NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
650722 |
6x4x   |
30755 | cing | 2-parsed | STAR | distance | NOE | simple | 122 |
data_6x4x_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6x4x
_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_6x4x 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6x4x
_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 6x4x "Master copy" parsed_6x4x
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6x4x
_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 6x4x.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6x4x 1
1 6x4x.mr . . XPLOR/CNS 2 distance NOE simple 793 parsed_6x4x 1
1 6x4x.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 10 parsed_6x4x 1
1 6x4x.mr . . XPLOR/CNS 4 distance NOE simple 122 parsed_6x4x 1
1 6x4x.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6x4x 1
1 6x4x.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6x4x 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6x4x
_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_6x4x 1
2 1 . . . parsed_6x4x 1
3 1 . . . parsed_6x4x 1
4 1 . . . parsed_6x4x 1
5 1 . . . parsed_6x4x 1
6 1 . . . parsed_6x4x 1
7 1 . . . parsed_6x4x 1
8 1 . . . parsed_6x4x 1
9 1 . . . parsed_6x4x 1
10 1 . . . parsed_6x4x 1
11 1 . . . parsed_6x4x 1
12 1 . . . parsed_6x4x 1
13 1 . . . parsed_6x4x 1
14 1 . . . parsed_6x4x 1
15 1 . . . parsed_6x4x 1
16 1 . . . parsed_6x4x 1
17 1 . . . parsed_6x4x 1
18 1 . . . parsed_6x4x 1
19 1 . . . parsed_6x4x 1
20 1 . . . parsed_6x4x 1
21 1 . . . parsed_6x4x 1
22 1 . . . parsed_6x4x 1
23 1 . . . parsed_6x4x 1
24 1 . . . parsed_6x4x 1
25 1 . . . parsed_6x4x 1
26 1 . . . parsed_6x4x 1
27 1 . . . parsed_6x4x 1
28 1 . . . parsed_6x4x 1
29 1 . . . parsed_6x4x 1
30 1 . . . parsed_6x4x 1
31 1 . . . parsed_6x4x 1
32 1 . . . parsed_6x4x 1
33 1 . . . parsed_6x4x 1
34 1 . . . parsed_6x4x 1
35 1 . . . parsed_6x4x 1
36 1 . . . parsed_6x4x 1
37 1 . . . parsed_6x4x 1
38 1 . . . parsed_6x4x 1
39 1 . . . parsed_6x4x 1
40 1 . . . parsed_6x4x 1
41 1 . . . parsed_6x4x 1
42 1 . . . parsed_6x4x 1
43 1 . . . parsed_6x4x 1
44 1 . . . parsed_6x4x 1
45 1 . . . parsed_6x4x 1
46 1 . . . parsed_6x4x 1
47 1 . . . parsed_6x4x 1
48 1 . . . parsed_6x4x 1
49 1 . . . parsed_6x4x 1
50 1 . . . parsed_6x4x 1
51 1 . . . parsed_6x4x 1
52 1 . . . parsed_6x4x 1
53 1 . . . parsed_6x4x 1
54 1 . . . parsed_6x4x 1
55 1 . . . parsed_6x4x 1
56 1 . . . parsed_6x4x 1
57 1 . . . parsed_6x4x 1
58 1 . . . parsed_6x4x 1
59 1 . . . parsed_6x4x 1
60 1 . . . parsed_6x4x 1
61 1 . . . parsed_6x4x 1
62 1 . . . parsed_6x4x 1
63 1 . . . parsed_6x4x 1
64 1 . . . parsed_6x4x 1
65 1 . . . parsed_6x4x 1
66 1 . . . parsed_6x4x 1
67 1 . . . parsed_6x4x 1
68 1 . . . parsed_6x4x 1
69 1 . . . parsed_6x4x 1
70 1 . . . parsed_6x4x 1
71 1 . . . parsed_6x4x 1
72 1 . . . parsed_6x4x 1
73 1 . . . parsed_6x4x 1
74 1 . . . parsed_6x4x 1
