parsed_1bnx stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_1bnx _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 1bnx.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 26 parsed_1bnx 1 1 1bnx.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . XPLOR/CNS 5 distance NOE simple 67 parsed_1bnx 1 1 1bnx.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . XPLOR/CNS 7 distance NOE simple 30 parsed_1bnx 1 1 1bnx.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . XPLOR/CNS 9 distance NOE simple 112 parsed_1bnx 1 1 1bnx.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . XPLOR/CNS 11 distance "hydrogen bond" simple 20 parsed_1bnx 1 1 1bnx.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1bnx 1 1 1bnx.mr . . "MR format" 13 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bnx 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_1bnx _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 ELECTRON TRANSPORT 30-JUL-98 1BNX *TITLE STRUCTURAL STUDIES ON THE EFFECTS OF THE DELETION IN THE *TITLE 2 RED CELL ANION EXCHANGER (BAND3, AE1) ASSOCIATED WITH SOUTH *TITLE 3 EAST ASIAN OVALOCYTOSIS. *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: BAND 3; *COMPND 3 CHAIN: A; *COMPND 4 FRAGMENT: C-TERMINAL CYTOPLASM/FIRST MEMBRANE SPAN; *COMPND 5 SYNONYM: SAO, ANION EXCHANGE PROTEIN 1; *COMPND 6 ENGINEERED: YES; *COMPND 7 MUTATION: YES; *COMPND 8 OTHER_DETAILS: PEPTIDE CORRESPONDS TO THE SECTION R-389 -K- *COMPND 9 430 IN THE SAO MUTANT OF HUMAN BAND 3. *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 OTHER_DETAILS: SYNTHESIZED USING FMOC PEPTIDE STRATEGY. *KEYWDS HUMAN ERYTHROCYTE ANION TRANSPORTER, TRANSMEMBRANE, *KEYWDS 2 SYNTHETIC PEPTIDE, NMR *EXPDTA NMR, 21 STRUCTURES *AUTHOR E.J.CHAMBERS, G.B.BLOOMBERG, S.M.RING, M.J.A.TANNER *REVDAT 2 22-DEC-99 1BNX 4 HEADER COMPND REMARK JRNL *REVDAT 2 2 4 ATOM SOURCE SEQRES *REVDAT 1 05-AUG-98 1BNX 0 ; save_ save_MR_file_comment_2 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 2 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 2 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; set message=off echo=off end restraints dihedral reset ; save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_1bnx _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 3 _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 4 . c . 5 . n . 5 . ca . 5 . c parsed_1bnx 1 2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1bnx 1 3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1bnx 1 4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_1bnx 1 5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1bnx 1 6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -35.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1bnx 1 7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1bnx 1 8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1bnx 1 9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1bnx 1 10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_1bnx 1 11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 14 . c . 15 . n . 15 . ca . 15 . c parsed_1bnx 1 12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1bnx 1 13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_1bnx 1 14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1bnx 1 15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1bnx 1 16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1bnx 1 17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -35.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1bnx 1 18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1bnx 1 19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1bnx 1 20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 24 . c . 25 . n . 25 . ca . 25 . c parsed_1bnx 1 21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1bnx 1 22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1bnx 1 23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_1bnx 1 24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1bnx 1 25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 32 . c . 33 . n . 33 . ca . 33 . c parsed_1bnx 1 26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 33 . c . 34 . n . 34 . ca . 34 . c parsed_1bnx 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 ; /mtgraf/usr/people/chambers/xplor31/xplor31/ovd1r/refineIII/ovd1r_dihe_ref3.tbl phi restraints assign (resid 1 and name c ) (resid 2 and name n ) (resid 2 and name ca) (resid 2 and name c ) 1.0 -70.0 35.0 2 assign (resid 2 and name c ) (resid 3 and name n ) (resid 3 and name ca) (resid 3 and name c ) 1.0 -60.0 35.0 2 ; 1 1 6 81 parsed_1bnx 1 stop_ save_ save_MR_file_comment_4 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 3 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 4 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; end set message=on echo=on end set message=off echo=off end clas seq ; save_ save_CNS/XPLOR_distance_constraints_5 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1bnx _Distance_constraint_list.ID 1 _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 . . . parsed_1bnx 1 2 1 . . . parsed_1bnx 1 3 1 . . . parsed_1bnx 1 4 1 . . . parsed_1bnx 1 5 1 . . . parsed_1bnx 1 6 1 . . . parsed_1bnx 1 7 1 . . . parsed_1bnx 1 8 1 . . . parsed_1bnx 1 9 1 . . . parsed_1bnx 1 10 1 . . . parsed_1bnx 1 11 1 . . . parsed_1bnx 1 12 1 . . . parsed_1bnx 1 13 1 . . . parsed_1bnx 1 14 1 . . . parsed_1bnx 1 15 1 . . . parsed_1bnx 1 16 1 . . . parsed_1bnx 1 17 1 . . . parsed_1bnx 1 18 1 . . . parsed_1bnx 1 19 1 . . . parsed_1bnx 1 20 1 . . . parsed_1bnx 1 21 1 . . . parsed_1bnx 1 22 1 . . . parsed_1bnx 1 23 1 . . . parsed_1bnx 1 24 1 . . . parsed_1bnx 1 25 1 . . . parsed_1bnx 1 26 1 . . . parsed_1bnx 1 27 1 . . . parsed_1bnx 1 28 1 . . . parsed_1bnx 1 29 1 . . . parsed_1bnx 1 30 1 . . . parsed_1bnx 1 31 1 . . . parsed_1bnx 1 32 1 . . . parsed_1bnx 1 33 1 . . . parsed_1bnx 1 34 1 . . . parsed_1bnx 1 35 1 . . . parsed_1bnx 1 36 1 . . . parsed_1bnx 1 37 1 . . . parsed_1bnx 1 38 1 . . . parsed_1bnx 1 39 1 . . . parsed_1bnx 1 40 1 . . . parsed_1bnx 1 41 1 . . . parsed_1bnx 1 42 1 . . . parsed_1bnx 1 43 1 . . . parsed_1bnx 1 44 1 . . . parsed_1bnx 1 45 1 . . . parsed_1bnx 1 46 1 . . . parsed_1bnx 1 47 1 . . . parsed_1bnx 1 48 1 . . . parsed_1bnx 1 49 1 . . . parsed_1bnx 1 50 1 . . . parsed_1bnx 1 51 1 . . . parsed_1bnx 1 52 1 . . . parsed_1bnx 1 53 1 . . . parsed_1bnx 1 54 1 . . . parsed_1bnx 1 55 1 . . . parsed_1bnx 1 56 1 . . . parsed_1bnx 1 57 1 . . . parsed_1bnx 1 58 1 . . . parsed_1bnx 1 59 1 . . . parsed_1bnx 1 60 1 . . . parsed_1bnx 1 61 1 . . . parsed_1bnx 1 62 1 . . . parsed_1bnx 1 63 1 . . . parsed_1bnx 1 64 1 . . . parsed_1bnx 1 65 1 . . . parsed_1bnx 1 66 1 . . . parsed_1bnx 1 67 1 . . . parsed_1bnx 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 . . . . . . . . . 