NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
35591 |
1lvz   |
5376 | cing | 2-parsed | STAR | entry | full | 190 |
data_1lvz_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1lvz
_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_1lvz 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1lvz
_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 1lvz "Master copy" parsed_1lvz
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1lvz
_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 1lvz.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 3 distance NOE ambi 121 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 4 distance "NOE not seen" simple 8 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 11 parsed_1lvz 1
1 1lvz.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 12 parsed_1lvz 1
1 1lvz.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 9 "dipolar coupling" "Not applicable" "Not applicable" 9 parsed_1lvz 1
1 1lvz.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 11 "dipolar coupling" "Not applicable" "Not applicable" 14 parsed_1lvz 1
1 1lvz.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . XPLOR/CNS 13 "dipolar coupling" "Not applicable" "Not applicable" 15 parsed_1lvz 1
1 1lvz.mr . . n/a 14 comment "Not applicable" "Not applicable" 0 parsed_1lvz 1
1 1lvz.mr . . "MR format" 15 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1lvz 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_1lvz
_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 PEPTIDE BINDING PROTEIN 30-MAY-02 1LVZ
*TITLE METARHODOPSIN II BOUND STRUCTURE OF C-TERMINAL PEPTIDE OF
*TITLE 2 ALPHA-SUBUNIT OF TRANSDUCIN
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: GUANINE NUCLEOTIDE-BINDING PROTEIN G(T), ALPHA-1
*COMPND 3 SUBUNIT;
*COMPND 4 CHAIN: A;
*COMPND 5 FRAGMENT: S2 PEPTIDE, RESIDUES 339-349;
*COMPND 6 SYNONYM: TRANSDUCIN ALPHA-1 CHAIN;
*COMPND 7 ENGINEERED: YES;
*COMPND 8 MUTATION: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS;
*SOURCE 3 ORGANISM_COMMON: BOVINE;
*SOURCE 4 GENE: GNAT1;
*SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 6 EXPRESSION_SYSTEM_COMMON: BACTERIA;
*SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 8 EXPRESSION_SYSTEM_PLASMID: GEV-S2
*KEYWDS ALPHA HELIX, RHODOPSIN-TRANSDUCIN COMPLEX
*EXPDTA NMR, 20 STRUCTURES
*AUTHOR B.W.KOENIG, G.KONTAXIS, D.C.MITCHELL, J.M.LOUIS, B.J.LITMAN,
*AUTHOR 2 A.BAX
*REVDAT 1 11-SEP-02 1LVZ 0
;
save_
save_MR_file_comment_2
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_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
;
The current file contains five constraint tables in XPLOR format,
1. NOE.tbl
2. Dihedral.tbl
3. Dipo_HN-N.tbl
4. Dipo_Ca-Ha.tbl
5. Dipo_sidechain.tbl
******************************************************************
************************ Start of NOE.tbl ************************
******************************************************************
;
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1lvz
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1lvz 1
2 1 . . . parsed_1lvz 1
3 1 . . . parsed_1lvz 1
4 1 . . . parsed_1lvz 1
5 1 . . . parsed_1lvz 1
6 1 . . . parsed_1lvz 1
7 1 . . . parsed_1lvz 1
8 1 . . . parsed_1lvz 1
9 1 . . . parsed_1lvz 1
10 1 . . . parsed_1lvz 1
11 1 . . . parsed_1lvz 1
12 1 . . . parsed_1lvz 1
13 1 . . . parsed_1lvz 1
14 1 . . . parsed_1lvz 1
15 1 . . . parsed_1lvz 1
16 1 . . . parsed_1lvz 1
17 1 . . . parsed_1lvz 1
18 1 . . . parsed_1lvz 1
19 1 . . . parsed_1lvz 1
20 1 . . . parsed_1lvz 1
21 1 . . . parsed_1lvz 1
22 1 . . . parsed_1lvz 1
23 1 . . . parsed_1lvz 1
24 1 . . . parsed_1lvz 1
25 1 . . . parsed_1lvz 1
26 1 . . . parsed_1lvz 1
27 1 . . . parsed_1lvz 1
28 1 . . . parsed_1lvz 1
29 1 . . . parsed_1lvz 1
30 1 . . . parsed_1lvz 1
31 1 . . . parsed_1lvz 1
32 1 . . . parsed_1lvz 1
33 1 . . . parsed_1lvz 1
34 1 . . . parsed_1lvz 1
35 1 . . . parsed_1lvz 1
36 1 . . . parsed_1lvz 1
37 1 . . . parsed_1lvz 1
38 1 . . . parsed_1lvz 1
39 1 . . . parsed_1lvz 1
40 1 . . . parsed_1lvz 1
41 1 . . . parsed_1lvz 1
42 1 . . . parsed_1lvz 1
43 1 . . . parsed_1lvz 1
44 1 . . . parsed_1lvz 1
45 1 . . . parsed_1lvz 1
46 1 . . . parsed_1lvz 1
47 1 . . . parsed_1lvz 1
48 1 . . . parsed_1lvz 1
49 1 . . . parsed_1lvz 1
50 1 . . . parsed_1lvz 1
51 1 . . . parsed_1lvz 1
52 1 . . . parsed_1lvz 1
53 1 . . . parsed_1lvz 1
54 1 . . . parsed_1lvz 1
55 1 . . . parsed_1lvz 1
56 1 . . . parsed_1lvz 1
57 1 . . . parsed_1lvz 1
58 1 . . . parsed_1lvz 1
59 1 . . . parsed_1lvz 1
60 1 . . . parsed_1lvz 1
61 1 . . . parsed_1lvz 1
62 1 . . . parsed_1lvz 1
63 1 . . . parsed_1lvz 1
64 1 . . . parsed_1lvz 1
65 1 . . . parsed_1lvz 1
66 1 . . . parsed_1lvz 1
67 1 . . . parsed_1lvz 1
68 1 . . . parsed_1lvz 1
69 1 . . . parsed_1lvz 1
70 1 . . . parsed_1lvz 1
71 1 . . . parsed_1lvz 1
72 1 . . . parsed_1lvz 1
73 1 . . . parsed_1lvz 1
74 1 . . . parsed_1lvz 1
75 1 . . . parsed_1lvz 1
76 1 . . . parsed_1lvz 1
77 1 . . . parsed_1lvz 1
78 1 . . . parsed_1lvz 1
79 1 . . . parsed_1lvz 1
80 1 . . . parsed_1lvz 1
81 1 . . . parsed_1lvz 1
82 1 . . . parsed_1lvz 1
83 1 . . . parsed_1lvz 1
84 1 . . . parsed_1lvz 1
85 1 . . . parsed_1lvz 1
86 1 . . . parsed_1lvz 1
87 1 . . . parsed_1lvz 1
88 1 . . . parsed_1lvz 1
89 1 . . . parsed_1lvz 1
90 1 . . . parsed_1lvz 1
91 1 . . . parsed_1lvz 1
92 1 . . . parsed_1lvz 1
93 1 . . . parsed_1lvz 1
94 1 . . . parsed_1lvz 1
95 1 . . . parsed_1lvz 1
96 1 . . . parsed_1lvz 1
97 1 . . . parsed_1lvz 1
98 1 . . . parsed_1lvz 1
99 1 . . . parsed_1lvz 1
100 1 . . . parsed_1lvz 1
101 1 . . . parsed_1lvz 1
102 1 . . . parsed_1lvz 1
103 1 . . . parsed_1lvz 1
104 1 . . . parsed_1lvz 1
105 1 . . . parsed_1lvz 1
106 1 . . . parsed_1lvz 1
107 1 . . . parsed_1lvz 1
108 1 . . . parsed_1lvz 1
109 1 . . . parsed_1lvz 1
