NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
30185 |
1bzk   |
cing | 2-parsed | STAR | entry | full | 232 |
data_1bzk_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1bzk
_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_1bzk 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1bzk
_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 1bzk "Master copy" parsed_1bzk
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1bzk
_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 1bzk.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 32 parsed_1bzk 1
1 1bzk.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . XPLOR/CNS 4 distance NOE simple 81 parsed_1bzk 1
1 1bzk.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . XPLOR/CNS 6 distance NOE simple 36 parsed_1bzk 1
1 1bzk.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . XPLOR/CNS 8 distance NOE simple 63 parsed_1bzk 1
1 1bzk.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . XPLOR/CNS 10 distance "hydrogen bond" simple 20 parsed_1bzk 1
1 1bzk.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 parsed_1bzk 1
1 1bzk.mr . . "MR format" 12 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1bzk 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_1bzk
_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 BAND 3 PROTEIN 01-NOV-98 1BZK
*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 ANION TRANSPORT PROTEIN;
*COMPND 3 CHAIN: NULL;
*COMPND 4 FRAGMENT: C-TERMINAL CYTOPLASM/FIRST MEMBRANE SPAN;
*COMPND 5 ENGINEERED: YES;
*COMPND 6 BIOLOGICAL_UNIT: MONOMER;
*COMPND 7 OTHER_DETAILS: PEPTIDE CORRESPONDS TO THE SECTION R-389 -K-
*COMPND 8 430 IN HUMAN BAND 3.
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED
*SOURCE 4 USING FMOC PEPTIDE STRATEGY. THE SEQUENCE OF THE PEPTIDE
*SOURCE 5 IS NATURALLY FOUND IN THE CYTOPLASM/MEMBRANE RED CELL OF
*SOURCE 6 HOMO SAPIENS.
*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 1 01-JUN-99 1BZK 0
set message=off echo=off end
restraints dihedral reset
;
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1bzk
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_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_1bzk 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 5 . c . 6 . n . 6 . ca . 6 . c parsed_1bzk 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1bzk 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_1bzk 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1bzk 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 9 . c . 10 . n . 10 . ca . 10 . c parsed_1bzk 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 10 . c . 11 . n . 11 . ca . 11 . c parsed_1bzk 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 11 . c . 12 . n . 12 . ca . 12 . c parsed_1bzk 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -35.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1bzk 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 13 . c . 14 . n . 14 . ca . 14 . c parsed_1bzk 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 16 . c . 17 . n . 17 . ca . 17 . c parsed_1bzk 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 17 . c . 18 . n . 18 . ca . 18 . c parsed_1bzk 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1bzk 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1bzk 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 20 . c . 21 . n . 21 . ca . 21 . c parsed_1bzk 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1bzk 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -25.0 . . 22 . c . 23 . n . 23 . ca . 23 . c parsed_1bzk 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1bzk 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -25.0 . . 24 . c . 25 . n . 25 . ca . 25 . c parsed_1bzk 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1bzk 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 26 . c . 27 . n . 27 . ca . 27 . c parsed_1bzk 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 27 . c . 28 . n . 28 . ca . 28 . c parsed_1bzk 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1bzk 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -35.0 . . 29 . c . 30 . n . 30 . ca . 30 . c parsed_1bzk 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 30 . c . 31 . n . 31 . ca . 31 . c parsed_1bzk 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 32 . c . 33 . n . 33 . ca . 33 . c parsed_1bzk 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 33 . c . 34 . n . 34 . ca . 34 . c parsed_1bzk 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 34 . c . 35 . n . 35 . ca . 35 . c parsed_1bzk 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 35 . c . 36 . n . 36 . ca . 36 . c parsed_1bzk 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 38 . c . 39 . n . 39 . ca . 39 . c parsed_1bzk 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -35.0 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1bzk 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 41 . c . 42 . n . 42 . ca . 42 . c parsed_1bzk 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
;
ovn1r/refineshx3/ovn1r_dih_sx.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 -60.0 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 30.0 2
;
1 1 6 77 parsed_1bzk 1
2
;
assign (resid 14 and name c ) (resid 15 and name n )
(resid 15 and name ca) (resid 15 and name c ) 1.0 -70.0 35.0 2
;
27 1 28 77 parsed_1bzk 1
stop_
save_
save_MR_file_comment_3