2 . HN parsed_1bnx 1 1 1 2 . . . . . . . . . 3 . HN parsed_1bnx 1 2 1 1 . . . . . . . . . 5 . HN parsed_1bnx 1 2 1 2 . . . . . . . . . 6 . HN parsed_1bnx 1 3 1 1 . . . . . . . . . 6 . HN parsed_1bnx 1 3 1 2 . . . . . . . . . 7 . HN parsed_1bnx 1 4 1 1 . . . . . . . . . 10 . HN parsed_1bnx 1 4 1 2 . . . . . . . . . 11 . HN parsed_1bnx 1 5 1 1 . . . . . . . . . 11 . HN parsed_1bnx 1 5 1 2 . . . . . . . . . 12 . HN parsed_1bnx 1 6 1 1 . . . . . . . . . 12 . HN parsed_1bnx 1 6 1 2 . . . . . . . . . 13 . HN parsed_1bnx 1 7 1 1 . . . . . . . . . 13 . HN parsed_1bnx 1 7 1 2 . . . . . . . . . 14 . HN parsed_1bnx 1 8 1 1 . . . . . . . . . 14 . HN parsed_1bnx 1 8 1 2 . . . . . . . . . 15 . HN parsed_1bnx 1 9 1 1 . . . . . . . . . 17 . HN parsed_1bnx 1 9 1 2 . . . . . . . . . 18 . HN parsed_1bnx 1 10 1 1 . . . . . . . . . 18 . HN parsed_1bnx 1 10 1 2 . . . . . . . . . 19 . HN parsed_1bnx 1 11 1 1 . . . . . . . . . 19 . HN parsed_1bnx 1 11 1 2 . . . . . . . . . 20 . HN parsed_1bnx 1 12 1 1 . . . . . . . . . 20 . HN parsed_1bnx 1 12 1 2 . . . . . . . . . 21 . HN parsed_1bnx 1 13 1 1 . . . . . . . . . 21 . HN parsed_1bnx 1 13 1 2 . . . . . . . . . 22 . HN parsed_1bnx 1 14 1 1 . . . . . . . . . 24 . HN parsed_1bnx 1 14 1 2 . . . . . . . . . 25 . HN parsed_1bnx 1 15 1 1 . . . . . . . . . 25 . HN parsed_1bnx 1 15 1 2 . . . . . . . . . 26 . HN parsed_1bnx 1 16 1 1 . . . . . . . . . 26 . HN parsed_1bnx 1 16 1 2 . . . . . . . . . 27 . HN parsed_1bnx 1 17 1 1 . . . . . . . . . 29 . HN parsed_1bnx 1 17 1 2 . . . . . . . . . 30 . HN parsed_1bnx 1 18 1 1 . . . . . . . . . 31 . HN parsed_1bnx 1 18 1 2 . . . . . . . . . 32 . HN parsed_1bnx 1 19 1 1 . . . . . . . . . 33 . HN parsed_1bnx 1 19 1 2 . . . . . . . . . 34 . HN parsed_1bnx 1 20 1 1 . . . . . . . . . 2 . HA parsed_1bnx 1 20 1 2 . . . . . . . . . 3 . HN parsed_1bnx 1 21 1 1 . . . . . . . . . 4 . HA parsed_1bnx 1 21 1 2 . . . . . . . . . 5 . HN parsed_1bnx 1 22 1 1 . . . . . . . . . 5 . HA parsed_1bnx 1 22 1 2 . . . . . . . . . 6 . HN parsed_1bnx 1 23 1 1 . . . . . . . . . 6 . HA parsed_1bnx 1 23 1 2 . . . . . . . . . 7 . HN parsed_1bnx 1 24 1 1 . . . . . . . . . 8 . HA parsed_1bnx 1 24 1 2 . . . . . . . . . 9 . HN parsed_1bnx 1 25 1 1 . . . . . . . . . 9 . HA parsed_1bnx 1 25 1 2 . . . . . . . . . 10 . HN parsed_1bnx 1 26 1 1 . . . . . . . . . 12 . HA parsed_1bnx 1 26 1 2 . . . . . . . . . 13 . HN parsed_1bnx 1 27 1 1 . . . . . . . . . 14 . HA parsed_1bnx 1 27 1 2 . . . . . . . . . 15 . HN parsed_1bnx 1 28 1 1 . . . . . . . . . 16 . HA parsed_1bnx 1 28 1 2 . . . . . . . . . 17 . HN parsed_1bnx 1 29 1 1 . . . . . . . . . 18 . HA parsed_1bnx 1 29 1 2 . . . . . . . . . 19 . HN parsed_1bnx 1 30 1 1 . . . . . . . . . 19 . HA parsed_1bnx 1 30 1 2 . . . . . . . . . 20 . HN parsed_1bnx 1 31 1 1 . . . . . . . . . 20 . HA parsed_1bnx 1 31 1 2 . . . . . . . . . 21 . HN parsed_1bnx 1 32 1 1 . . . . . . . . . 21 . HA parsed_1bnx 1 32 1 2 . . . . . . . . . 22 . HN parsed_1bnx 1 33 1 1 . . . . . . . . . 25 . HA parsed_1bnx 1 33 1 2 . . . . . . . . . 26 . HN parsed_1bnx 1 34 1 1 . . . . . . . . . 32 . HA1 parsed_1bnx 1 34 1 2 . . . . . . . . . 33 . HN parsed_1bnx 1 35 1 1 . . . . . . . . . 32 . HA2 parsed_1bnx 1 35 1 2 . . . . . . . . . 33 . HN parsed_1bnx 1 36 1 1 . . . . . . . . . 33 . HA parsed_1bnx 1 36 1 2 . . . . . . . . . 34 . HN parsed_1bnx 1 37 1 1 . . . . . . . . . 2 . HB* parsed_1bnx 1 37 1 2 . . . . . . . . . 3 . HN parsed_1bnx 1 38 1 1 . . . . . . . . . 4 . HB1 parsed_1bnx 1 38 1 2 . . . . . . . . . 5 . HN parsed_1bnx 1 39 1 1 . . . . . . . . . 5 . HB* parsed_1bnx 1 39 1 2 . . . . . . . . . 6 . HN parsed_1bnx 1 40 1 1 . . . . . . . . . 6 . HB* parsed_1bnx 1 40 1 2 . . . . . . . . . 7 . HN parsed_1bnx 1 41 1 1 . . . . . . . . . 7 . HB* parsed_1bnx 1 41 1 2 . . . . . . . . . 8 . HN parsed_1bnx 1 42 1 1 . . . . . . . . . 8 . HB* parsed_1bnx 1 42 1 2 . . . . . . . . . 9 . HN parsed_1bnx 1 43 1 1 . . . . . . . . . 9 . HB* parsed_1bnx 1 43 1 2 . . . . . . . . . 10 . HN parsed_1bnx 1 44 1 1 . . . . . . . . . 10 . HB parsed_1bnx 1 44 1 2 . . . . . . . . . 11 . HN parsed_1bnx 1 45 1 1 . . . . . . . . . 11 . HB parsed_1bnx 1 45 1 2 . . . . . . . . . 12 . HN parsed_1bnx 1 46 1 1 . . . . . . . . . 12 . HB2 parsed_1bnx 1 46 1 2 . . . . . . . . . 13 . HN parsed_1bnx 1 47 1 1 . . . . . . . . . 12 . HB1 parsed_1bnx 1 47 1 2 . . . . . . . . . 13 . HN parsed_1bnx 1 48 1 1 . . . . . . . . . 13 . HB parsed_1bnx 1 48 1 2 . . . . . . . . . 14 . HN parsed_1bnx 1 49 1 1 . . . . . . . . . 14 . HB parsed_1bnx 1 49 1 2 . . . . . . . . . 15 . HN parsed_1bnx 1 50 1 1 . . . . . . . . . 15 . HB* parsed_1bnx 1 50 1 2 . . . . . . . . . 16 . HN parsed_1bnx 1 51 1 1 . . . . . . . . . 16 . HB parsed_1bnx 1 51 1 2 . . . . . . . . . 17 . HN parsed_1bnx 1 52 1 1 . . . . . . . . . 17 . HB* parsed_1bnx 1 52 1 2 . . . . . . . . . 18 . HN parsed_1bnx 1 53 1 1 . . . . . . . . . 18 . HB1 parsed_1bnx 1 53 1 2 . . . . . . . . . 19 . HN parsed_1bnx 1 54 1 1 . . . . . . . . . 18 . HB2 parsed_1bnx 1 54 1 2 . . . . . . . . . 19 . HN parsed_1bnx 1 55 1 1 . . . . . . . . . 19 . HB* parsed_1bnx 1 55 1 2 . . . . . . . . . 20 . HN parsed_1bnx 1 56 1 1 . . . . . . . . . 20 . HB* parsed_1bnx 1 56 1 2 . . . . . . . . . 