110 1 . . . parsed_1lvz 1
111 1 . . . parsed_1lvz 1
112 1 . . . parsed_1lvz 1
113 1 . . . parsed_1lvz 1
114 1 . . . parsed_1lvz 1
115 1 . . . parsed_1lvz 1
116 1 . . . parsed_1lvz 1
117 1 . . . parsed_1lvz 1
118 1 . . . parsed_1lvz 1
119 1 . . . parsed_1lvz 1
120 1 . . . parsed_1lvz 1
121 1 . . . parsed_1lvz 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 . . . . . . . . . 3 . HN parsed_1lvz 1
1 1 2 . . . . . . . . . 4 . HN parsed_1lvz 1
2 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
2 1 2 . . . . . . . . . 5 . HN parsed_1lvz 1
2 1 2 . . . . . . . . . 6 . HN parsed_1lvz 1
2 1 2 . . . . . . . . . 7 . HN parsed_1lvz 1
3 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
3 1 2 . . . . . . . . . 3 . HA parsed_1lvz 1
4 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
4 1 2 . . . . . . . . . 2 . HA parsed_1lvz 1
5 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
5 1 2 . . . . . . . . . 3 . HG# parsed_1lvz 1
6 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
6 1 2 . . . . . . . . . 3 . HB# parsed_1lvz 1
7 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
7 1 2 . . . . . . . . . 2 . HB# parsed_1lvz 1
7 1 2 . . . . . . . . . 6 . HB# parsed_1lvz 1
8 1 1 . . . . . . . . . 3 . HN parsed_1lvz 1
8 1 2 . . . . . . . . . 2 . HG# parsed_1lvz 1
8 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
8 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
8 1 2 . . . . . . . . . 6 . HD# parsed_1lvz 1
9 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
9 1 2 . . . . . . . . . 5 . HN parsed_1lvz 1
9 1 2 . . . . . . . . . 6 . HN parsed_1lvz 1
9 1 2 . . . . . . . . . 7 . HN parsed_1lvz 1
10 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
10 1 2 . . . . . . . . . 4 . HA parsed_1lvz 1
11 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
11 1 2 . . . . . . . . . 3 . HA parsed_1lvz 1
12 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
12 1 2 . . . . . . . . . 2 . HA parsed_1lvz 1
13 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
13 1 2 . . . . . . . . . 1 . HA parsed_1lvz 1
14 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
14 1 2 . . . . . . . . . 4 . HB# parsed_1lvz 1
15 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
15 1 2 . . . . . . . . . 3 . HB# parsed_1lvz 1
16 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
16 1 2 . . . . . . . . . 2 . HB# parsed_1lvz 1
16 1 2 . . . . . . . . . 6 . HB# parsed_1lvz 1
17 1 1 . . . . . . . . . 4 . HN parsed_1lvz 1
17 1 2 . . . . . . . . . 1 . HD# parsed_1lvz 1
17 1 2 . . . . . . . . . 5 . HD* parsed_1lvz 1
18 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
18 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
18 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
18 1 2 . . . . . . . . . 9 . HN parsed_1lvz 1
19 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
19 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
19 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
19 1 2 . . . . . . . . . 11 . HN parsed_1lvz 1
20 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
20 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
20 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
20 1 2 . . . . . . . . . 10 . HN parsed_1lvz 1
21 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
21 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
21 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
21 1 2 . . . . . . . . . 11 . HD# parsed_1lvz 1
22 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
22 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
22 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
22 1 2 . . . . . . . . . 11 . HE# parsed_1lvz 1
23 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
23 1 2 . . . . . . . . . 4 . HA parsed_1lvz 1
24 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
24 1 2 . . . . . . . . . 5 . HA parsed_1lvz 1
25 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
25 1 2 . . . . . . . . . 1 . HA parsed_1lvz 1
26 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
26 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
26 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
26 1 2 . . . . . . . . . 11 . HB# parsed_1lvz 1
27 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
27 1 2 . . . . . . . . . 4 . HB# parsed_1lvz 1
28 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
28 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
28 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
28 1 2 . . . . . . . . . 3 . HG# parsed_1lvz 1
29 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
29 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
29 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
29 1 2 . . . . . . . . . 3 . HB# parsed_1lvz 1
30 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
30 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
30 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
30 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
30 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
31 1 1 . . . . . . . . . 5 . HN parsed_1lvz 1
31 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
31 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
31 1 2 . . . . . . . . . 5 . HD1# parsed_1lvz 1
31 1 2 . . . . . . . . . 5 . HD2# parsed_1lvz 1
32 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
32 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
32 1 2 . . . . . . . . . 7 . HA parsed_1lvz 1
33 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
33 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
33 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
34 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
34 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
34 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 1