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1bzk
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 3
_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
!/refine5/ovn1r_noe_ref5.tbl additional intraresidue noes from 4.
clas seq
;
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bzk
_Distance_constraint_list.ID 1
_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_1bzk 1
2 1 . . . parsed_1bzk 1
3 1 . . . parsed_1bzk 1
4 1 . . . parsed_1bzk 1
5 1 . . . parsed_1bzk 1
6 1 . . . parsed_1bzk 1
7 1 . . . parsed_1bzk 1
8 1 . . . parsed_1bzk 1
9 1 . . . parsed_1bzk 1
10 1 . . . parsed_1bzk 1
11 1 . . . parsed_1bzk 1
12 1 . . . parsed_1bzk 1
13 1 . . . parsed_1bzk 1
14 1 . . . parsed_1bzk 1
15 1 . . . parsed_1bzk 1
16 1 . . . parsed_1bzk 1
17 1 . . . parsed_1bzk 1
18 1 . . . parsed_1bzk 1
19 1 . . . parsed_1bzk 1
20 1 . . . parsed_1bzk 1
21 1 . . . parsed_1bzk 1
22 1 . . . parsed_1bzk 1
23 1 . . . parsed_1bzk 1
24 1 . . . parsed_1bzk 1
25 1 . . . parsed_1bzk 1
26 1 . . . parsed_1bzk 1
27 1 . . . parsed_1bzk 1
28 1 . . . parsed_1bzk 1
29 1 . . . parsed_1bzk 1
30 1 . . . parsed_1bzk 1
31 1 . . . parsed_1bzk 1
32 1 . . . parsed_1bzk 1
33 1 . . . parsed_1bzk 1
34 1 . . . parsed_1bzk 1
35 1 . . . parsed_1bzk 1
36 1 . . . parsed_1bzk 1
37 1 . . . parsed_1bzk 1
38 1 . . . parsed_1bzk 1
39 1 . . . parsed_1bzk 1
40 1 . . . parsed_1bzk 1
41 1 . . . parsed_1bzk 1
42 1 . . . parsed_1bzk 1
43 1 . . . parsed_1bzk 1
44 1 . . . parsed_1bzk 1
45 1 . . . parsed_1bzk 1
46 1 . . . parsed_1bzk 1
47 1 . . . parsed_1bzk 1
48 1 . . . parsed_1bzk 1
49 1 . . . parsed_1bzk 1
50 1 . . . parsed_1bzk 1
51 1 . . . parsed_1bzk 1
52 1 . . . parsed_1bzk 1
53 1 . . . parsed_1bzk 1
54 1 . . . parsed_1bzk 1
55 1 . . . parsed_1bzk 1
56 1 . . . parsed_1bzk 1
57 1 . . . parsed_1bzk 1
58 1 . . . parsed_1bzk 1
59 1 . . . parsed_1bzk 1
60 1 . . . parsed_1bzk 1
61 1 . . . parsed_1bzk 1
62 1 . . . parsed_1bzk 1
63 1 . . . parsed_1bzk 1
64 1 . . . parsed_1bzk 1
65 1 . . . parsed_1bzk 1
66 1 . . . parsed_1bzk 1
67 1 . . . parsed_1bzk 1
68 1 . . . parsed_1bzk 1
69 1 . . . parsed_1bzk 1
70 1 . . . parsed_1bzk 1
71 1 . . . parsed_1bzk 1
72 1 . . . parsed_1bzk 1
73 1 . . . parsed_1bzk 1
74 1 . . . parsed_1bzk 1
75 1 . . . parsed_1bzk 1
76 1 . . . parsed_1bzk 1
77 1 . . . parsed_1bzk 1
78 1 . . . parsed_1bzk 1
79 1 . . . parsed_1bzk 1
80 1 . . . parsed_1bzk 1
81 1 . . . parsed_1bzk 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 . . . . . . . . . 5 . HN parsed_1bzk 1
1 1 2 . . . . . . . . . 6 . HN parsed_1bzk 1
2 1 1 . . . . . . . . . 6 . HN parsed_1bzk 1
2 1 2 . . . . . . . . . 7 . HN parsed_1bzk 1
3 1 1 . . . . . . . . . 7 . HN parsed_1bzk 1
3 1 2 . . . . . . . . . 8 . HN parsed_1bzk 1
4 1 1 . . . . . . . . . 8 . HN parsed_1bzk 1
4 1 2 . . . . . . . . . 9 . HN parsed_1bzk 1
5 1 1 . . . . . . . . . 9 . HN parsed_1bzk 1
5 1 2 . . . . . . . . . 10 . HN parsed_1bzk 1
6 1 1 . . . . . . . . . 10 . HN parsed_1bzk 1
6 1 2 . . . . . . . . . 11 . HN parsed_1bzk 1
7 1 1 . . . . . . . . . 11 . HN parsed_1bzk 1
7 1 2 . . . . . . . . . 12 . HN parsed_1bzk 1
8 1 1 . . . . . . . . . 12 . HN parsed_1bzk 1
8 1 2 . . . . . . . . . 13 . HN parsed_1bzk 1
9 1 1 . . . . . . . . . 13 . HN parsed_1bzk 1
9 1 2 . . . . . . . . . 14 . HN parsed_1bzk 1
10 1 1 . . . . . . . . . 14 . HN parsed_1bzk 1
10 1 2 . . . . . . . . . 15 . HN parsed_1bzk 1
11 1 1 . . . . . . . . . 17 . HN parsed_1bzk 1
11 1 2 . . . . . . . . . 18 . HN parsed_1bzk 1
12 1 1 . . . . . . . . . 18 . HN parsed_1bzk 1
12 1 2 . . . . . . . . . 19 . HN parsed_1bzk 1
13 1 1 . . . . . . . . . 19 . HN parsed_1bzk 1
13 1 2 . . . . . . . . . 20 . HN parsed_1bzk 1
14 1 1 . . . . . . . . . 20 . HN parsed_1bzk 1
14 1 2 . . . . . . . . . 21 . HN parsed_1bzk 1
15 1 1 . . . . . . . . . 21 . HN parsed_1bzk 1
15 1 2 . . . . . . . . . 22 . HN parsed_1bzk 1
16 1 1 . . . . . . . . . 24 . HN parsed_1bzk 1
16 1 2 . . . . . . . . . 25 . HN parsed_1bzk 1
17 1 1 . . . . . . . . . 25 . HN parsed_1bzk 1
17 1 2 . . . . . . . . . 26 . HN parsed_1bzk 1
18 1 1 . . . . . . . . . 26 . HN parsed_1bzk 1
18 1 2 . . . . . . . . . 27 . HN parsed_1bzk 1
19 1 1 . . . . . . . . . 27 . HN parsed_1bzk 1
19 1 2 . . . . . . . . . 28 . HN parsed_1bzk 1
20 1 1 . . . . . . . . . 28 . HN parsed_1bzk 1
20 1 2 . . . . . . . . . 29 . HN parsed_1bzk 1
21 1 1 . . . . . . . . . 29 . HN parsed_1bzk 1
21 1 2 . . . . . . . . . 30 . HN parsed_1bzk 1
22 1 1 . . . . . . . . . 30 . HN parsed_1bzk 1
22 1 2 . . . . . . . . . 31 . HN parsed_1bzk 1
23 1 1 . . . . . . . . . 33 . HN parsed_1bzk 1
23 1 2 . . . . . . . . . 34 . HN parsed_1bzk 1
24 1 1 . . . . . . . . . 34 . HN parsed_1bzk 1
24 1 2 . . . . . . . . . 35 . HN parsed_1bzk 1
25 1 1 . . . . . . . . . 35 . HN parsed_1bzk 1
25 1 2 . . . . . . . . . 36 . HN parsed_1bzk 1
26 1 1 . . . . . . . . . 38 . HN parsed_1bzk 1
26 1 2 . . . . . . . . . 39 . HN parsed_1bzk 1
27 1 1 . . . . . . . . . 40 . HN parsed_1bzk 1
27 1 2 . . . . . . . . . 41 . HN parsed_1bzk 1
28 1 1 . . . . . . . . . 42 . HN parsed_1bzk 1
28 1 2 . . . . . . . . . 43 . HN parsed_1bzk 1
29 1 1 . . . . . . . . . 5 . HA parsed_1bzk 1
29 1 2 . . . . . . . . . 6 . HN parsed_1bzk 1
30 1 1 . . . . . . . . . 6 . HA parsed_1bzk 1
30 1 2 . . . . . . . . . 7 . HN parsed_1bzk 1
31 1 1 . . . . . . . . . 8 . HA parsed_1bzk 1
31 1 2 . . . . . . . . . 9 . HN parsed_1bzk 1
32 1 1 . . . . . . . . . 10 . HA parsed_1bzk 1
32 1 2 . . . . . . . . . 11 . HN parsed_1bzk 1