21 . HN parsed_1bnx 1 57 1 1 . . . . . . . . . 21 . HB* parsed_1bnx 1 57 1 2 . . . . . . . . . 22 . HN parsed_1bnx 1 58 1 1 . . . . . . . . . 23 . HB1 parsed_1bnx 1 58 1 2 . . . . . . . . . 24 . HN parsed_1bnx 1 59 1 1 . . . . . . . . . 24 . HB* parsed_1bnx 1 59 1 2 . . . . . . . . . 25 . HN parsed_1bnx 1 60 1 1 . . . . . . . . . 25 . HB parsed_1bnx 1 60 1 2 . . . . . . . . . 26 . HN parsed_1bnx 1 61 1 1 . . . . . . . . . 26 . HB parsed_1bnx 1 61 1 2 . . . . . . . . . 27 . HN parsed_1bnx 1 62 1 1 . . . . . . . . . 31 . HB* parsed_1bnx 1 62 1 2 . . . . . . . . . 32 . HN parsed_1bnx 1 63 1 1 . . . . . . . . . 33 . HB* parsed_1bnx 1 63 1 2 . . . . . . . . . 34 . HN parsed_1bnx 1 64 1 1 . . . . . . . . . 3 . HA parsed_1bnx 1 64 1 2 . . . . . . . . . 4 . HD* parsed_1bnx 1 65 1 1 . . . . . . . . . 3 . HN parsed_1bnx 1 65 1 2 . . . . . . . . . 4 . HD* parsed_1bnx 1 66 1 1 . . . . . . . . . 23 . HA parsed_1bnx 1 66 1 2 . . . . . . . . . 24 . HD* parsed_1bnx 1 67 1 1 . . . . . . . . . 23 . HN parsed_1bnx 1 67 1 2 . . . . . . . . . 24 . HD* parsed_1bnx 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 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 2 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 3 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 4 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 5 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 6 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 7 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 8 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 9 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 10 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 11 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 12 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 13 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 14 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 15 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 16 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 17 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 18 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 19 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 20 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 21 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 22 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 23 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 24 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 25 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 26 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 27 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 28 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 29 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 30 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 31 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 32 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 33 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 34 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 35 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 36 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 37 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 38 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 39 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 40 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 41 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 42 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 43 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 44 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 45 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 46 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 47 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 48 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 49 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 50 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 51 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 52 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 53 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 54 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 55 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 56 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 57 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 58 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 59 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 60 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 61 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 1 62 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 63 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 64 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 1 65 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 66 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 1 67 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 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 ; /mtgraf/usr/people/chambers/xplor31/xplor31/ovd1r/refshx_noe.tbl HN(i)-HN(i+1) ; 1 1 2 81 parsed_1bnx 1 2 HA(i)-HN(i+1) 22 1 22 81 parsed_1bnx 1 3 HB(i)-HN(i+1) 40 1 40 81 parsed_1bnx 1 4 "misc pro" 68 1 68 81 parsed_1bnx 1 stop_ save_ save_MR_file_comment_6 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 4 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 6 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment "clas short " save_ save_CNS/XPLOR_distance_constraints_7 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1bnx _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 7 _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_1bnx 2 2 1 . . . parsed_1bnx 2 3 1 . . . parsed_1bnx 2 4 1 . . . parsed_1bnx 2 5 1 . . . parsed_1bnx 2 6 1 . . . parsed_1bnx 2 7 1 . . . parsed_1bnx 2 8 1 . . . parsed_1bnx 2 9 1 . . . parsed_1bnx 2 10 1 . . . parsed_1bnx 2 11 1 . . . parsed_1bnx 2 12 1 . . . parsed_1bnx 2 13 1 . . . parsed_1bnx 2 14 1 . . . parsed_1bnx 2 15 1 . . . parsed_1bnx 2 16 1 . . . parsed_1bnx 2 17 1 . . . parsed_1bnx 2 18 1 . . . parsed_1bnx 2 19 1 . . . parsed_1bnx 2 20 1 . . . parsed_1bnx 2 21 1 . . . parsed_1bnx 2 22 1 . . . parsed_1bnx 2 23 1 . . . parsed_1bnx 2 24 1 . . . parsed_1bnx 2 25 1 . . . parsed_1bnx 2 26 1 . . . parsed_1bnx 2 27 1 . . . parsed_1bnx 2 28 1 . . . parsed_1bnx 2 29 1 . . . parsed_1bnx 2 30 1 . . . parsed_1bnx 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 . . . . . . . . . 