75 1 . . . parsed_6x4x 1
76 1 . . . parsed_6x4x 1
77 1 . . . parsed_6x4x 1
78 1 . . . parsed_6x4x 1
79 1 . . . parsed_6x4x 1
80 1 . . . parsed_6x4x 1
81 1 . . . parsed_6x4x 1
82 1 . . . parsed_6x4x 1
83 1 . . . parsed_6x4x 1
84 1 . . . parsed_6x4x 1
85 1 . . . parsed_6x4x 1
86 1 . . . parsed_6x4x 1
87 1 . . . parsed_6x4x 1
88 1 . . . parsed_6x4x 1
89 1 . . . parsed_6x4x 1
90 1 . . . parsed_6x4x 1
91 1 . . . parsed_6x4x 1
92 1 . . . parsed_6x4x 1
93 1 . . . parsed_6x4x 1
94 1 . . . parsed_6x4x 1
95 1 . . . parsed_6x4x 1
96 1 . . . parsed_6x4x 1
97 1 . . . parsed_6x4x 1
98 1 . . . parsed_6x4x 1
99 1 . . . parsed_6x4x 1
100 1 . . . parsed_6x4x 1
101 1 . . . parsed_6x4x 1
102 1 . . . parsed_6x4x 1
103 1 . . . parsed_6x4x 1
104 1 . . . parsed_6x4x 1
105 1 . . . parsed_6x4x 1
106 1 . . . parsed_6x4x 1
107 1 . . . parsed_6x4x 1
108 1 . . . parsed_6x4x 1
109 1 . . . parsed_6x4x 1
110 1 . . . parsed_6x4x 1
111 1 . . . parsed_6x4x 1
112 1 . . . parsed_6x4x 1
113 1 . . . parsed_6x4x 1
114 1 . . . parsed_6x4x 1
115 1 . . . parsed_6x4x 1
116 1 . . . parsed_6x4x 1
117 1 . . . parsed_6x4x 1
118 1 . . . parsed_6x4x 1
119 1 . . . parsed_6x4x 1
120 1 . . . parsed_6x4x 1
121 1 . . . parsed_6x4x 1
122 1 . . . parsed_6x4x 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 . . . . . . . . . 40 . HA parsed_6x4x 1
1 1 2 . . . . . . . . . 40 . HB1 parsed_6x4x 1
2 1 1 . . . . . . . . . 40 . HA parsed_6x4x 1
2 1 2 . . . . . . . . . 40 . HB2 parsed_6x4x 1
3 1 1 . . . . . . . . . 40 . HB2 parsed_6x4x 1
3 1 2 . . . . . . . . . 40 . HN parsed_6x4x 1
4 1 1 . . . . . . . . . 40 . HB1 parsed_6x4x 1
4 1 2 . . . . . . . . . 40 . HN parsed_6x4x 1
5 1 1 . . . . . . . . . 40 . HB2 parsed_6x4x 1
5 1 2 . . . . . . . . . 41 . HN parsed_6x4x 1
6 1 1 . . . . . . . . . 40 . HB1 parsed_6x4x 1
6 1 2 . . . . . . . . . 41 . HN parsed_6x4x 1
7 1 1 . . . . . . . . . 40 . HN parsed_6x4x 1
7 1 2 . . . . . . . . . 41 . HN parsed_6x4x 1
8 1 1 . . . . . . . . . 40 . HN parsed_6x4x 1
8 1 2 . . . . . . . . . 41 . HA1 parsed_6x4x 1
9 1 1 . . . . . . . . . 40 . HA parsed_6x4x 1
9 1 2 . . . . . . . . . 41 . HN parsed_6x4x 1
10 1 1 . . . . . . . . . 40 . HB1 parsed_6x4x 1
10 1 2 . . . . . . . . . 45 . HD2 parsed_6x4x 1
11 1 1 . . . . . . . . . 40 . HB2 parsed_6x4x 1
11 1 2 . . . . . . . . . 45 . HD2 parsed_6x4x 1
12 1 1 . . . . . . . . . 40 . HB2 parsed_6x4x 1
12 1 2 . . . . . . . . . 45 . HB2 parsed_6x4x 1
13 1 1 . . . . . . . . . 40 . HB1 parsed_6x4x 1
13 1 2 . . . . . . . . . 45 . HB1 parsed_6x4x 1
14 1 1 . . . . . . . . . 40 . HB2 parsed_6x4x 1
14 1 2 . . . . . . . . . 45 . HB1 parsed_6x4x 1
15 1 1 . . . . . . . . . 41 . HN parsed_6x4x 1
15 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
16 1 1 . . . . . . . . . 41 . HA1 parsed_6x4x 1
16 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
17 1 1 . . . . . . . . . 41 . HA2 parsed_6x4x 1