33 1 1 . . . . . . . . . 11 . HA parsed_1bzk 1
33 1 2 . . . . . . . . . 12 . HN parsed_1bzk 1
34 1 1 . . . . . . . . . 14 . HA parsed_1bzk 1
34 1 2 . . . . . . . . . 15 . HN parsed_1bzk 1
35 1 1 . . . . . . . . . 17 . HA parsed_1bzk 1
35 1 2 . . . . . . . . . 18 . HN parsed_1bzk 1
36 1 1 . . . . . . . . . 21 . HA parsed_1bzk 1
36 1 2 . . . . . . . . . 22 . HN parsed_1bzk 1
37 1 1 . . . . . . . . . 24 . HA parsed_1bzk 1
37 1 2 . . . . . . . . . 25 . HN parsed_1bzk 1
38 1 1 . . . . . . . . . 25 . HA parsed_1bzk 1
38 1 2 . . . . . . . . . 26 . HN parsed_1bzk 1
39 1 1 . . . . . . . . . 26 . HA parsed_1bzk 1
39 1 2 . . . . . . . . . 27 . HN parsed_1bzk 1
40 1 1 . . . . . . . . . 27 . HA parsed_1bzk 1
40 1 2 . . . . . . . . . 28 . HN parsed_1bzk 1
41 1 1 . . . . . . . . . 29 . HA parsed_1bzk 1
41 1 2 . . . . . . . . . 30 . HN parsed_1bzk 1
42 1 1 . . . . . . . . . 30 . HA parsed_1bzk 1
42 1 2 . . . . . . . . . 31 . HN parsed_1bzk 1
43 1 1 . . . . . . . . . 33 . HA parsed_1bzk 1
43 1 2 . . . . . . . . . 34 . HN parsed_1bzk 1
44 1 1 . . . . . . . . . 35 . HA parsed_1bzk 1
44 1 2 . . . . . . . . . 36 . HN parsed_1bzk 1
45 1 1 . . . . . . . . . 41 . HA1 parsed_1bzk 1
45 1 2 . . . . . . . . . 42 . HN parsed_1bzk 1
46 1 1 . . . . . . . . . 41 . HA2 parsed_1bzk 1
46 1 2 . . . . . . . . . 42 . HN parsed_1bzk 1
47 1 1 . . . . . . . . . 42 . HA parsed_1bzk 1
47 1 2 . . . . . . . . . 43 . HN parsed_1bzk 1
48 1 1 . . . . . . . . . 4 . HB1 parsed_1bzk 1
48 1 2 . . . . . . . . . 5 . HN parsed_1bzk 1
49 1 1 . . . . . . . . . 4 . HB2 parsed_1bzk 1
49 1 2 . . . . . . . . . 5 . HN parsed_1bzk 1
50 1 1 . . . . . . . . . 5 . HB* parsed_1bzk 1
50 1 2 . . . . . . . . . 6 . HN parsed_1bzk 1
51 1 1 . . . . . . . . . 6 . HB* parsed_1bzk 1
51 1 2 . . . . . . . . . 7 . HN parsed_1bzk 1
52 1 1 . . . . . . . . . 7 . HB* parsed_1bzk 1
52 1 2 . . . . . . . . . 8 . HN parsed_1bzk 1
53 1 1 . . . . . . . . . 9 . HB1 parsed_1bzk 1
53 1 2 . . . . . . . . . 10 . HN parsed_1bzk 1
54 1 1 . . . . . . . . . 9 . HB2 parsed_1bzk 1
54 1 2 . . . . . . . . . 10 . HN parsed_1bzk 1
55 1 1 . . . . . . . . . 10 . HB parsed_1bzk 1
55 1 2 . . . . . . . . . 11 . HN parsed_1bzk 1
56 1 1 . . . . . . . . . 11 . HB* parsed_1bzk 1
56 1 2 . . . . . . . . . 12 . HN parsed_1bzk 1
57 1 1 . . . . . . . . . 14 . HB* parsed_1bzk 1
57 1 2 . . . . . . . . . 15 . HN parsed_1bzk 1
58 1 1 . . . . . . . . . 18 . HB parsed_1bzk 1
58 1 2 . . . . . . . . . 19 . HN parsed_1bzk 1
59 1 1 . . . . . . . . . 19 . HB* parsed_1bzk 1
59 1 2 . . . . . . . . . 20 . HN parsed_1bzk 1
60 1 1 . . . . . . . . . 20 . HB* parsed_1bzk 1
60 1 2 . . . . . . . . . 21 . HN parsed_1bzk 1
61 1 1 . . . . . . . . . 21 . HB* parsed_1bzk 1
61 1 2 . . . . . . . . . 22 . HN parsed_1bzk 1
62 1 1 . . . . . . . . . 23 . HB parsed_1bzk 1
62 1 2 . . . . . . . . . 24 . HN parsed_1bzk 1
63 1 1 . . . . . . . . . 24 . HB1 parsed_1bzk 1
63 1 2 . . . . . . . . . 25 . HN parsed_1bzk 1
64 1 1 . . . . . . . . . 24 . HB2 parsed_1bzk 1
64 1 2 . . . . . . . . . 25 . HN parsed_1bzk 1
65 1 1 . . . . . . . . . 25 . HB parsed_1bzk 1
65 1 2 . . . . . . . . . 26 . HN parsed_1bzk 1
66 1 1 . . . . . . . . . 27 . HB* parsed_1bzk 1
66 1 2 . . . . . . . . . 28 . HN parsed_1bzk 1
67 1 1 . . . . . . . . . 28 . HB* parsed_1bzk 1
67 1 2 . . . . . . . . . 29 . HN parsed_1bzk 1
68 1 1 . . . . . . . . . 29 . HB* parsed_1bzk 1
68 1 2 . . . . . . . . . 30 . HN parsed_1bzk 1
69 1 1 . . . . . . . . . 30 . HB* parsed_1bzk 1
69 1 2 . . . . . . . . . 31 . HN parsed_1bzk 1
70 1 1 . . . . . . . . . 32 . HB1 parsed_1bzk 1
70 1 2 . . . . . . . . . 33 . HN parsed_1bzk 1
71 1 1 . . . . . . . . . 32 . HB2 parsed_1bzk 1
71 1 2 . . . . . . . . . 33 . HN parsed_1bzk 1
72 1 1 . . . . . . . . . 33 . HB* parsed_1bzk 1
72 1 2 . . . . . . . . . 34 . HN parsed_1bzk 1
73 1 1 . . . . . . . . . 34 . HB parsed_1bzk 1
73 1 2 . . . . . . . . . 35 . HN parsed_1bzk 1
74 1 1 . . . . . . . . . 36 . HB parsed_1bzk 1
74 1 2 . . . . . . . . . 37 . HN parsed_1bzk 1
75 1 1 . . . . . . . . . 3 . HA parsed_1bzk 1
75 1 2 . . . . . . . . . 4 . HD1 parsed_1bzk 1
76 1 1 . . . . . . . . . 3 . HA parsed_1bzk 1
76 1 2 . . . . . . . . . 4 . HD2 parsed_1bzk 1
77 1 1 . . . . . . . . . 15 . HN parsed_1bzk 1
77 1 2 . . . . . . . . . 16 . HD1 parsed_1bzk 1
78 1 1 . . . . . . . . . 16 . HD1 parsed_1bzk 1
78 1 2 . . . . . . . . . 17 . HN parsed_1bzk 1
79 1 1 . . . . . . . . . 31 . HA parsed_1bzk 1
79 1 2 . . . . . . . . . 32 . HD1 parsed_1bzk 1
80 1 1 . . . . . . . . . 31 . HN parsed_1bzk 1
80 1 2 . . . . . . . . . 32 . HD* parsed_1bzk 1
81 1 1 . . . . . . . . . 32 . HD* parsed_1bzk 1
81 1 2 . . . . . . . . . 33 . HN parsed_1bzk 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 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
2 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
3 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
4 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
5 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
6 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
7 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
8 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
9 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
10 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
11 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
12 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
13 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