3 . HA parsed_1bnx 2 1 1 2 . . . . . . . . . 6 . HN parsed_1bnx 2 2 1 1 . . . . . . . . . 6 . HA parsed_1bnx 2 2 1 2 . . . . . . . . . 9 . HN parsed_1bnx 2 3 1 1 . . . . . . . . . 7 . HA parsed_1bnx 2 3 1 2 . . . . . . . . . 10 . HN parsed_1bnx 2 4 1 1 . . . . . . . . . 10 . HA parsed_1bnx 2 4 1 2 . . . . . . . . . 13 . HN parsed_1bnx 2 5 1 1 . . . . . . . . . 12 . HA parsed_1bnx 2 5 1 2 . . . . . . . . . 15 . HN parsed_1bnx 2 6 1 1 . . . . . . . . . 14 . HA parsed_1bnx 2 6 1 2 . . . . . . . . . 17 . HN parsed_1bnx 2 7 1 1 . . . . . . . . . 16 . HA parsed_1bnx 2 7 1 2 . . . . . . . . . 19 . HN parsed_1bnx 2 8 1 1 . . . . . . . . . 18 . HA parsed_1bnx 2 8 1 2 . . . . . . . . . 21 . HN parsed_1bnx 2 9 1 1 . . . . . . . . . 21 . HA parsed_1bnx 2 9 1 2 . . . . . . . . . 24 . HN parsed_1bnx 2 10 1 1 . . . . . . . . . 8 . HA parsed_1bnx 2 10 1 2 . . . . . . . . . 12 . HN parsed_1bnx 2 11 1 1 . . . . . . . . . 9 . HA parsed_1bnx 2 11 1 2 . . . . . . . . . 13 . HN parsed_1bnx 2 12 1 1 . . . . . . . . . 13 . HA parsed_1bnx 2 12 1 2 . . . . . . . . . 17 . HN parsed_1bnx 2 13 1 1 . . . . . . . . . 14 . HA parsed_1bnx 2 13 1 2 . . . . . . . . . 18 . HN parsed_1bnx 2 14 1 1 . . . . . . . . . 15 . HA parsed_1bnx 2 14 1 2 . . . . . . . . . 19 . HN parsed_1bnx 2 15 1 1 . . . . . . . . . 16 . HA parsed_1bnx 2 15 1 2 . . . . . . . . . 20 . HN parsed_1bnx 2 16 1 1 . . . . . . . . . 18 . HA parsed_1bnx 2 16 1 2 . . . . . . . . . 22 . HN parsed_1bnx 2 17 1 1 . . . . . . . . . 3 . HA parsed_1bnx 2 17 1 2 . . . . . . . . . 6 . HB* parsed_1bnx 2 18 1 1 . . . . . . . . . 6 . HA parsed_1bnx 2 18 1 2 . . . . . . . . . 9 . HB* parsed_1bnx 2 19 1 1 . . . . . . . . . 7 . HA parsed_1bnx 2 19 1 2 . . . . . . . . . 10 . HB parsed_1bnx 2 20 1 1 . . . . . . . . . 10 . HA parsed_1bnx 2 20 1 2 . . . . . . . . . 13 . HB parsed_1bnx 2 21 1 1 . . . . . . . . . 11 . HA parsed_1bnx 2 21 1 2 . . . . . . . . . 14 . HB parsed_1bnx 2 22 1 1 . . . . . . . . . 12 . HA parsed_1bnx 2 22 1 2 . . . . . . . . . 15 . HB* parsed_1bnx 2 23 1 1 . . . . . . . . . 14 . HA parsed_1bnx 2 23 1 2 . . . . . . . . . 17 . HB* parsed_1bnx 2 24 1 1 . . . . . . . . . 16 . HA parsed_1bnx 2 24 1 2 . . . . . . . . . 19 . HB* parsed_1bnx 2 25 1 1 . . . . . . . . . 17 . HA parsed_1bnx 2 25 1 2 . . . . . . . . . 20 . HB* parsed_1bnx 2 26 1 1 . . . . . . . . . 18 . HA parsed_1bnx 2 26 1 2 . . . . . . . . . 21 . HB* parsed_1bnx 2 27 1 1 . . . . . . . . . 21 . HA parsed_1bnx 2 27 1 2 . . . . . . . . . 24 . HB* parsed_1bnx 2 28 1 1 . . . . . . . . . 22 . HA parsed_1bnx 2 28 1 2 . . . . . . . . . 25 . HB parsed_1bnx 2 29 1 1 . . . . . . . . . 24 . HA parsed_1bnx 2 29 1 2 . . . . . . . . . 27 . HB* parsed_1bnx 2 30 1 1 . . . . . . . . . 3 . HD* parsed_1bnx 2 30 1 2 . . . . . . . . . 4 . HD* parsed_1bnx 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 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 2 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 3 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 4 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 5 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 6 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 7 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 8 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 9 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 10 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 11 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 12 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 13 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 14 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 15 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 16 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 17 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 18 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 19 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 20 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 2 21 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 2 22 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 23 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 2 24 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 2 25 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 26 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 27 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 2 28 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 2 29 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 30 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 2 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 HA(i)-HN(i+3) 1 1 1 81 parsed_1bnx 2 2 HA(i)-HN(i+4) 11 1 11 81 parsed_1bnx 2 3 HA(i)-HB(i+3) 19 1 19 81 parsed_1bnx 2 4 misc. 33 1 33 81 parsed_1bnx 2 stop_ save_ save_MR_file_comment_8 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 5 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 8 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment "clas intra " save_ save_CNS/XPLOR_distance_constraints_9 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1bnx _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 9 _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_1bnx 3 2 1 . . . parsed_1bnx 3 3 1 . . . parsed_1bnx 3 4 1 . . . parsed_1bnx 3 5 1 . . . parsed_1bnx 3 6 1 . . . parsed_1bnx 3 7 1 . . . parsed_1bnx 3 8 1 . . . parsed_1bnx 3 9 1 . . . parsed_1bnx 3 10 1 . . . parsed_1bnx 3 11 1 . . . parsed_1bnx 3 12 1 . . . parsed_1bnx 3 13 1 . . . parsed_1bnx 3 14 1 . . . parsed_1bnx 3 15 1 . . . parsed_1bnx 3 16 1 . . . parsed_1bnx 3 17 1 . . . parsed_1bnx 3 18 