34 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
35 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
35 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
35 1 2 . . . . . . . . . 7 . HB# parsed_1lvz 1
36 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
36 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
36 1 2 . . . . . . . . . 6 . HB# parsed_1lvz 1
37 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
37 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
37 1 2 . . . . . . . . . 6 . HG# parsed_1lvz 1
38 1 1 . . . . . . . . . 6 . HN parsed_1lvz 1
38 1 1 . . . . . . . . . 7 . HN parsed_1lvz 1
38 1 2 . . . . . . . . . 3 . HA parsed_1lvz 1
39 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
39 1 2 . . . . . . . . . 9 . HN parsed_1lvz 1
40 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
40 1 2 . . . . . . . . . 4 . HA parsed_1lvz 1
41 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
41 1 2 . . . . . . . . . 8 . HA parsed_1lvz 1
42 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
42 1 2 . . . . . . . . . 5 . HA parsed_1lvz 1
42 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
42 1 2 . . . . . . . . . 10 . HA parsed_1lvz 1
43 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
43 1 2 . . . . . . . . . 7 . HB# parsed_1lvz 1
44 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
44 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
44 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
45 1 1 . . . . . . . . . 8 . HN parsed_1lvz 1
45 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
45 1 2 . . . . . . . . . 1 . HG2# parsed_1lvz 1
45 1 2 . . . . . . . . . 5 . HD1# parsed_1lvz 1
45 1 2 . . . . . . . . . 5 . HD2# parsed_1lvz 1
45 1 2 . . . . . . . . . 10 . HD1# parsed_1lvz 1
45 1 2 . . . . . . . . . 10 . HD2# parsed_1lvz 1
46 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
46 1 2 . . . . . . . . . 10 . HN parsed_1lvz 1
47 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
47 1 2 . . . . . . . . . 11 . HE# parsed_1lvz 1
48 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
48 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
49 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
49 1 2 . . . . . . . . . 7 . HA parsed_1lvz 1
50 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
50 1 2 . . . . . . . . . 8 . HA parsed_1lvz 1
51 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
51 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
52 1 1 . . . . . . . . . 9 . HN parsed_1lvz 1
52 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
52 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
53 1 1 . . . . . . . . . 10 . HN parsed_1lvz 1
53 1 2 . . . . . . . . . 11 . HN parsed_1lvz 1
54 1 1 . . . . . . . . . 10 . HN parsed_1lvz 1
54 1 2 . . . . . . . . . 10 . HA parsed_1lvz 1
55 1 1 . . . . . . . . . 10 . HN parsed_1lvz 1
55 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 1
56 1 1 . . . . . . . . . 10 . HN parsed_1lvz 1
56 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
56 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
57 1 1 . . . . . . . . . 10 . HN parsed_1lvz 1
57 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
58 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
58 1 2 . . . . . . . . . 11 . HD# parsed_1lvz 1
59 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
59 1 2 . . . . . . . . . 11 . HA parsed_1lvz 1
60 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
60 1 2 . . . . . . . . . 10 . HA parsed_1lvz 1
61 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
61 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
62 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
62 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
63 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
63 1 2 . . . . . . . . . 11 . HB# parsed_1lvz 1
64 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
64 1 2 . . . . . . . . . 2 . HG# parsed_1lvz 1
64 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
64 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
64 1 2 . . . . . . . . . 6 . HD# parsed_1lvz 1
65 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
65 1 2 . . . . . . . . . 1 . HG1# parsed_1lvz 1
65 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
65 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
66 1 1 . . . . . . . . . 11 . HN parsed_1lvz 1
66 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
66 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
67 1 1 . . . . . . . . . 4 . HA parsed_1lvz 1
67 1 2 . . . . . . . . . 4 . HD2# parsed_1lvz 1
68 1 1 . . . . . . . . . 4 . HB# parsed_1lvz 1
68 1 2 . . . . . . . . . 4 . HD2# parsed_1lvz 1
69 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 1
69 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
69 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
70 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 1
70 1 2 . . . . . . . . . 1 . HG1# parsed_1lvz 1
70 1 2 . . . . . . . . . 6 . HG# parsed_1lvz 1
70 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
70 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
71 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 1
71 1 2 . . . . . . . . . 5 . HD1# parsed_1lvz 1
72 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
72 1 2 . . . . . . . . . 11 . HA parsed_1lvz 1
73 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
73 1 2 . . . . . . . . . 5 . HA parsed_1lvz 1
74 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
74 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
75 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
75 1 2 . . . . . . . . . 11 . HB# parsed_1lvz 1
76 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
76 1 2 . . . . . . . . . 2 . HG# parsed_1lvz 1
76 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