14 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
15 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
16 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
17 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
18 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
19 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
20 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
21 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
22 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
23 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
24 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
25 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
26 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
27 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
28 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
29 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
30 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
31 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
32 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
33 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
34 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
35 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
36 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
37 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
38 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
39 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
40 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
41 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
42 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
43 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
44 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
45 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
46 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
47 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
48 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
49 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
50 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
51 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
52 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
53 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
54 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
55 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
56 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
57 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
58 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
59 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
60 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
61 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
62 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
63 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
64 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
65 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
66 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
67 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
68 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 1
69 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
70 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
71 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
72 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
73 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
74 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
75 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
76 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 1
77 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
78 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
79 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
80 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 1
81 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 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 HN(i)-HN(i+1) 1 1 1 15 parsed_1bzk 1
2 HA(i)-HN(i+1) 30 1 30 15 parsed_1bzk 1
3 HB(i)-HN(i+1) 50 1 50 15 parsed_1bzk 1
4 "misc pro" 78 1 78 10 parsed_1bzk 1
5 "assign (resid 31 and name HA )(resid 32 and name HD2 ) 3.0 3.0 0.5" 84 1 84 75 parsed_1bzk 1
stop_
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1bzk
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "clas short"
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bzk
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_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_1bzk 2
2 1 . . . parsed_1bzk 2
3 1 . . . parsed_1bzk 2
4 1 . . . parsed_1bzk 2
5 1 . . . parsed_1bzk 2
6 1 . . . parsed_1bzk 2
7 1 . . . parsed_1bzk 2
8 1 . . . parsed_1bzk 2
9 1 . . . parsed_1bzk 2
10 1 . . . parsed_1bzk 2
11 1 . . . parsed_1bzk 2
12 1 . . . parsed_1bzk 2
13 1 . . . parsed_1bzk 2
14 1 . . . parsed_1bzk 2
15 1 . . . parsed_1bzk 2
16 1 . . . parsed_1bzk 2
17 1 . . . parsed_1bzk 2
18 1 . . . parsed_1bzk 2
19 1 . . . parsed_1bzk 2
20 1 . . . parsed_1bzk 2
21 1 . . . parsed_1bzk 2
22 1 . . . parsed_1bzk 2
23 1 . . . parsed_1bzk 2
24 1 . . . parsed_1bzk 2
25 1 . . . parsed_1bzk 2
26 1 . . . parsed_1bzk 2
27 1 . . . parsed_1bzk 2
28 1 . . . parsed_1bzk 2
29 1 . . . parsed_1bzk 2
30 1 . . . parsed_1bzk 2
31 1 . . . parsed_1bzk 2
32 1 . . . parsed_1bzk 2
33 1 . . . parsed_1bzk 2
34 1 . . . parsed_1bzk 2
35 1 . . . parsed_1bzk 2