1 . . . parsed_1bnx 3 19 1 . . . parsed_1bnx 3 20 1 . . . parsed_1bnx 3 21 1 . . . parsed_1bnx 3 22 1 . . . parsed_1bnx 3 23 1 . . . parsed_1bnx 3 24 1 . . . parsed_1bnx 3 25 1 . . . parsed_1bnx 3 26 1 . . . parsed_1bnx 3 27 1 . . . parsed_1bnx 3 28 1 . . . parsed_1bnx 3 29 1 . . . parsed_1bnx 3 30 1 . . . parsed_1bnx 3 31 1 . . . parsed_1bnx 3 32 1 . . . parsed_1bnx 3 33 1 . . . parsed_1bnx 3 34 1 . . . parsed_1bnx 3 35 1 . . . parsed_1bnx 3 36 1 . . . parsed_1bnx 3 37 1 . . . parsed_1bnx 3 38 1 . . . parsed_1bnx 3 39 1 . . . parsed_1bnx 3 40 1 . . . parsed_1bnx 3 41 1 . . . parsed_1bnx 3 42 1 . . . parsed_1bnx 3 43 1 . . . parsed_1bnx 3 44 1 . . . parsed_1bnx 3 45 1 . . . parsed_1bnx 3 46 1 . . . parsed_1bnx 3 47 1 . . . parsed_1bnx 3 48 1 . . . parsed_1bnx 3 49 1 . . . parsed_1bnx 3 50 1 . . . parsed_1bnx 3 51 1 . . . parsed_1bnx 3 52 1 . . . parsed_1bnx 3 53 1 . . . parsed_1bnx 3 54 1 . . . parsed_1bnx 3 55 1 . . . parsed_1bnx 3 56 1 . . . parsed_1bnx 3 57 1 . . . parsed_1bnx 3 58 1 . . . parsed_1bnx 3 59 1 . . . parsed_1bnx 3 60 1 . . . parsed_1bnx 3 61 1 . . . parsed_1bnx 3 62 1 . . . parsed_1bnx 3 63 1 . . . parsed_1bnx 3 64 1 . . . parsed_1bnx 3 65 1 . . . parsed_1bnx 3 66 1 . . . parsed_1bnx 3 67 1 . . . parsed_1bnx 3 68 1 . . . parsed_1bnx 3 69 1 . . . parsed_1bnx 3 70 1 . . . parsed_1bnx 3 71 1 . . . parsed_1bnx 3 72 1 . . . parsed_1bnx 3 73 1 . . . parsed_1bnx 3 74 1 . . . parsed_1bnx 3 75 1 . . . parsed_1bnx 3 76 1 . . . parsed_1bnx 3 77 1 . . . parsed_1bnx 3 78 1 . . . parsed_1bnx 3 79 1 . . . parsed_1bnx 3 80 1 . . . parsed_1bnx 3 81 1 . . . parsed_1bnx 3 82 1 . . . parsed_1bnx 3 83 1 . . . parsed_1bnx 3 84 1 . . . parsed_1bnx 3 85 1 . . . parsed_1bnx 3 86 1 . . . parsed_1bnx 3 87 1 . . . parsed_1bnx 3 88 1 . . . parsed_1bnx 3 89 1 . . . parsed_1bnx 3 90 1 . . . parsed_1bnx 3 91 1 . . . parsed_1bnx 3 92 1 . . . parsed_1bnx 3 93 1 . . . parsed_1bnx 3 94 1 . . . parsed_1bnx 3 95 1 . . . parsed_1bnx 3 96 1 . . . parsed_1bnx 3 97 1 . . . parsed_1bnx 3 98 1 . . . parsed_1bnx 3 99 1 . . . parsed_1bnx 3 100 1 . . . parsed_1bnx 3 101 1 . . . parsed_1bnx 3 102 1 . . . parsed_1bnx 3 103 1 . . . parsed_1bnx 3 104 1 . . . parsed_1bnx 3 105 1 . . . parsed_1bnx 3 106 1 . . . parsed_1bnx 3 107 1 . . . parsed_1bnx 3 108 1 . . . parsed_1bnx 3 109 1 . . . parsed_1bnx 3 110 1 . . . parsed_1bnx 3 111 1 . . . parsed_1bnx 3 112 1 . . . parsed_1bnx 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 . . . . . . . . . 2 . HN parsed_1bnx 3 1 1 2 . . . . . . . . . 2 . HA parsed_1bnx 3 2 1 1 . . . . . . . . . 3 . HN parsed_1bnx 3 2 1 2 . . . . . . . . . 3 . HA parsed_1bnx 3 3 1 1 . . . . . . . . . 5 . HN parsed_1bnx 3 3 1 2 . . . . . . . . . 5 . HA parsed_1bnx 3 4 1 1 . . . . . . . . . 6 . HN parsed_1bnx 3 4 1 2 . . . . . . . . . 6 . HA parsed_1bnx 3 5 1 1 . . . . . . . . . 7 . HN parsed_1bnx 3 5 1 2 . . . . . . . . . 7 . HA parsed_1bnx 3 6 1 1 . . . . . . . . . 8 . HN parsed_1bnx 3 6 1 2 . . . . . . . . . 8 . HA parsed_1bnx 3 7 1 1 . . . . . . . . . 9 . HN parsed_1bnx 3 7 1 2 . . . . . . . . . 9 . HA parsed_1bnx 3 8 1 1 . . . . . . . . . 10 . HN parsed_1bnx 3 8 1 2 . . . . . . . . . 10 . HA parsed_1bnx 3 9 1 1 . . . . . . . . . 11 . HN parsed_1bnx 3 9 1 2 . . . . . . . . . 11 . HA parsed_1bnx 3 10 1 1 . . . . . . . . . 12 . HN parsed_1bnx 3 10 1 2 . . . . . . . . . 12 . HA parsed_1bnx 3 11 1 1 . . . . . . . . . 13 . HN parsed_1bnx 3 11 1 2 . . . . . . . . . 13 . HA parsed_1bnx 3 12 1 1 . . . . . . . . . 14 . HN parsed_1bnx 3 12 1 2 . . . . . . . . . 14 . HA parsed_1bnx 3 13 1 1 . . . . . . . . . 15 . HN parsed_1bnx 3 13 1 2 . . . . . . . . . 15 . HA parsed_1bnx 3 14 1 1 . . . . . . . . . 16 . HN parsed_1bnx 3 14 1 2 . . . . . . . . . 16 . HA parsed_1bnx 3 15 1 1 . . . . . . . . . 17 . HN parsed_1bnx 3 15 1 2 . . . . . . . . . 17 . HA parsed_1bnx 3 16 1 1 . . . . . . . . . 18 . HN parsed_1bnx 3 16 1 2 . . . . . . . . . 18 . HA parsed_1bnx 3 17 1 1 . . . . . . . . . 19 . HN parsed_1bnx 3 17 1 2 . . . . . . . . . 19 . HA parsed_1bnx 3 18 1 1 . . . . . . . . . 20 . HN parsed_1bnx 3 18 1 2 . . . . . . . . . 20 . HA parsed_1bnx 3 19 1 1 . . . . . . . . . 21 . HN parsed_1bnx 3 19 1 2 . . . . . . . . . 21 . HA parsed_1bnx 3 20 1 1 . . . . . . . . . 22 . HN parsed_1bnx 3 20 1 2 . . . . . . . . . 22 . HA parsed_1bnx 3 21 1 1 . . . . . . . . . 24 . HN parsed_1bnx 3 21 1 2 . . . . . . . . . 24 . HA parsed_1bnx 3 22 1 1 . . . . . . . . . 25 . HN parsed_1bnx 3 22 1 2 . . . . . . . . . 25 . HA parsed_1bnx 3 23 1 1 . . . . . . . . . 26 . HN parsed_1bnx 3 23 1 2 . . . . . . . . . 26 . HA parsed_1bnx 3 24 1 1 . . . . . . . . . 27 . HN parsed_1bnx 3 24 1 2 . . . . . . . . . 27 . HA parsed_1bnx 3 25 1 1 . . . . . . . . . 28 . HN parsed_1bnx 3 25 1 2 . . . . . . . . . 28 . HA1 parsed_1bnx 3 26 1 1 . . . . . . . . . 28 . HN parsed_1bnx 3 26 1 2 . . . . . . . . . 28 . HA2 parsed_1bnx 3 27 1 1 . . . . . . . . . 29 . HN parsed_1bnx 3 27 1 2 . . . . . . . . . 29 . HA1 parsed_1bnx 3 28 1 1 . . . . . . . . . 29 . HN parsed_1bnx 3 28 1 2 . . . . . . . . . 29 . HA2 parsed_1bnx 3 29 1 1 . . . . . . . . . 30 . HN parsed_1bnx 3 29 1 2 . . . . . . . . . 30 . HA parsed_1bnx 3 30 1 1 . . . . . . . . . 31 . HN parsed_1bnx 3 30 1 2 . . . . . . . . . 31 . HA parsed_1bnx 3 31 1 1 . . . . . . . . . 32 . HN parsed_1bnx 3 31 1 2 . . . . . . . . . 32 . HA parsed_1bnx 3 32 1 1 . . . . . . . . . 33 . HN parsed_1bnx 3 32 1 2 . . . . . . . . . 33 . HA parsed_1bnx 3 33 1 1 . . . . . . . . . 34 . HN parsed_1bnx 3 33 1 2 . . . . . . . . . 34 . HA parsed_1bnx 3 34 1 1 . . . . . . . . . 3 . HN parsed_1bnx 3 34 1 2 . . . . . . . . . 3 . HB* parsed_1bnx 3 35 1 1 . . . . . . . . . 5 . HN parsed_1bnx 3 35 1 2 . . . . . . . . . 5 . HB1 parsed_1bnx 3 36 1 1 . . . . . . . . . 5 . HN parsed_1bnx 3 36 1 2 . . . . . . . . . 5 . HB2 parsed_1bnx 3 37 1 1 . . . . . . . . . 6 . HN parsed_1bnx 3 37 1 2 . . . . . . . . . 6 . HB1 parsed_1bnx 3 38 1 1 . . . . . . . . . 6 . HN parsed_1bnx 3 38 1 2 . . . . . . . . . 6 . HB2 parsed_1bnx 3 39 1 1 . . . . . . . . . 