76 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
76 1 2 . . . . . . . . . 6 . HD# parsed_1lvz 1
77 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
77 1 2 . . . . . . . . . 6 . HG# parsed_1lvz 1
77 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
77 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
78 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
78 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
78 1 2 . . . . . . . . . 5 . HD1# parsed_1lvz 1
79 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 1
79 1 2 . . . . . . . . . 10 . HD2# parsed_1lvz 1
80 1 1 . . . . . . . . . 11 . HZ parsed_1lvz 1
80 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
80 1 2 . . . . . . . . . 5 . HD1# parsed_1lvz 1
81 1 1 . . . . . . . . . 4 . HA parsed_1lvz 1
81 1 2 . . . . . . . . . 2 . HA parsed_1lvz 1
81 1 2 . . . . . . . . . 5 . HA parsed_1lvz 1
82 1 1 . . . . . . . . . 4 . HA parsed_1lvz 1
82 1 2 . . . . . . . . . 7 . HB# parsed_1lvz 1
83 1 1 . . . . . . . . . 4 . HA parsed_1lvz 1
83 1 2 . . . . . . . . . 3 . HG# parsed_1lvz 1
84 1 1 . . . . . . . . . 7 . HA parsed_1lvz 1
84 1 2 . . . . . . . . . 8 . HA parsed_1lvz 1
85 1 1 . . . . . . . . . 7 . HA parsed_1lvz 1
85 1 2 . . . . . . . . . 6 . HA parsed_1lvz 1
86 1 1 . . . . . . . . . 7 . HA parsed_1lvz 1
86 1 2 . . . . . . . . . 7 . HB# parsed_1lvz 1
87 1 1 . . . . . . . . . 11 . HA parsed_1lvz 1
87 1 2 . . . . . . . . . 11 . HB# parsed_1lvz 1
88 1 1 . . . . . . . . . 8 . HA parsed_1lvz 1
88 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 1
88 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
89 1 1 . . . . . . . . . 8 . HA parsed_1lvz 1
89 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
90 1 1 . . . . . . . . . 2 . HA parsed_1lvz 1
90 1 1 . . . . . . . . . 5 . HA parsed_1lvz 1
90 1 1 . . . . . . . . . 10 . HA parsed_1lvz 1
90 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 1
90 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
91 1 1 . . . . . . . . . 6 . HA parsed_1lvz 1
91 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 1
91 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 1
92 1 1 . . . . . . . . . 6 . HA parsed_1lvz 1
92 1 2 . . . . . . . . . 11 . HB# parsed_1lvz 1
93 1 1 . . . . . . . . . 2 . HA parsed_1lvz 1
93 1 1 . . . . . . . . . 5 . HA parsed_1lvz 1
93 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
94 1 1 . . . . . . . . . 10 . HA parsed_1lvz 1
94 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
95 1 1 . . . . . . . . . 6 . HA parsed_1lvz 1
95 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
95 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
96 1 1 . . . . . . . . . 3 . HA parsed_1lvz 1
96 1 2 . . . . . . . . . 6 . HE# parsed_1lvz 1
97 1 1 . . . . . . . . . 3 . HA parsed_1lvz 1
97 1 2 . . . . . . . . . 3 . HG# parsed_1lvz 1
98 1 1 . . . . . . . . . 3 . HA parsed_1lvz 1
98 1 2 . . . . . . . . . 6 . HB# parsed_1lvz 1
99 1 1 . . . . . . . . . 3 . HA parsed_1lvz 1
99 1 2 . . . . . . . . . 6 . HD# parsed_1lvz 1
100 1 1 . . . . . . . . . 8 . HB# parsed_1lvz 1
100 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
100 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
101 1 1 . . . . . . . . . 8 . HB# parsed_1lvz 1
101 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
102 1 1 . . . . . . . . . 1 . HA parsed_1lvz 1
102 1 2 . . . . . . . . . 4 . HB# parsed_1lvz 1
103 1 1 . . . . . . . . . 1 . HA parsed_1lvz 1
103 1 1 . . . . . . . . . 8 . HB# parsed_1lvz 1
103 1 2 . . . . . . . . . 2 . HG# parsed_1lvz 1
103 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
103 1 2 . . . . . . . . . 6 . HD# parsed_1lvz 1
104 1 1 . . . . . . . . . 1 . HA parsed_1lvz 1
104 1 1 . . . . . . . . . 8 . HB# parsed_1lvz 1
104 1 2 . . . . . . . . . 1 . HG1# parsed_1lvz 1
104 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
104 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
105 1 1 . . . . . . . . . 1 . HA parsed_1lvz 1
105 1 2 . . . . . . . . . 1 . HG2# parsed_1lvz 1
106 1 1 . . . . . . . . . 1 . HA parsed_1lvz 1
106 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
107 1 1 . . . . . . . . . 2 . HD# parsed_1lvz 1
107 1 2 . . . . . . . . . 2 . HB# parsed_1lvz 1
108 1 1 . . . . . . . . . 2 . HD# parsed_1lvz 1
108 1 2 . . . . . . . . . 2 . HG# parsed_1lvz 1
109 1 1 . . . . . . . . . 6 . HE# parsed_1lvz 1
109 1 2 . . . . . . . . . 6 . HB# parsed_1lvz 1
110 1 1 . . . . . . . . . 11 . HB# parsed_1lvz 1
110 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 1
110 1 2 . . . . . . . . . 5 . HG parsed_1lvz 1
111 1 1 . . . . . . . . . 11 . HB# parsed_1lvz 1
111 1 2 . . . . . . . . . 10 . HB# parsed_1lvz 1
111 1 2 . . . . . . . . . 10 . HG parsed_1lvz 1
112 1 1 . . . . . . . . . 11 . HB# parsed_1lvz 1
112 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
112 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
113 1 1 . . . . . . . . . 1 . HB parsed_1lvz 1
113 1 2 . . . . . . . . . 1 . HG1# parsed_1lvz 1
114 1 1 . . . . . . . . . 1 . HB parsed_1lvz 1
114 1 2 . . . . . . . . . 1 . HG2# parsed_1lvz 1
115 1 1 . . . . . . . . . 1 . HB parsed_1lvz 1
115 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
115 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
116 1 1 . . . . . . . . . 5 . HB# parsed_1lvz 1
116 1 1 . . . . . . . . . 6 . HD# parsed_1lvz 1
116 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
117 1 1 . . . . . . . . . 2 . HG# parsed_1lvz 1
117 1 1 . . . . . . . . . 5 . HB# parsed_1lvz 1
117 1 1 . . . . . . . . . 5 . HG parsed_1lvz 1
117 1 2 . . . . . . . . . 1 . HG1# parsed_1lvz 1
118 1 1 . . . . . . . . . 2 . HG# parsed_1lvz 1
118 1 1 . . . . . . . . . 5 . HB# parsed_1lvz 1
118 1 1 . . . . . . . . . 5 . HG parsed_1lvz 1
118 1 2 . . . . . . . . . 1 . HG2# parsed_1lvz 1