36 1 . . . parsed_1bzk 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 . . . . . . . . . 4 . HA parsed_1bzk 2
1 1 2 . . . . . . . . . 7 . HN parsed_1bzk 2
2 1 1 . . . . . . . . . 6 . HA parsed_1bzk 2
2 1 2 . . . . . . . . . 9 . HN parsed_1bzk 2
3 1 1 . . . . . . . . . 15 . HA parsed_1bzk 2
3 1 2 . . . . . . . . . 18 . HN parsed_1bzk 2
4 1 1 . . . . . . . . . 16 . HA parsed_1bzk 2
4 1 2 . . . . . . . . . 19 . HN parsed_1bzk 2
5 1 1 . . . . . . . . . 18 . HA parsed_1bzk 2
5 1 2 . . . . . . . . . 21 . HN parsed_1bzk 2
6 1 1 . . . . . . . . . 20 . HA parsed_1bzk 2
6 1 2 . . . . . . . . . 23 . HN parsed_1bzk 2
7 1 1 . . . . . . . . . 21 . HA parsed_1bzk 2
7 1 2 . . . . . . . . . 24 . HN parsed_1bzk 2
8 1 1 . . . . . . . . . 23 . HA parsed_1bzk 2
8 1 2 . . . . . . . . . 26 . HN parsed_1bzk 2
9 1 1 . . . . . . . . . 24 . HA parsed_1bzk 2
9 1 2 . . . . . . . . . 27 . HN parsed_1bzk 2
10 1 1 . . . . . . . . . 25 . HA parsed_1bzk 2
10 1 2 . . . . . . . . . 28 . HN parsed_1bzk 2
11 1 1 . . . . . . . . . 7 . HA parsed_1bzk 2
11 1 2 . . . . . . . . . 11 . HN parsed_1bzk 2
12 1 1 . . . . . . . . . 8 . HA parsed_1bzk 2
12 1 2 . . . . . . . . . 12 . HN parsed_1bzk 2
13 1 1 . . . . . . . . . 16 . HA parsed_1bzk 2
13 1 2 . . . . . . . . . 20 . HN parsed_1bzk 2
14 1 1 . . . . . . . . . 17 . HA parsed_1bzk 2
14 1 2 . . . . . . . . . 21 . HN parsed_1bzk 2
15 1 1 . . . . . . . . . 23 . HA parsed_1bzk 2
15 1 2 . . . . . . . . . 27 . HN parsed_1bzk 2
16 1 1 . . . . . . . . . 25 . HA parsed_1bzk 2
16 1 2 . . . . . . . . . 29 . HN parsed_1bzk 2
17 1 1 . . . . . . . . . 26 . HA parsed_1bzk 2
17 1 2 . . . . . . . . . 30 . HN parsed_1bzk 2
18 1 1 . . . . . . . . . 27 . HA parsed_1bzk 2
18 1 2 . . . . . . . . . 31 . HN parsed_1bzk 2
19 1 1 . . . . . . . . . 30 . HA parsed_1bzk 2
19 1 2 . . . . . . . . . 34 . HN parsed_1bzk 2
20 1 1 . . . . . . . . . 3 . HA parsed_1bzk 2
20 1 2 . . . . . . . . . 6 . HB* parsed_1bzk 2
21 1 1 . . . . . . . . . 4 . HA parsed_1bzk 2
21 1 2 . . . . . . . . . 7 . HB* parsed_1bzk 2
22 1 1 . . . . . . . . . 6 . HA parsed_1bzk 2
22 1 2 . . . . . . . . . 9 . HB* parsed_1bzk 2
23 1 1 . . . . . . . . . 10 . HA parsed_1bzk 2
23 1 2 . . . . . . . . . 13 . HB parsed_1bzk 2
24 1 1 . . . . . . . . . 11 . HA parsed_1bzk 2
24 1 2 . . . . . . . . . 14 . HB* parsed_1bzk 2
25 1 1 . . . . . . . . . 15 . HA parsed_1bzk 2
25 1 2 . . . . . . . . . 18 . HB parsed_1bzk 2
26 1 1 . . . . . . . . . 17 . HA parsed_1bzk 2
26 1 2 . . . . . . . . . 20 . HB* parsed_1bzk 2
27 1 1 . . . . . . . . . 18 . HA parsed_1bzk 2
27 1 2 . . . . . . . . . 21 . HB* parsed_1bzk 2
28 1 1 . . . . . . . . . 19 . HA parsed_1bzk 2
28 1 2 . . . . . . . . . 22 . HB parsed_1bzk 2
29 1 1 . . . . . . . . . 20 . HA parsed_1bzk 2
29 1 2 . . . . . . . . . 23 . HB parsed_1bzk 2
30 1 1 . . . . . . . . . 21 . HA parsed_1bzk 2
30 1 2 . . . . . . . . . 24 . HB* parsed_1bzk 2
31 1 1 . . . . . . . . . 22 . HA parsed_1bzk 2
31 1 2 . . . . . . . . . 25 . HB* parsed_1bzk 2
32 1 1 . . . . . . . . . 23 . HA parsed_1bzk 2
32 1 2 . . . . . . . . . 26 . HB* parsed_1bzk 2
33 1 1 . . . . . . . . . 24 . HA parsed_1bzk 2
33 1 2 . . . . . . . . . 27 . HB* parsed_1bzk 2
34 1 1 . . . . . . . . . 25 . HA parsed_1bzk 2
34 1 2 . . . . . . . . . 28 . HB* parsed_1bzk 2
35 1 1 . . . . . . . . . 30 . HA parsed_1bzk 2
35 1 2 . . . . . . . . . 33 . HB* parsed_1bzk 2
36 1 1 . . . . . . . . . 33 . HA parsed_1bzk 2
36 1 2 . . . . . . . . . 36 . HB* parsed_1bzk 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_1bzk 2
2 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
3 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
4 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
5 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
6 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
7 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
8 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
9 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
10 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
11 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
12 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
13 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
14 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
15 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
16 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
17 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
18 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
19 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
20 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
21 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
22 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
23 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
24 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
25 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
26 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
27 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
28 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
29 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
30 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
31 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 2
32 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
33 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
34 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 2
35 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 2