10 . HN parsed_1bnx 3 39 1 2 . . . . . . . . . 10 . HB parsed_1bnx 3 40 1 1 . . . . . . . . . 11 . HN parsed_1bnx 3 40 1 2 . . . . . . . . . 11 . HB parsed_1bnx 3 41 1 1 . . . . . . . . . 12 . HN parsed_1bnx 3 41 1 2 . . . . . . . . . 12 . HB1 parsed_1bnx 3 42 1 1 . . . . . . . . . 12 . HN parsed_1bnx 3 42 1 2 . . . . . . . . . 12 . HB2 parsed_1bnx 3 43 1 1 . . . . . . . . . 13 . HN parsed_1bnx 3 43 1 2 . . . . . . . . . 13 . HB parsed_1bnx 3 44 1 1 . . . . . . . . . 14 . HN parsed_1bnx 3 44 1 2 . . . . . . . . . 14 . HB parsed_1bnx 3 45 1 1 . . . . . . . . . 15 . HN parsed_1bnx 3 45 1 2 . . . . . . . . . 15 . HB1 parsed_1bnx 3 46 1 1 . . . . . . . . . 15 . HN parsed_1bnx 3 46 1 2 . . . . . . . . . 15 . HB2 parsed_1bnx 3 47 1 1 . . . . . . . . . 16 . HN parsed_1bnx 3 47 1 2 . . . . . . . . . 16 . HB parsed_1bnx 3 48 1 1 . . . . . . . . . 17 . HN parsed_1bnx 3 48 1 2 . . . . . . . . . 17 . HB* parsed_1bnx 3 49 1 1 . . . . . . . . . 18 . HN parsed_1bnx 3 49 1 2 . . . . . . . . . 18 . HB* parsed_1bnx 3 50 1 1 . . . . . . . . . 19 . HN parsed_1bnx 3 50 1 2 . . . . . . . . . 19 . HB* parsed_1bnx 3 51 1 1 . . . . . . . . . 20 . HN parsed_1bnx 3 51 1 2 . . . . . . . . . 20 . HB* parsed_1bnx 3 52 1 1 . . . . . . . . . 21 . HN parsed_1bnx 3 52 1 2 . . . . . . . . . 21 . HB* parsed_1bnx 3 53 1 1 . . . . . . . . . 22 . HN parsed_1bnx 3 53 1 2 . . . . . . . . . 22 . HB* parsed_1bnx 3 54 1 1 . . . . . . . . . 24 . HN parsed_1bnx 3 54 1 2 . . . . . . . . . 24 . HB* parsed_1bnx 3 55 1 1 . . . . . . . . . 25 . HN parsed_1bnx 3 55 1 2 . . . . . . . . . 25 . HB parsed_1bnx 3 56 1 1 . . . . . . . . . 26 . HN parsed_1bnx 3 56 1 2 . . . . . . . . . 26 . HB parsed_1bnx 3 57 1 1 . . . . . . . . . 27 . HN parsed_1bnx 3 57 1 2 . . . . . . . . . 27 . HB* parsed_1bnx 3 58 1 1 . . . . . . . . . 33 . HN parsed_1bnx 3 58 1 2 . . . . . . . . . 33 . HB* parsed_1bnx 3 59 1 1 . . . . . . . . . 34 . HN parsed_1bnx 3 59 1 2 . . . . . . . . . 34 . HB* parsed_1bnx 3 60 1 1 . . . . . . . . . 11 . HA parsed_1bnx 3 60 1 2 . . . . . . . . . 11 . HB parsed_1bnx 3 61 1 1 . . . . . . . . . 18 . HA parsed_1bnx 3 61 1 2 . . . . . . . . . 18 . HB* parsed_1bnx 3 62 1 1 . . . . . . . . . 13 . HA parsed_1bnx 3 62 1 2 . . . . . . . . . 13 . HB parsed_1bnx 3 63 1 1 . . . . . . . . . 34 . HN parsed_1bnx 3 63 1 2 . . . . . . . . . 34 . HG* parsed_1bnx 3 64 1 1 . . . . . . . . . 34 . HN parsed_1bnx 3 64 1 2 . . . . . . . . . 34 . HB* parsed_1bnx 3 65 1 1 . . . . . . . . . 13 . HA parsed_1bnx 3 65 1 2 . . . . . . . . . 13 . HG1* parsed_1bnx 3 66 1 1 . . . . . . . . . 13 . HA parsed_1bnx 3 66 1 2 . . . . . . . . . 13 . HG2* parsed_1bnx 3 67 1 1 . . . . . . . . . 13 . HN parsed_1bnx 3 67 1 2 . . . . . . . . . 13 . HG1* parsed_1bnx 3 68 1 1 . . . . . . . . . 13 . HN parsed_1bnx 3 68 1 2 . . . . . . . . . 13 . HG2* parsed_1bnx 3 69 1 1 . . . . . . . . . 13 . HB parsed_1bnx 3 69 1 2 . . . . . . . . . 13 . HG1* parsed_1bnx 3 70 1 1 . . . . . . . . . 13 . HB parsed_1bnx 3 70 1 2 . . . . . . . . . 13 . HG2* parsed_1bnx 3 71 1 1 . . . . . . . . . 13 . HG1* parsed_1bnx 3 71 1 2 . . . . . . . . . 13 . HG2* parsed_1bnx 3 72 1 1 . . . . . . . . . 7 . HN parsed_1bnx 3 72 1 2 . . . . . . . . . 7 . HD* parsed_1bnx 3 73 1 1 . . . . . . . . . 7 . HA parsed_1bnx 3 73 1 2 . . . . . . . . . 7 . HD* parsed_1bnx 3 74 1 1 . . . . . . . . . 7 . HG parsed_1bnx 3 74 1 2 . . . . . . . . . 7 . HD1* parsed_1bnx 3 75 1 1 . . . . . . . . . 7 . HG parsed_1bnx 3 75 1 2 . . . . . . . . . 7 . HD2* parsed_1bnx 3 76 1 1 . . . . . . . . . 21 . HN parsed_1bnx 3 76 1 2 . . . . . . . . . 21 . HG parsed_1bnx 3 77 1 1 . . . . . . . . . 21 . HA parsed_1bnx 3 77 1 2 . . . . . . . . . 21 . HG parsed_1bnx 3 78 1 1 . . . . . . . . . 21 . HB1 parsed_1bnx 3 78 1 2 . . . . . . . . . 21 . HB2 parsed_1bnx 3 79 1 1 . . . . . . . . . 21 . HB* parsed_1bnx 3 79 1 2 . . . . . . . . . 21 . HG parsed_1bnx 3 80 1 1 . . . . . . . . . 30 . HG parsed_1bnx 3 80 1 2 . . . . . . . . . 30 . HD2* parsed_1bnx 3 81 1 1 . . . . . . . . . 30 . HG parsed_1bnx 3 81 1 2 . . . . . . . . . 30 . HD1* parsed_1bnx 3 82 1 1 . . . . . . . . . 31 . HG parsed_1bnx 3 82 1 2 . . . . . . . . . 31 . HD1* parsed_1bnx 3 83 1 1 . . . . . . . . . 31 . HG parsed_1bnx 3 83 1 2 . . . . . . . . . 31 . HD2* parsed_1bnx 3 84 1 1 . . . . . . . . . 10 . HN parsed_1bnx 3 84 1 2 . . . . . . . . . 10 . HG1* parsed_1bnx 3 85 1 1 . . . . . . . . . 10 . HN parsed_1bnx 3 85 1 2 . . . . . . . . . 10 . HG2* parsed_1bnx 3 86 1 1 . . . . . . . . . 10 . HA parsed_1bnx 3 86 1 2 . . . . . . . . . 10 . HG1* parsed_1bnx 3 87 1 1 . . . . . . . . . 10 . HA parsed_1bnx 3 87 1 2 . . . . . . . . . 10 . HG2* parsed_1bnx 3 88 1 1 . . . . . . . . . 10 . HG11 parsed_1bnx 3 88 1 2 . . . . . . . . . 10 . HG12 parsed_1bnx 3 89 1 1 . . . . . . . . . 14 . HN parsed_1bnx 3 89 1 2 . . . . . . . . . 14 . HG1* parsed_1bnx 3 90 1 1 . . . . . . . . . 14 . HN parsed_1bnx 3 90 1 2 . . . . . . . . . 14 . HG2* parsed_1bnx 3 91 1 1 . . . . . . . . . 14 . HA parsed_1bnx 3 91 1 2 . . . . . . . . . 14 . HG1* parsed_1bnx 3 92 1 1 . . . . . . . . . 14 . HA parsed_1bnx 3 92 1 2 . . . . . . . . . 14 . HG2* parsed_1bnx 3 93 1 1 . . . . . . . . . 14 . HG11 parsed_1bnx 3 93 1 2 . . . . . . . . . 14 . HG12 parsed_1bnx 3 94 1 1 . . . . . . . . . 16 . HN parsed_1bnx 3 94 1 2 . . . . . . . . . 16 . HG1* parsed_1bnx 3 95 1 1 . . . . . . . . . 16 . HN parsed_1bnx 3 95 1 2 . . . . . . . . . 16 . HG2* parsed_1bnx 3 96 1 1 . . . . . . . . . 16 . HA parsed_1bnx 3 96 1 2 . . . . . . . . . 16 . HG1* parsed_1bnx 3 97 1 1 . . . . . . . . . 16 . HA parsed_1bnx 3 97 1 2 . . . . . . . . . 16 . HG2* parsed_1bnx 3 98 1 1 . . . . . . . . . 16 . HG11 parsed_1bnx 3 98 1 2 . . . . . . . . . 16 . HG12 parsed_1bnx 3 99 1 1 . . . . . . . . . 25 . HN parsed_1bnx 3 99 1 2 . . . . . . . . . 25 . HG1* parsed_1bnx 3 100 1 1 . . . . . . . . . 4 . HB1 parsed_1bnx 3 100 1 2 . . . . . . . . . 4 . HB2 parsed_1bnx 3 101 1 1 . . . . . . . . . 4 . HD1 parsed_1bnx 3 101 1 2 . . . . . . . . . 4 . HD2 parsed_1bnx 3 102 1 1 . . . . . . . . . 