119 1 1 . . . . . . . . . 2 . HG# parsed_1lvz 1
119 1 1 . . . . . . . . . 5 . HB# parsed_1lvz 1
119 1 1 . . . . . . . . . 5 . HG parsed_1lvz 1
119 1 2 . . . . . . . . . 1 . HD1# parsed_1lvz 1
119 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 1
120 1 1 . . . . . . . . . 10 . HB# parsed_1lvz 1
120 1 1 . . . . . . . . . 10 . HG parsed_1lvz 1
120 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 1
121 1 1 . . . . . . . . . 6 . HG# parsed_1lvz 1
121 1 1 . . . . . . . . . 10 . HB# parsed_1lvz 1
121 1 2 . . . . . . . . . 10 . HD# parsed_1lvz 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 . . . . . 2.6 2.2 3.0 parsed_1lvz 1
2 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
3 1 . . . . . 2.9 2.4 3.4 parsed_1lvz 1
4 1 . . . . . 2.9 2.4 3.4 parsed_1lvz 1
5 1 . . . . . 3.5 2.7 4.3 parsed_1lvz 1
6 1 . . . . . 2.9 2.3 3.5 parsed_1lvz 1
7 1 . . . . . 3.4 2.7 4.1 parsed_1lvz 1
8 1 . . . . . 3.9 2.9 4.9 parsed_1lvz 1
9 1 . . . . . 2.6 2.2 3.0 parsed_1lvz 1
10 1 . . . . . 2.8 2.3 3.3 parsed_1lvz 1
11 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
12 1 . . . . . 3.6 2.8 4.4 parsed_1lvz 1
13 1 . . . . . 4.8 3.4 6.2 parsed_1lvz 1
14 1 . . . . . 2.6 2.1 3.1 parsed_1lvz 1
15 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
16 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
17 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
18 1 . . . . . 3.1 2.5 3.7 parsed_1lvz 1
19 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
20 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
21 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
22 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
23 1 . . . . . 3.0 2.2 3.8 parsed_1lvz 1
24 1 . . . . . 2.4 2.0 2.8 parsed_1lvz 1
25 1 . . . . . 4.0 3.0 5.0 parsed_1lvz 1
26 1 . . . . . 4.5 3.1 5.9 parsed_1lvz 1
27 1 . . . . . 3.7 2.0 4.6 parsed_1lvz 1
28 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
29 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
30 1 . . . . . 2.5 2.0 3.0 parsed_1lvz 1
31 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
32 1 . . . . . 2.7 2.2 3.2 parsed_1lvz 1
33 1 . . . . . 2.7 2.2 3.2 parsed_1lvz 1
34 1 . . . . . 3.5 2.7 4.3 parsed_1lvz 1
35 1 . . . . . 2.4 1.9 2.9 parsed_1lvz 1
36 1 . . . . . 2.3 1.8 2.8 parsed_1lvz 1
37 1 . . . . . 3.1 2.5 3.7 parsed_1lvz 1
38 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
39 1 . . . . . 2.8 2.3 3.3 parsed_1lvz 1
40 1 . . . . . 4.0 3.0 5.0 parsed_1lvz 1
41 1 . . . . . 2.6 2.2 3.0 parsed_1lvz 1
42 1 . . . . . 3.7 2.8 4.6 parsed_1lvz 1
43 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
44 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
45 1 . . . . . 4.4 3.2 5.6 parsed_1lvz 1
46 1 . . . . . 2.9 2.4 3.4 parsed_1lvz 1
47 1 . . . . . 4.9 3.4 6.4 parsed_1lvz 1
48 1 . . . . . 2.4 2.0 2.8 parsed_1lvz 1
49 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
50 1 . . . . . 4.2 3.1 5.3 parsed_1lvz 1
51 1 . . . . . 3.4 2.7 4.1 parsed_1lvz 1
52 1 . . . . . 4.5 3.3 5.7 parsed_1lvz 1
53 1 . . . . . 2.8 2.3 3.3 parsed_1lvz 1
54 1 . . . . . 2.9 2.4 3.4 parsed_1lvz 1
55 1 . . . . . 3.1 2.5 3.7 parsed_1lvz 1
56 1 . . . . . 2.4 1.9 2.9 parsed_1lvz 1
57 1 . . . . . 2.9 2.3 3.5 parsed_1lvz 1
58 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
59 1 . . . . . 2.8 2.3 3.3 parsed_1lvz 1
60 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
61 1 . . . . . 3.7 2.9 4.5 parsed_1lvz 1
62 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
63 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
64 1 . . . . . 4.4 3.2 5.6 parsed_1lvz 1
65 1 . . . . . 3.2 2.6 3.8 parsed_1lvz 1
66 1 . . . . . 3.3 2.6 4.0 parsed_1lvz 1
67 1 . . . . . 3.2 2.6 3.8 parsed_1lvz 1
68 1 . . . . . 2.7 1.9 3.5 parsed_1lvz 1
69 1 . . . . . 3.9 2.7 5.1 parsed_1lvz 1
70 1 . . . . . 4.1 2.9 5.3 parsed_1lvz 1
71 1 . . . . . 3.4 2.4 4.4 parsed_1lvz 1
72 1 . . . . . 2.9 2.3 3.5 parsed_1lvz 1
73 1 . . . . . 4.4 3.2 5.6 parsed_1lvz 1
74 1 . . . . . 4.4 3.2 5.6 parsed_1lvz 1
75 1 . . . . . 2.2 1.5 2.9 parsed_1lvz 1
76 1 . . . . . 3.1 2.2 4.0 parsed_1lvz 1
77 1 . . . . . 3.4 2.4 4.4 parsed_1lvz 1
78 1 . . . . . 3.2 2.2 4.2 parsed_1lvz 1
79 1 . . . . . 3.9 2.7 5.1 parsed_1lvz 1
80 1 . . . . . 3.8 2.6 5.0 parsed_1lvz 1
81 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
82 1 . . . . . 3.2 2.6 3.8 parsed_1lvz 1
83 1 . . . . . 4.2 3.1 5.3 parsed_1lvz 1
84 1 . . . . . 3.8 2.9 4.7 parsed_1lvz 1
85 1 . . . . . 4.0 3.0 5.0 parsed_1lvz 1
86 1 . . . . . 2.1 1.7 2.5 parsed_1lvz 1
87 1 . . . . . 2.6 2.1 3.1 parsed_1lvz 1
88 1 . . . . . 2.4 1.9 2.9 parsed_1lvz 1
89 1 . . . . . 3.5 2.7 4.3 parsed_1lvz 1
90 1 . . . . . 3.4 2.7 4.1 parsed_1lvz 1
91 1 . . . . . 3.7 2.8 4.6 parsed_1lvz 1
92 1 . . . . . 3.3 2.5 4.1 parsed_1lvz 1
93 1 . . . . . 2.5 2.0 3.0 parsed_1lvz 1
94 1 . . . . . 2.2 1.8 2.6 parsed_1lvz 1
95 1 . . . . . 4.0 3.0 5.0 parsed_1lvz 1
96 1 . . . . . 3.9 2.9 4.9 parsed_1lvz 1
97 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
98 1 . . . . . 3.0 2.4 3.6 parsed_1lvz 1
99 1 . . . . . 3.2 2.6 3.8 parsed_1lvz 1
100 1 . . . . . 3.0 2.1 3.9 parsed_1lvz 1
101 1 . . . . . 3.2 2.3 4.1 parsed_1lvz 1
102 1 . . . . . 3.9 2.9 4.9 parsed_1lvz 1
103 1 . . . . . 4.1 3.1 5.1 parsed_1lvz 1
104 1 . . . . . 2.8 2.0 3.6 parsed_1lvz 1
105 1 . . . . . 3.1 2.5 3.7 parsed_1lvz 1
106 1 . . . . . 3.2 2.6 3.8 parsed_1lvz 1
107 1 . . . . . 2.9 2.0 3.8 parsed_1lvz 1
108 1 . . . . . 2.5 1.7 3.3 parsed_1lvz 1
109 1 . . . . . 3.4 2.4 4.4 parsed_1lvz 1
110 1 . . . . . 3.3 2.3 4.3 parsed_1lvz 1
111 1 . . . . . 4.8 3.4 6.2 parsed_1lvz 1
112 1 . . . . . 3.8 2.7 4.9 parsed_1lvz 1
113 1 . . . . . 3.4 2.4 4.4 parsed_1lvz 1
114 1 . . . . . 3.0 2.1 3.9 parsed_1lvz 1
115 1 . . . . . 3.0 2.1 3.9 parsed_1lvz 1
116 1 . . . . . 2.6 1.8 3.4 parsed_1lvz 1
117 1 . . . . . 4.2 2.9 5.5 parsed_1lvz 1