17 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
18 1 1 . . . . . . . . . 41 . HN parsed_6x4x 1
18 1 2 . . . . . . . . . 45 . HD2 parsed_6x4x 1
19 1 1 . . . . . . . . . 42 . HA parsed_6x4x 1
19 1 2 . . . . . . . . . 42 . HB1 parsed_6x4x 1
20 1 1 . . . . . . . . . 42 . HA parsed_6x4x 1
20 1 2 . . . . . . . . . 42 . HB2 parsed_6x4x 1
21 1 1 . . . . . . . . . 42 . HA parsed_6x4x 1
21 1 2 . . . . . . . . . 42 . HG# parsed_6x4x 1
22 1 1 . . . . . . . . . 42 . HB2 parsed_6x4x 1
22 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
23 1 1 . . . . . . . . . 42 . HB1 parsed_6x4x 1
23 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
24 1 1 . . . . . . . . . 42 . HG# parsed_6x4x 1
24 1 2 . . . . . . . . . 42 . HN parsed_6x4x 1
25 1 1 . . . . . . . . . 42 . HA parsed_6x4x 1
25 1 2 . . . . . . . . . 43 . HN parsed_6x4x 1
26 1 1 . . . . . . . . . 42 . HN parsed_6x4x 1
26 1 2 . . . . . . . . . 43 . HN parsed_6x4x 1
27 1 1 . . . . . . . . . 42 . HG# parsed_6x4x 1
27 1 2 . . . . . . . . . 43 . HN parsed_6x4x 1
28 1 1 . . . . . . . . . 42 . HB2 parsed_6x4x 1
28 1 2 . . . . . . . . . 43 . HN parsed_6x4x 1
29 1 1 . . . . . . . . . 42 . HB1 parsed_6x4x 1
29 1 2 . . . . . . . . . 43 . HN parsed_6x4x 1
30 1 1 . . . . . . . . . 43 . HB2 parsed_6x4x 1
30 1 2 . . . . . . . . . 43 . HD1 parsed_6x4x 1
31 1 1 . . . . . . . . . 43 . HG# parsed_6x4x 1
31 1 2 . . . . . . . . . 43 . HA parsed_6x4x 1
32 1 1 . . . . . . . . . 43 . HD1 parsed_6x4x 1
32 1 2 . . . . . . . . . 43 . HB1 parsed_6x4x 1
33 1 1 . . . . . . . . . 43 . HD2 parsed_6x4x 1
33 1 2 . . . . . . . . . 43 . HB2 parsed_6x4x 1
34 1 1 . . . . . . . . . 43 . HB1 parsed_6x4x 1
34 1 2 . . . . . . . . . 43 . HE parsed_6x4x 1
35 1 1 . . . . . . . . . 43 . HB2 parsed_6x4x 1
35 1 2 . . . . . . . . . 43 . HE parsed_6x4x 1
36 1 1 . . . . . . . . . 43 . HG1 parsed_6x4x 1
36 1 2 . . . . . . . . . 43 . HE parsed_6x4x 1
37 1 1 . . . . . . . . . 43 . HG2 parsed_6x4x 1
37 1 2 . . . . . . . . . 43 . HE parsed_6x4x 1
38 1 1 . . . . . . . . . 43 . HA parsed_6x4x 1
38 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
39 1 1 . . . . . . . . . 43 . HN parsed_6x4x 1
39 1 2 . . . . . . . . . 44 . HA1 parsed_6x4x 1
40 1 1 . . . . . . . . . 43 . HN parsed_6x4x 1
40 1 2 . . . . . . . . . 44 . HA2 parsed_6x4x 1
41 1 1 . . . . . . . . . 43 . HB1 parsed_6x4x 1
41 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
42 1 1 . . . . . . . . . 43 . HB2 parsed_6x4x 1
42 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
43 1 1 . . . . . . . . . 43 . HG# parsed_6x4x 1
43 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
44 1 1 . . . . . . . . . 43 . HB1 parsed_6x4x 1
44 1 2 . . . . . . . . . 44 . HA1 parsed_6x4x 1
45 1 1 . . . . . . . . . 43 . HB1 parsed_6x4x 1
45 1 2 . . . . . . . . . 44 . HA2 parsed_6x4x 1
46 1 1 . . . . . . . . . 43 . HB2 parsed_6x4x 1
46 1 2 . . . . . . . . . 44 . HA1 parsed_6x4x 1