23 . HB1 parsed_1bnx 3 102 1 2 . . . . . . . . . 23 . HB2 parsed_1bnx 3 103 1 1 . . . . . . . . . 23 . HD1 parsed_1bnx 3 103 1 2 . . . . . . . . . 23 . HD2 parsed_1bnx 3 104 1 1 . . . . . . . . . 3 . HB* parsed_1bnx 3 104 1 2 . . . . . . . . . 3 . HD* parsed_1bnx 3 105 1 1 . . . . . . . . . 5 . HB* parsed_1bnx 3 105 1 2 . . . . . . . . . 5 . HD* parsed_1bnx 3 106 1 1 . . . . . . . . . 6 . HA parsed_1bnx 3 106 1 2 . . . . . . . . . 6 . HD* parsed_1bnx 3 107 1 1 . . . . . . . . . 5 . HA parsed_1bnx 3 107 1 2 . . . . . . . . . 5 . HD* parsed_1bnx 3 108 1 1 . . . . . . . . . 28 . HA1 parsed_1bnx 3 108 1 2 . . . . . . . . . 28 . HA2 parsed_1bnx 3 109 1 1 . . . . . . . . . 29 . HA1 parsed_1bnx 3 109 1 2 . . . . . . . . . 29 . HA2 parsed_1bnx 3 110 1 1 . . . . . . . . . 32 . HA1 parsed_1bnx 3 110 1 2 . . . . . . . . . 32 . HA2 parsed_1bnx 3 111 1 1 . . . . . . . . . 11 . HN parsed_1bnx 3 111 1 2 . . . . . . . . . 11 . HG2* parsed_1bnx 3 112 1 1 . . . . . . . . . 26 . HN parsed_1bnx 3 112 1 2 . . . . . . . . . 26 . HG2* parsed_1bnx 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 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 2 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 3 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 4 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 5 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 6 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 7 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 8 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 9 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 10 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 11 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 12 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 13 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 14 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 15 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 16 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 17 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 18 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 19 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 20 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 21 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 22 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 23 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 24 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 25 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 26 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 27 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 28 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 29 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 30 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 31 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 32 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 33 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 34 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 35 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 36 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 37 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 38 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 39 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 40 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 41 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 42 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 43 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 44 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 45 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 46 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 47 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 48 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 49 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 50 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 51 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 52 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 53 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 54 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 55 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 56 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 57 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 58 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 59 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 60 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 61 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 62 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 63 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 64 1 . . . . . 3.0 0.0 3.5 parsed_1bnx 3 65 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 66 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 67 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 68 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 69 1 . . . . . 2.5 0.0 3.5 parsed_1bnx 3 70 1 . . . . . 2.5 0.0 3.5 parsed_1bnx 3 71 1 . . . . . 2.5 0.0 3.5 parsed_1bnx 3 72 1 . . . . . 4.0 0.0 6.0 parsed_1bnx 3 73 1 . . . . . 4.0 0.0 6.0 parsed_1bnx 3 74 1 . . . . . 2.5 0.0 4.0 parsed_1bnx 3 75 1 . . . . . 2.5 0.0 4.0 parsed_1bnx 3 76 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 77 1 . . . . . 3.5 0.0 4.5 parsed_1bnx 3 78 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 79 1 . . . . . 3.5 0.0 4.5 parsed_1bnx 3 80 1 . . . . . 2.5 0.0 4.0 parsed_1bnx 3 81 1 . . . . . 2.5 0.0 4.0 parsed_1bnx 3 82 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 83 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 84 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 85 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 86 1 . . . . . 