118 1 . . . . . 3.8 2.7 4.9 parsed_1lvz 1
119 1 . . . . . 1.9 1.3 2.5 parsed_1lvz 1
120 1 . . . . . 1.9 1.3 2.5 parsed_1lvz 1
121 1 . . . . . 2.2 1.5 2.9 parsed_1lvz 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 "message=off echo=off" 2 1 2 28 parsed_1lvz 1
2 "********** CP's originating at E3-HN **********" 4 1 4 52 parsed_1lvz 1
3 "********** CP's originating at N4-HN **********" 18 1 18 52 parsed_1lvz 1
4 "********** CP's originating at L5 (perhaps overlap with K6_HN, D7_HN) **********" 33 1 33 84 parsed_1lvz 1
5 "********** CP's originating at K6 or D7 **********" 60 1 60 54 parsed_1lvz 1
6 "********** CP's originating at S8-HN **********" 77 1 77 52 parsed_1lvz 1
7 "********** CP's originating at G9-HN **********" 92 1 92 52 parsed_1lvz 1
8 "********** CP's originating at L10-HN **********" 102 1 102 53 parsed_1lvz 1
9 "********** CP's originating at F11-HN **********" 111 1 111 53 parsed_1lvz 1
10 "********** CP's originating at N4-HD21 or N4-HD22 **********" 126 1 126 66 parsed_1lvz 1
11 "********** CP's originating at F11-HE# **********" 131 1 131 54 parsed_1lvz 1
12 "********** CP's originating at F11-HD# **********" 140 1 140 54 parsed_1lvz 1
13 "********** CP's originating at F11-HZ **********" 156 1 156 53 parsed_1lvz 1
14 "********** CP's originating at N4-HA **********" 161 1 161 52 parsed_1lvz 1
15 "********** CP's originating at D7-HA **********" 168 1 168 52 parsed_1lvz 1
16 "********** CP's originating at F11-HA **********" 174 1 174 53 parsed_1lvz 1
17 "********** CP's originating at S8-HA **********" 178 1 178 52 parsed_1lvz 1
18 "********** CP's originating at (R2, L5, L10, K6)-HA **********" 184 1 184 67 parsed_1lvz 1
19 "********** CP's originating at E3-HA **********" 197 1 197 52 parsed_1lvz 1
20 "********** CP's originating at G9-HA/S8-HB# **********" 204 1 204 59 parsed_1lvz 1
21 "********** CP's originating at I1-HA/S8-HB# **********" 209 1 209 59 parsed_1lvz 1
22 "********** CP's originating at R2-HD# **********" 219 1 219 53 parsed_1lvz 1
23 "********** CP's originating at K6-HE# **********" 224 1 224 53 parsed_1lvz 1
24 "********** CP's originating at F11-HB# **********" 228 1 228 54 parsed_1lvz 1
25 "********** CP's originating at I1-HB **********" 234 1 234 52 parsed_1lvz 1
26 "********** CP's originating at K6-HD# or L5-HB# ********" 241 1 241 61 parsed_1lvz 1
27 "********** CP's originating at R2-HG# or L5-HB# or L5-HG ********" 246 1 246 70 parsed_1lvz 1
28 "********** CP's originating at L10-HB# or L10-HG ********" 255 1 255 62 parsed_1lvz 1
29 "********** CP's originating at K6-HG# or L10-HB# ********" 260 1 260 62 parsed_1lvz 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1lvz
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "NOE not seen"
_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_1lvz 2
2 1 . . . parsed_1lvz 2
3 1 . . . parsed_1lvz 2
4 1 . . . parsed_1lvz 2
5 1 . . . parsed_1lvz 2
6 1 . . . parsed_1lvz 2
7 1 . . . parsed_1lvz 2
8 1 . . . parsed_1lvz 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 . . . . . . . . . 11 . HD# parsed_1lvz 2
1 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 2
2 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 2
2 1 2 . . . . . . . . . 8 . HB# parsed_1lvz 2
3 1 1 . . . . . . . . . 11 . HA parsed_1lvz 2
3 1 2 . . . . . . . . . 5 . HD# parsed_1lvz 2
4 1 1 . . . . . . . . . 11 . HA parsed_1lvz 2
4 1 2 . . . . . . . . . 5 . HB# parsed_1lvz 2
5 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 2
5 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 2
6 1 1 . . . . . . . . . 11 . HZ parsed_1lvz 2
6 1 2 . . . . . . . . . 9 . HA# parsed_1lvz 2
7 1 1 . . . . . . . . . 11 . HD# parsed_1lvz 2
7 1 2 . . . . . . . . . 6 . HA parsed_1lvz 2
8 1 1 . . . . . . . . . 11 . HE# parsed_1lvz 2
8 1 2 . . . . . . . . . 6 . HA parsed_1lvz 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 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
2 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
3 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
4 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
5 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
6 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
7 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 2
8 1 . . . . . 5.0 3.5 25.0 parsed_1lvz 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 "******** lower bounds for x-peaks that were definitely not observed ********" 1 1 1 81 parsed_1lvz 2
stop_
save_
save_CNS/XPLOR_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1lvz
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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_1lvz 3
2 1 . . . parsed_1lvz 3
3 1 . . . parsed_1lvz 3
4 1 . . . parsed_1lvz 3
5 1 . . . parsed_1lvz 3
6 1 . . . parsed_1lvz 3
7 1 . . . parsed_1lvz 3
8 1 . . . parsed_1lvz 3
9 1 . . . parsed_1lvz 3
10 1 . . . parsed_1lvz 3
11 1 . . . parsed_1lvz 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 . . . . . . . . . 1 . O parsed_1lvz 3
1 1 2 . . . . . . . . . 5 . HN parsed_1lvz 3
2 1 1 . . . . . . . . . 1 . O parsed_1lvz 3
2 1 2 . . . . . . . . . 5 . N parsed_1lvz 3
3 1 1 . . . . . . . . . 2 . O parsed_1lvz 3
3 1 2 . . . . . . . . . 6 . HN parsed_1lvz 3
4 1 1 . . . . . . . . . 2 . O parsed_1lvz 3
4 1 2 . . . . . . . . . 6 . N parsed_1lvz 3
5 1 1 . . . . . . . . . 3 . O parsed_1lvz 3
5 1 2 . . . . . . . . . 7 . HN parsed_1lvz 3
6 1 1 . . . . . . . . . 3 . O parsed_1lvz 3
6 1 2 . . . . . . . . . 7 . N parsed_1lvz 3
7 1 1 . . . . . . . . . 4 . O parsed_1lvz 3
7 1 2 . . . . . . . . . 8 . HN parsed_1lvz 3
8 1 1 . . . . . . . . . 4 . O parsed_1lvz 3
8 1 2 . . . . . . . . . 8 . N parsed_1lvz 3
9 1 1 . . . . . . . . . 5 . O parsed_1lvz 3
9 1 2 . . . . . . . . . 9 . HN parsed_1lvz 3
10 1 1 . . . . . . . . . 5 . O parsed_1lvz 3