36 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 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 15 parsed_1bzk 2
2 HA(i)-HN(i+4) 12 1 12 15 parsed_1bzk 2
3 HA(i)-HB(i+3) 22 1 22 15 parsed_1bzk 2
stop_
save_
save_MR_file_comment_7
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1bzk
_Org_constr_file_comment.ID 4
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 7
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "clas intra"
save_
save_CNS/XPLOR_distance_constraints_8
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bzk
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 8
_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_1bzk 3
2 1 . . . parsed_1bzk 3
3 1 . . . parsed_1bzk 3
4 1 . . . parsed_1bzk 3
5 1 . . . parsed_1bzk 3
6 1 . . . parsed_1bzk 3
7 1 . . . parsed_1bzk 3
8 1 . . . parsed_1bzk 3
9 1 . . . parsed_1bzk 3
10 1 . . . parsed_1bzk 3
11 1 . . . parsed_1bzk 3
12 1 . . . parsed_1bzk 3
13 1 . . . parsed_1bzk 3
14 1 . . . parsed_1bzk 3
15 1 . . . parsed_1bzk 3
16 1 . . . parsed_1bzk 3
17 1 . . . parsed_1bzk 3
18 1 . . . parsed_1bzk 3
19 1 . . . parsed_1bzk 3
20 1 . . . parsed_1bzk 3
21 1 . . . parsed_1bzk 3
22 1 . . . parsed_1bzk 3
23 1 . . . parsed_1bzk 3
24 1 . . . parsed_1bzk 3
25 1 . . . parsed_1bzk 3
26 1 . . . parsed_1bzk 3
27 1 . . . parsed_1bzk 3
28 1 . . . parsed_1bzk 3
29 1 . . . parsed_1bzk 3
30 1 . . . parsed_1bzk 3
31 1 . . . parsed_1bzk 3
32 1 . . . parsed_1bzk 3
33 1 . . . parsed_1bzk 3
34 1 . . . parsed_1bzk 3
35 1 . . . parsed_1bzk 3
36 1 . . . parsed_1bzk 3
37 1 . . . parsed_1bzk 3
38 1 . . . parsed_1bzk 3
39 1 . . . parsed_1bzk 3
40 1 . . . parsed_1bzk 3
41 1 . . . parsed_1bzk 3
42 1 . . . parsed_1bzk 3
43 1 . . . parsed_1bzk 3
44 1 . . . parsed_1bzk 3
45 1 . . . parsed_1bzk 3
46 1 . . . parsed_1bzk 3
47 1 . . . parsed_1bzk 3
48 1 . . . parsed_1bzk 3
49 1 . . . parsed_1bzk 3
50 1 . . . parsed_1bzk 3
51 1 . . . parsed_1bzk 3
52 1 . . . parsed_1bzk 3
53 1 . . . parsed_1bzk 3
54 1 . . . parsed_1bzk 3
55 1 . . . parsed_1bzk 3
56 1 . . . parsed_1bzk 3
57 1 . . . parsed_1bzk 3
58 1 . . . parsed_1bzk 3
59 1 . . . parsed_1bzk 3
60 1 . . . parsed_1bzk 3
61 1 . . . parsed_1bzk 3
62 1 . . . parsed_1bzk 3
63 1 . . . parsed_1bzk 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 . . . . . . . . . 3 . HN parsed_1bzk 3
1 1 2 . . . . . . . . . 3 . HA parsed_1bzk 3
2 1 1 . . . . . . . . . 5 . HN parsed_1bzk 3
2 1 2 . . . . . . . . . 5 . HA parsed_1bzk 3
3 1 1 . . . . . . . . . 7 . HN parsed_1bzk 3
3 1 2 . . . . . . . . . 7 . HA parsed_1bzk 3
4 1 1 . . . . . . . . . 8 . HN parsed_1bzk 3
4 1 2 . . . . . . . . . 8 . HA parsed_1bzk 3
5 1 1 . . . . . . . . . 9 . HN parsed_1bzk 3
5 1 2 . . . . . . . . . 9 . HA parsed_1bzk 3
6 1 1 . . . . . . . . . 10 . HN parsed_1bzk 3
6 1 2 . . . . . . . . . 10 . HA parsed_1bzk 3
7 1 1 . . . . . . . . . 11 . HN parsed_1bzk 3
7 1 2 . . . . . . . . . 11 . HA parsed_1bzk 3
8 1 1 . . . . . . . . . 12 . HN parsed_1bzk 3
8 1 2 . . . . . . . . . 12 . HA parsed_1bzk 3
9 1 1 . . . . . . . . . 13 . HN parsed_1bzk 3
9 1 2 . . . . . . . . . 13 . HA parsed_1bzk 3
10 1 1 . . . . . . . . . 14 . HN parsed_1bzk 3
10 1 2 . . . . . . . . . 14 . HA parsed_1bzk 3
11 1 1 . . . . . . . . . 15 . HN parsed_1bzk 3
11 1 2 . . . . . . . . . 15 . HA parsed_1bzk 3
12 1 1 . . . . . . . . . 17 . HN parsed_1bzk 3
12 1 2 . . . . . . . . . 17 . HA parsed_1bzk 3
13 1 1 . . . . . . . . . 19 . HN parsed_1bzk 3
13 1 2 . . . . . . . . . 19 . HA parsed_1bzk 3
14 1 1 . . . . . . . . . 22 . HN parsed_1bzk 3
14 1 2 . . . . . . . . . 22 . HA parsed_1bzk 3
15 1 1 . . . . . . . . . 24 . HN parsed_1bzk 3
15 1 2 . . . . . . . . . 24 . HA parsed_1bzk 3
16 1 1 . . . . . . . . . 25 . HN parsed_1bzk 3
16 1 2 . . . . . . . . . 25 . HA parsed_1bzk 3
17 1 1 . . . . . . . . . 26 . HN parsed_1bzk 3
17 1 2 . . . . . . . . . 26 . HA parsed_1bzk 3
18 1 1 . . . . . . . . . 27 . HN parsed_1bzk 3
18 1 2 . . . . . . . . . 27 . HA parsed_1bzk 3
19 1 1 . . . . . . . . . 28 . HN parsed_1bzk 3
19 1 2 . . . . . . . . . 28 . HA parsed_1bzk 3
20 1 1 . . . . . . . . . 29 . HN parsed_1bzk 3
20 1 2 . . . . . . . . . 29 . HA parsed_1bzk 3
21 1 1 . . . . . . . . . 30 . HN parsed_1bzk 3
21 1 2 . . . . . . . . . 30 . HA parsed_1bzk 3
22 1 1 . . . . . . . . . 31 . HN parsed_1bzk 3
22 1 2 . . . . . . . . . 31 . HA parsed_1bzk 3
23 1 1 . . . . . . . . . 33 . HN parsed_1bzk 3
23 1 2 . . . . . . . . . 33 . HA parsed_1bzk 3
24 1 1 . . . . . . . . . 34 . HN parsed_1bzk 3
24 1 2 . . . . . . . . . 34 . HA parsed_1bzk 3
25 1 1 . . . . . . . . . 35 . HN parsed_1bzk 3
25 1 2 . . . . . . . . . 35 . HA parsed_1bzk 3
26 1 1 . . . . . . . . . 36 . HN parsed_1bzk 3
26 1 2 . . . . . . . . . 36 . HA parsed_1bzk 3
27 1 1 . . . . . . . . . 42 . HN parsed_1bzk 3
27 1 2 . . . . . . . . . 42 . HA parsed_1bzk 3
28 1 1 . . . . . . . . . 3 . HN parsed_1bzk 3
28 1 2 . . . . . . . . . 3 . HB1 parsed_1bzk 3
29 1 1 . . . . . . . . . 3 . HN parsed_1bzk 3
29 1 2 . . . . . . . . . 3 . HB2 parsed_1bzk 3
30 1 1 . . . . . . . . . 5 . HN parsed_1bzk 3
30 1 2 . . . . . . . . . 5 . HB1 parsed_1bzk 3
31 1 1 . . . . . . . . . 5 . HN parsed_1bzk 3
31 1 2 . . . . . . . . . 5 . HB2 parsed_1bzk 3
32 1 1 . . . . . . . . . 6 . HN parsed_1bzk 3
32 1 2 . . . . . . . . . 6 . HB* parsed_1bzk 3
33 1 1 . . . . . . . . . 10 . HN parsed_1bzk 3
33 1 2 . . . . . . . . . 10 . HB parsed_1bzk 3
34 1 1 . . . . . . . . . 13 . HN parsed_1bzk 3