3.5 0.0 4.5 parsed_1bnx 3 87 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 88 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 89 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 90 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 91 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 92 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 93 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 94 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 95 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 96 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 97 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 98 1 . . . . . 2.5 0.0 3.0 parsed_1bnx 3 99 1 . . . . . 3.5 0.0 5.0 parsed_1bnx 3 100 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 101 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 102 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 103 1 . . . . . 2.5 0.0 2.9 parsed_1bnx 3 104 1 . . . . . 3.5 0.0 4.0 parsed_1bnx 3 105 1 . . . . . 3.5 0.0 4.0 parsed_1bnx 3 106 1 . . . . . 3.5 0.0 4.0 parsed_1bnx 3 107 1 . . . . . 4.0 0.0 5.0 parsed_1bnx 3 108 1 . . . . . 1.8 0.0 2.0 parsed_1bnx 3 109 1 . . . . . 1.8 0.0 2.0 parsed_1bnx 3 110 1 . . . . . 1.8 0.0 2.0 parsed_1bnx 3 111 1 . . . . . 3.5 0.0 4.5 parsed_1bnx 3 112 1 . . . . . 3.5 0.0 4.5 parsed_1bnx 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 HN(i)-HA(i) 1 1 1 81 parsed_1bnx 3 2 ; HN(i)-HB(i) assign (resid 2 and name HN )(resid 2 and name HB1 ) 3.0 3.0 0.5 ; 35 1 36 81 parsed_1bnx 3 3 HA(i)-HB(i) 63 1 63 81 parsed_1bnx 3 4 LYs 67 1 67 81 parsed_1bnx 3 5 ; assign (resid 34 and nameHE* )(resid 34 and name HZ* ) 3.0 3.0 0.5 Val ; 70 1 71 81 parsed_1bnx 3 6 Leu 79 1 79 81 parsed_1bnx 3 7 ile 92 1 92 81 parsed_1bnx 3 8 Pro 109 1 109 81 parsed_1bnx 3 9 aromatics 114 1 114 81 parsed_1bnx 3 10 glycine 119 1 119 81 parsed_1bnx 3 11 threonines 123 1 123 81 parsed_1bnx 3 12 "hydrogen bonds" 126 1 126 81 parsed_1bnx 3 stop_ save_ save_MR_file_comment_10 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 6 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 10 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment "clas hbon " save_ save_CNS/XPLOR_distance_constraints_11 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_1bnx _Distance_constraint_list.ID 4 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 11 _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_1bnx 4 2 1 . . . parsed_1bnx 4 3 1 . . . parsed_1bnx 4 4 1 . . . parsed_1bnx 4 5 1 . . . parsed_1bnx 4 6 1 . . . parsed_1bnx 4 7 1 . . . parsed_1bnx 4 8 1 . . . parsed_1bnx 4 9 1 . . . parsed_1bnx 4 10 1 . . . parsed_1bnx 4 11 1 . . . parsed_1bnx 4 12 1 . . . parsed_1bnx 4 13 1 . . . parsed_1bnx 4 14 1 . . . parsed_1bnx 4 15 1 . . . parsed_1bnx 4 16 1 . . . parsed_1bnx 4 17 1 . . . parsed_1bnx 4 18 1 . . . parsed_1bnx 4 19 1 . . . parsed_1bnx 4 20 1 . . . parsed_1bnx 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 1 1 . . . . . . . . . 7 . O parsed_1bnx 4 1 1 2 . . . . . . . . . 11 . N parsed_1bnx 4 2 1 1 . . . . . . . . . 8 . O parsed_1bnx 4 2 1 2 . . . . . . . . . 12 . N parsed_1bnx 4 3 1 1 . . . . . . . . . 9 . O parsed_1bnx 4 3 1 2 . . . . . . . . . 13 . N parsed_1bnx 4 4 1 1 . . . . . . . . . 10 . O parsed_1bnx 4 4 1 2 . . . . . . . . . 14 . N parsed_1bnx 4 5 1 1 . . . . . . . . . 11 . O parsed_1bnx 4 5 1 2 . . . . . . . . . 15 . N parsed_1bnx 4 6 1 1 . . . . . . . . . 12 . O parsed_1bnx 4 6 1 2 . . . . . . . . . 16 . N parsed_1bnx 4 7 1 1 . . . . . . . . . 13 . O parsed_1bnx 4 7 1 2 . . . . . . . . . 17 . N parsed_1bnx 4 8 1 1 . . . . . . . . . 14 . O parsed_1bnx 4 8 1 2 . . . . . . . . . 18 . N parsed_1bnx 4 9 1 1 . . . . . . . . . 15 . O parsed_1bnx 4 9 1 2 . . . . . . . . . 19 . N parsed_1bnx 4 10 1 1 . . . . . . . . . 16 . O parsed_1bnx 4 10 1 2 . . . . . . . . . 20 . N parsed_1bnx 4 11 1 1 . . . . . . . . . 7 . O parsed_1bnx 4 11 1 2 . . . . . . . . . 11 . HN parsed_1bnx 4 12 1 1 . . . . . . . . . 8 . O parsed_1bnx 4 12 1 2 . . . . . . . . . 12 . HN parsed_1bnx 4 13 1 1 . . . . . . . . . 9 . O parsed_1bnx 4 13 1 2 . . . . . . . . . 13 . HN parsed_1bnx 4 14 1 1 . . . . . . . . . 10 . O parsed_1bnx 4 14 1 2 . . . . . . . . . 14 . HN parsed_1bnx 4 15 1 1 . . . . . . . . . 11 . O parsed_1bnx 4 15 1 2 . . . . . . . . . 15 . HN parsed_1bnx 4 16 1 1 . . . . . . . . . 12 . O parsed_1bnx 4 16 1 2 . . . . . . . . . 16 . HN parsed_1bnx 4 17 1 1 . . . . . . . . . 13 . O parsed_1bnx 4 17 1 2 . . . . . . . . . 17 . HN parsed_1bnx 4 18 1 1 . . . . . . . . . 14 . O parsed_1bnx 4 18 1 2 . . . . . . . . . 18 . HN parsed_1bnx 4 19 1 1 . . . . . . . . . 15 . O parsed_1bnx 4 19 1 2 . . . . . . . . . 19 . HN parsed_1bnx 4 20 1 1 . . . . . . . . . 16 . O parsed_1bnx 4 20 1 2 . . . . . . . . . 20 . HN parsed_1bnx 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 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 2 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 3 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 4 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 5 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 6 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 7 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 8 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 9 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 10 1 . . . . . 3.3 0.0 3.5 parsed_1bnx 4 11 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 12 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 13 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 14 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 15 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 16 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 17 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 18 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 19 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 20 1 . . . . . 2.3 0.0 2.5 parsed_1bnx 4 stop_ save_ save_MR_file_comment_12 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_1bnx _Org_constr_file_comment.ID 7 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 12 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; set message=on echo=on end ; save_
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