10 1 2 . . . . . . . . . 9 . N parsed_1lvz 3
11 1 1 . . . . . . . . . 8 . OG parsed_1lvz 3
11 1 2 . . . . . . . . . 10 . N parsed_1lvz 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 . . . . . 1.9 1.6 2.2 parsed_1lvz 3
2 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 3
3 1 . . . . . 1.9 1.6 2.2 parsed_1lvz 3
4 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 3
5 1 . . . . . 1.9 1.6 2.2 parsed_1lvz 3
6 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 3
7 1 . . . . . 1.9 1.6 2.2 parsed_1lvz 3
8 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 3
9 1 . . . . . 1.9 1.6 2.2 parsed_1lvz 3
10 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 3
11 1 . . . . . 2.9 2.5 3.3 parsed_1lvz 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 "******** add specific hydrogen bond constraint for N-terminal alpha-helix ********" 3 1 3 88 parsed_1lvz 3
2 "******** add specific hydrogen bond constraint between Ser8-OG and Leu10-N ********" 20 1 20 88 parsed_1lvz 3
3 "message=on echo=on" 23 1 23 26 parsed_1lvz 3
stop_
save_
save_MR_file_comment_6
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_Org_constr_file_comment.ID 3
_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
;
******************************************************************
************************ End of NOE.tbl ************************
******************************************************************
******************************************************************
********************* Start of Dihedral.tbl **********************
******************************************************************
set message=off echo=off end
;
save_
save_CNS/XPLOR_dihedral_7
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1lvz
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 7
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 20.0 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_1lvz 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_1lvz 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_1lvz 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_1lvz 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_1lvz 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_1lvz 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.0 0.0 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_1lvz 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 5 . N . 5 . CA . 5 . CB . 5 . CG parsed_1lvz 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 10 . N . 10 . CA . 10 . CB . 10 . CG parsed_1lvz 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 5 . CA . 5 . CB . 5 . CG . 5 . CD1 parsed_1lvz 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 10 . CA . 10 . CB . 10 . CG . 10 . CD1 parsed_1lvz 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 75.0 105.0 . . 11 . CA . 11 . CB . 11 . CG . 11 . CD1 parsed_1lvz 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 "dihedral restraints on psi" 4 1 4 31 parsed_1lvz 1
2
;
S8
dihedral restraints on phi
;
6 70 8 31 parsed_1lvz 1
3 E3 10 71 10 75 parsed_1lvz 1
4 N4 12 71 12 75 parsed_1lvz 1
5 D7 14 71 14 75 parsed_1lvz 1
6 S8 16 71 16 75 parsed_1lvz 1
7 L10 18 71 18 76 parsed_1lvz 1
8
;
F11
dihedral restraints on chi1
;
20 71 22 32 parsed_1lvz 1
9 L5 24 72 24 76 parsed_1lvz 1
10
;
L10
dihedral restraints on chi2
;
26 72 28 32 parsed_1lvz 1
11 L5 30 73 30 77 parsed_1lvz 1
12 L10 32 73 32 78 parsed_1lvz 1
13 F11 34 73 34 78 parsed_1lvz 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "restraints dihedral reset" 2 1 2 25 parsed_1lvz 1
2 end 36 1 36 3 parsed_1lvz 1
stop_
save_
save_MR_file_comment_8
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_Org_constr_file_comment.ID 4
_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
;
set message=on echo=on end
******************************************************************
********************* End of Dihedral.tbl **********************
******************************************************************
******************************************************************
********************* Start of Dipo_HN-N.tbl *********************
******************************************************************
set echo off message off end
;
save_
save_CNS/XPLOR_dipolar_coupling_9
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1lvz
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 9
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . 1.1 0.9000 1.3000 . . . 3 . N . 3 . HN parsed_1lvz 1
2 . . . . . . . . . . . . . . . . -0.4 -0.6000 -0.2000 . . . 4 . N . 4 . HN parsed_1lvz 1
3 . . . . . . . . . . . . . . . . 0.7 0.5000 0.9000 . . . 5 . N . 5 . HN parsed_1lvz 1
4 . . . . . . . . . . . . . . . . 2.0 1.8000 2.2000 . . . 6 . N . 6 . HN parsed_1lvz 1
5 . . . . . . . . . . . . . . . . -0.1 -0.3000 0.1000 . . . 7 . N . 7 . HN parsed_1lvz 1
6 . . . . . . . . . . . . . . . . -0.1 -0.3000 0.1000 . . . 8 . N . 8 . HN parsed_1lvz 1
7 . . . . . . . . . . . . . . . . 2.4 2.2000 2.6000 . . . 9 . N . 9 . HN parsed_1lvz 1
8 . . . . . . . . . . . . . . . . -0.3 -0.5000 -0.1000 . . . 10 . N . 10 . HN parsed_1lvz 1
9 . . . . . . . . . . . . . . . . -0.7 -0.9000 -0.5000 . . . 11 . N . 11 . HN parsed_1lvz 1
stop_
save_
save_MR_file_comment_10
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_Org_constr_file_comment.ID 5
_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
;
set echo on message on end
******************************************************************
********************* End of Dipo_HN-N.tbl *********************
******************************************************************
******************************************************************
******************** Start of Dipo_Ca-Ha.tbl *********************
******************************************************************
set echo off message off end