34 1 2 . . . . . . . . . 13 . HB parsed_1bzk 3
35 1 1 . . . . . . . . . 15 . HN parsed_1bzk 3
35 1 2 . . . . . . . . . 15 . HB* parsed_1bzk 3
36 1 1 . . . . . . . . . 17 . HN parsed_1bzk 3
36 1 2 . . . . . . . . . 17 . HB* parsed_1bzk 3
37 1 1 . . . . . . . . . 19 . HN parsed_1bzk 3
37 1 2 . . . . . . . . . 19 . HB* parsed_1bzk 3
38 1 1 . . . . . . . . . 20 . HN parsed_1bzk 3
38 1 2 . . . . . . . . . 20 . HB* parsed_1bzk 3
39 1 1 . . . . . . . . . 22 . HN parsed_1bzk 3
39 1 2 . . . . . . . . . 22 . HB* parsed_1bzk 3
40 1 1 . . . . . . . . . 24 . HN parsed_1bzk 3
40 1 2 . . . . . . . . . 24 . HB* parsed_1bzk 3
41 1 1 . . . . . . . . . 25 . HN parsed_1bzk 3
41 1 2 . . . . . . . . . 25 . HB parsed_1bzk 3
42 1 1 . . . . . . . . . 42 . HN parsed_1bzk 3
42 1 2 . . . . . . . . . 42 . HB* parsed_1bzk 3
43 1 1 . . . . . . . . . 13 . HA parsed_1bzk 3
43 1 2 . . . . . . . . . 13 . HB parsed_1bzk 3
44 1 1 . . . . . . . . . 18 . HA parsed_1bzk 3
44 1 2 . . . . . . . . . 18 . HB* parsed_1bzk 3
45 1 1 . . . . . . . . . 39 . HG parsed_1bzk 3
45 1 2 . . . . . . . . . 39 . HD2* parsed_1bzk 3
46 1 1 . . . . . . . . . 39 . HG parsed_1bzk 3
46 1 2 . . . . . . . . . 39 . HD1* parsed_1bzk 3
47 1 1 . . . . . . . . . 40 . HG parsed_1bzk 3
47 1 2 . . . . . . . . . 40 . HD1* parsed_1bzk 3
48 1 1 . . . . . . . . . 40 . HG parsed_1bzk 3
48 1 2 . . . . . . . . . 40 . HD2* parsed_1bzk 3
49 1 1 . . . . . . . . . 11 . HN parsed_1bzk 3
49 1 2 . . . . . . . . . 11 . HG2* parsed_1bzk 3
50 1 1 . . . . . . . . . 11 . HA parsed_1bzk 3
50 1 2 . . . . . . . . . 11 . HG2* parsed_1bzk 3
51 1 1 . . . . . . . . . 11 . HB parsed_1bzk 3
51 1 2 . . . . . . . . . 11 . HG2* parsed_1bzk 3
52 1 1 . . . . . . . . . 13 . HB parsed_1bzk 3
52 1 2 . . . . . . . . . 13 . HG1* parsed_1bzk 3
53 1 1 . . . . . . . . . 13 . HB parsed_1bzk 3
53 1 2 . . . . . . . . . 13 . HG2* parsed_1bzk 3
54 1 1 . . . . . . . . . 13 . HG1* parsed_1bzk 3
54 1 2 . . . . . . . . . 13 . HG2* parsed_1bzk 3
55 1 1 . . . . . . . . . 4 . HB1 parsed_1bzk 3
55 1 2 . . . . . . . . . 4 . HB2 parsed_1bzk 3
56 1 1 . . . . . . . . . 4 . HD1 parsed_1bzk 3
56 1 2 . . . . . . . . . 4 . HD2 parsed_1bzk 3
57 1 1 . . . . . . . . . 16 . HB1 parsed_1bzk 3
57 1 2 . . . . . . . . . 16 . HB2 parsed_1bzk 3
58 1 1 . . . . . . . . . 16 . HD1 parsed_1bzk 3
58 1 2 . . . . . . . . . 16 . HD2 parsed_1bzk 3
59 1 1 . . . . . . . . . 32 . HB1 parsed_1bzk 3
59 1 2 . . . . . . . . . 32 . HB2 parsed_1bzk 3
60 1 1 . . . . . . . . . 32 . HD1 parsed_1bzk 3
60 1 2 . . . . . . . . . 32 . HD2 parsed_1bzk 3
61 1 1 . . . . . . . . . 37 . HA1 parsed_1bzk 3
61 1 2 . . . . . . . . . 37 . HA2 parsed_1bzk 3
62 1 1 . . . . . . . . . 38 . HA1 parsed_1bzk 3
62 1 2 . . . . . . . . . 38 . HA2 parsed_1bzk 3
63 1 1 . . . . . . . . . 41 . HA1 parsed_1bzk 3
63 1 2 . . . . . . . . . 41 . HA2 parsed_1bzk 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_1bzk 3
2 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
3 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
4 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
5 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
6 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
7 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
8 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
9 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
10 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
11 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
12 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
13 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
14 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
15 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
16 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
17 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
18 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
19 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
20 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
21 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
22 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
23 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
24 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
25 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
26 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
27 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
28 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 3
29 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 3
30 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 3
31 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 3
32 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
33 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
34 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
35 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
36 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
37 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
38 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
39 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
40 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
41 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 3
42 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 3
43 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
44 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
45 1 . . . . . 2.5 0.0 4.0 parsed_1bzk 3
46 1 . . . . . 2.5 0.0 4.0 parsed_1bzk 3
47 1 . . . . . 2.5 0.0 3.0 parsed_1bzk 3
48 1 . . . . . 2.5 0.0 3.0 parsed_1bzk 3
49 1 . . . . . 3.0 0.0 3.5 parsed_1bzk 3
50 1 . . . . . 4.0 0.0 5.0 parsed_1bzk 3
51 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
52 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
53 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
54 1 . . . . . 2.5 0.0 3.5 parsed_1bzk 3
55 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
56 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
57 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
58 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
59 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
60 1 . . . . . 2.5 0.0 2.9 parsed_1bzk 3
61 1 . . . . . 1.8 0.0 2.0 parsed_1bzk 3
62 1 . . . . . 1.8 0.0 2.0 parsed_1bzk 3
63 1 . . . . . 1.8 0.0 2.0 parsed_1bzk 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 13 parsed_1bzk 3
2 HN(i)-HB(i) 29 1 29 13 parsed_1bzk 3
3 HA(i)-HB(i) 45 1 45 13 parsed_1bzk 3
4 Leu 48 1 48 6 parsed_1bzk 3
5 Thr 53 1 53 6 parsed_1bzk 3
6 Val 57 1 57 5 parsed_1bzk 3
7 Pro 61 1 61 5 parsed_1bzk 3
8 gly 68 1 68 5 parsed_1bzk 3
stop_
save_
save_MR_file_comment_9
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1bzk
_Org_constr_file_comment.ID 5
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 9
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
!hbonds
clas hbon
;
save_
save_CNS/XPLOR_distance_constraints_10
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1bzk
_Distance_constraint_list.ID 4
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 10
_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_1bzk 4
2 1 . . . parsed_1bzk 4
3 1 . . . parsed_1bzk 4
4 1 . . . parsed_1bzk 4
5 1 . . . parsed_1bzk 4
6 1 . . . parsed_1bzk 4
7 1 . . . parsed_1bzk 4
8 1 . . . parsed_1bzk 4
9 1 . . . parsed_1bzk 4
10 1 . . . parsed_1bzk 4
11 1 . . . parsed_1bzk 4
12 1 . . . parsed_1bzk 4
13 1 . . . parsed_1bzk 4
14 1 . . . parsed_1bzk 4
15 1 . . . parsed_1bzk 4
16 1 . . . parsed_1bzk 4
17 1 . . . parsed_1bzk 4
18 1 . . . parsed_1bzk 4
19 1 . . . parsed_1bzk 4
20 1 . . . parsed_1bzk 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 . . . . . . . . . 16 . O parsed_1bzk 4
1 1 2 . . . . . . . . . 20 . N parsed_1bzk 4
2 1 1 . . . . . . . . . 17 . O parsed_1bzk 4
2 1 2 . . . . . . . . . 21 . N parsed_1bzk 4
3 1 1 . . . . . . . . . 18 . O parsed_1bzk 4
3 1 2 . . . . . . . . . 22 . N parsed_1bzk 4
4 1 1 . . . . . . . . . 19 . O parsed_1bzk 4
4 1 2 . . . . . . . . . 23 . N parsed_1bzk 4
5 1 1 . . . . . . . . . 20 . O parsed_1bzk 4
5 1 2 . . . . . . . . . 24 . N parsed_1bzk 4
6 1 1 . . . . . . . . . 21 . O parsed_1bzk 4
6 1 2 . . . . . . . . . 25 . N parsed_1bzk 4
7 1 1 . . . . . . . . . 22 . O parsed_1bzk 4
7 1 2 . . . . . . . . . 26 . N parsed_1bzk 4
8 1 1 . . . . . . . . . 23 . O parsed_1bzk 4
8 1 2 . . . . . . . . . 27 . N parsed_1bzk 4
9 1 1 . . . . . . . . . 24 . O parsed_1bzk 4
9 1 2 . . . . . . . . . 28 . N parsed_1bzk 4
10 1 1 . . . . . . . . . 25 . O parsed_1bzk 4
10 1 2 . . . . . . . . . 29 . N parsed_1bzk 4
11 1 1 . . . . . . . . . 16 . O parsed_1bzk 4
11 1 2 . . . . . . . . . 20 . HN parsed_1bzk 4
12 1 1 . . . . . . . . . 17 . O parsed_1bzk 4
12 1 2 . . . . . . . . . 21 . HN parsed_1bzk 4
13 1 1 . . . . . . . . . 18 . O parsed_1bzk 4
13 1 2 . . . . . . . . . 22 . HN parsed_1bzk 4
14 1 1 . . . . . . . . . 19 . O parsed_1bzk 4
14 1 2 . . . . . . . . . 23 . HN parsed_1bzk 4
15 1 1 . . . . . . . . . 20 . O parsed_1bzk 4
15 1 2 . . . . . . . . . 24 . HN parsed_1bzk 4
16 1 1 . . . . . . . . . 21 . O parsed_1bzk 4
16 1 2 . . . . . . . . . 25 . HN parsed_1bzk 4
17 1 1 . . . . . . . . . 22 . O parsed_1bzk 4
17 1 2 . . . . . . . . . 26 . HN parsed_1bzk 4
18 1 1 . . . . . . . . . 23 . O parsed_1bzk 4
18 1 2 . . . . . . . . . 27 . HN parsed_1bzk 4
19 1 1 . . . . . . . . . 24 . O parsed_1bzk 4
19 1 2 . . . . . . . . . 28 . HN parsed_1bzk 4
20 1 1 . . . . . . . . . 25 . O parsed_1bzk 4
20 1 2 . . . . . . . . . 29 . HN parsed_1bzk 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_1bzk 4
2 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
3 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
4 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
5 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
6 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
7 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
8 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
9 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
10 1 . . . . . 3.3 0.0 3.5 parsed_1bzk 4
11 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
12 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
13 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
14 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
15 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
16 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
17 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
18 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
19 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
20 1 . . . . . 2.3 0.0 2.5 parsed_1bzk 4
stop_
save_
save_MR_file_comment_11
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1bzk
_Org_constr_file_comment.ID 6
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 11
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
set message=on echo=on end
;
save_
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