;
save_
save_CNS/XPLOR_dipolar_coupling_11
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1lvz
_RDC_constraint_list.ID 2
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 11
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . 1.9 1.5000 2.3000 . . . 1 . HA . 1 . CA parsed_1lvz 2
2 . . . . . . . . . . . . . . . . -0.1 -0.5000 0.3000 . . . 1 . HB . 1 . CB parsed_1lvz 2
3 . . . . . . . . . . . . . . . . 1.3 0.9000 1.7000 . . . 1 . HG1# . 1 . CG1 parsed_1lvz 2
4 . . . . . . . . . . . . . . . . 1.5 1.1000 1.9000 . . . 1 . CB . 1 . CG2 parsed_1lvz 2
5 . . . . . . . . . . . . . . . . 0.0 -0.4000 0.4000 . . . 1 . CG1 . 1 . CD1 parsed_1lvz 2
6 . . . . . . . . . . . . . . . . 1.2 0.8000 1.6000 . . . 3 . HA . 3 . CA parsed_1lvz 2
7 . . . . . . . . . . . . . . . . 3.2 2.8000 3.6000 . . . 4 . HA . 4 . CA parsed_1lvz 2
8 . . . . . . . . . . . . . . . . 0.5 0.1000 0.9000 . . . 6 . HA . 6 . CA parsed_1lvz 2
9 . . . . . . . . . . . . . . . . 3.4 3.0000 3.8000 . . . 7 . HA . 7 . CA parsed_1lvz 2
10 . . . . . . . . . . . . . . . . 1.8 1.4000 2.2000 . . . 8 . HA . 8 . CA parsed_1lvz 2
11 . . . . . . . . . . . . . . . . 0.2 -0.4000 0.8000 . . . 9 . CA . 9 . HA# parsed_1lvz 2
12 . . . . . . . . . . . . . . . . -2.1 -2.5000 -1.7000 . . . 10 . HA . 10 . CA parsed_1lvz 2
13 . . . . . . . . . . . . . . . . 0.0 -0.4000 0.4000 . . . 11 . HA . 11 . CA parsed_1lvz 2
14 . . . . . . . . . . . . . . . . -0.9 -1.3000 -0.5000 . . . 11 . CB . 11 . HB# parsed_1lvz 2
stop_
save_
save_MR_file_comment_12
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_Org_constr_file_comment.ID 6
_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 echo on message on end
******************************************************************
******************** End of Dipo_Ca-Ha.tbl *********************
******************************************************************
******************************************************************
******************* Start of Dipo_sidechain.tbl ******************
******************************************************************
set echo off message off end
;
save_
save_CNS/XPLOR_dipolar_coupling_13
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1lvz
_RDC_constraint_list.ID 3
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 13
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . -0.7 -15.7 -0.5 . . . 2 . CB . 2 . HB# parsed_1lvz 3
2 . . . . . . . . . . . . . . . . 0.3 0.1000 15.3000 . . . 2 . CD . 2 . HD# parsed_1lvz 3
3 . . . . . . . . . . . . . . . . 1.3 1.1000 16.3000 . . . 3 . CB . 3 . HB# parsed_1lvz 3
4 . . . . . . . . . . . . . . . . -2.3 -17.3000 -2.1000 . . . 4 . CB . 4 . HB# parsed_1lvz 3
5 . . . . . . . . . . . . . . . . -2.6 -17.6000 -2.4000 . . . 5 . CB . 5 . HB# parsed_1lvz 3
6 . . . . . . . . . . . . . . . . 1.0 0.8000 16.0000 . . . 5 . CG . 5 . CD1 parsed_1lvz 3
7 . . . . . . . . . . . . . . . . -2.2 -17.2000 -2.0000 . . . 5 . CG . 5 . CD2 parsed_1lvz 3
8 . . . . . . . . . . . . . . . . 2.0 1.8000 17.0000 . . . 6 . CB . 6 . HB# parsed_1lvz 3
9 . . . . . . . . . . . . . . . . 1.6 1.4000 16.6000 . . . 6 . CG . 6 . HG# parsed_1lvz 3
10 . . . . . . . . . . . . . . . . -0.4 -15.4000 -0.2000 . . . 6 . CE . 6 . HE# parsed_1lvz 3
11 . . . . . . . . . . . . . . . . 1.9 1.7000 16.9000 . . . 7 . CB . 7 . HB# parsed_1lvz 3
12 . . . . . . . . . . . . . . . . -2.3 -17.3000 -2.1000 . . . 8 . CB . 8 . HB# parsed_1lvz 3
13 . . . . . . . . . . . . . . . . -2.4 -17.4000 -2.2000 . . . 10 . CB . 10 . HB# parsed_1lvz 3
14 . . . . . . . . . . . . . . . . 2.3 2.1000 17.3000 . . . 10 . CG . 10 . CD1 parsed_1lvz 3
15 . . . . . . . . . . . . . . . . -1.4 -16.4000 -1.2000 . . . 10 . CG . 10 . CD2 parsed_1lvz 3
stop_
loop_
_RDC_constraint_comment_org.ID
_RDC_constraint_comment_org.Comment_text
_RDC_constraint_comment_org.Comment_begin_line
_RDC_constraint_comment_org.Comment_begin_column
_RDC_constraint_comment_org.Comment_end_line
_RDC_constraint_comment_org.Comment_end_column
_RDC_constraint_comment_org.Entry_ID
_RDC_constraint_comment_org.RDC_constraint_list_ID
1 "***** Arg2 CB-HB# half-open square potential" 7 1 7 50 parsed_1lvz 3
2 "***** Arg2 CD-HD# half-open square potential" 15 1 15 50 parsed_1lvz 3
3 "***** Glu3 CB-HB# half-open square potential" 23 1 23 50 parsed_1lvz 3
4 "***** Asn4 CB-HB# half-open square potential" 31 1 31 50 parsed_1lvz 3
5 "***** Leu5 CB-HB# half-open square potential" 39 1 39 50 parsed_1lvz 3
6 "***** Leu5 CG-CD1 half-open square potential" 47 1 47 50 parsed_1lvz 3
7 "***** Leu5 CG-CD2 value half-open square potential" 55 1 55 55 parsed_1lvz 3
8 "***** Lys6 CB-HB# half-open square potential" 63 1 63 50 parsed_1lvz 3
9 "***** Lys6 CG-HG# half-open square potential" 71 1 71 50 parsed_1lvz 3
10 "***** Lys6 CE-HE# half-open square potential" 79 1 79 50 parsed_1lvz 3
11 "***** Asp7 CB-HB# half-open square potential" 87 1 87 50 parsed_1lvz 3
12 "***** Ser8 CB-HB# half-open square potential" 95 1 95 50 parsed_1lvz 3
13 "***** Leu10 CB-HB# half-open square potential" 103 1 103 51 parsed_1lvz 3
14 "***** Leu10 CG-CD1 half-open square potential" 111 1 111 51 parsed_1lvz 3
15 "***** Leu10 CG-CD2 half-open square potential" 119 1 119 51 parsed_1lvz 3
stop_
save_
save_MR_file_comment_14
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1lvz
_Org_constr_file_comment.ID 7
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 14
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
set echo on message on end
******************************************************************
******************* End of Dipo_sidechain.tbl ******************
******************************************************************
;
save_
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