47 1 1 . . . . . . . . . 43 . HB2 parsed_6x4x 1
47 1 2 . . . . . . . . . 44 . HA2 parsed_6x4x 1
48 1 1 . . . . . . . . . 44 . HA1 parsed_6x4x 1
48 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
49 1 1 . . . . . . . . . 44 . HA2 parsed_6x4x 1
49 1 2 . . . . . . . . . 44 . HN parsed_6x4x 1
50 1 1 . . . . . . . . . 44 . HA2 parsed_6x4x 1
50 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
51 1 1 . . . . . . . . . 44 . HA1 parsed_6x4x 1
51 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
52 1 1 . . . . . . . . . 44 . HN parsed_6x4x 1
52 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
53 1 1 . . . . . . . . . 44 . HA2 parsed_6x4x 1
53 1 2 . . . . . . . . . 45 . HD2 parsed_6x4x 1
54 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
54 1 2 . . . . . . . . . 45 . HB1 parsed_6x4x 1
55 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
55 1 2 . . . . . . . . . 45 . HB2 parsed_6x4x 1
56 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
56 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
57 1 1 . . . . . . . . . 45 . HD2 parsed_6x4x 1
57 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
58 1 1 . . . . . . . . . 45 . HB2 parsed_6x4x 1
58 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
59 1 1 . . . . . . . . . 45 . HB1 parsed_6x4x 1
59 1 2 . . . . . . . . . 45 . HN parsed_6x4x 1
60 1 1 . . . . . . . . . 45 . HB2 parsed_6x4x 1
60 1 2 . . . . . . . . . 45 . HD2 parsed_6x4x 1
61 1 1 . . . . . . . . . 45 . HB1 parsed_6x4x 1
61 1 2 . . . . . . . . . 45 . HD1 parsed_6x4x 1
62 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
62 1 2 . . . . . . . . . 45 . HB1 parsed_6x4x 1
63 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
63 1 2 . . . . . . . . . 45 . HB2 parsed_6x4x 1
64 1 1 . . . . . . . . . 45 . HN parsed_6x4x 1
64 1 2 . . . . . . . . . 45 . HD1 parsed_6x4x 1
65 1 1 . . . . . . . . . 45 . HD1 parsed_6x4x 1
65 1 2 . . . . . . . . . 46 . HA parsed_6x4x 1
66 1 1 . . . . . . . . . 45 . HB2 parsed_6x4x 1
66 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
67 1 1 . . . . . . . . . 45 . HB1 parsed_6x4x 1
67 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
68 1 1 . . . . . . . . . 45 . HA parsed_6x4x 1
68 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
69 1 1 . . . . . . . . . 45 . HN parsed_6x4x 1
69 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
70 1 1 . . . . . . . . . 45 . HD1 parsed_6x4x 1
70 1 2 . . . . . . . . . 47 . HA parsed_6x4x 1
71 1 1 . . . . . . . . . 45 . HE1 parsed_6x4x 1
71 1 2 . . . . . . . . . 47 . HA parsed_6x4x 1
72 1 1 . . . . . . . . . 46 . HA parsed_6x4x 1
72 1 2 . . . . . . . . . 46 . HB1 parsed_6x4x 1
73 1 1 . . . . . . . . . 46 . HA parsed_6x4x 1
73 1 2 . . . . . . . . . 46 . HB2 parsed_6x4x 1
74 1 1 . . . . . . . . . 46 . HA parsed_6x4x 1
74 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
75 1 1 . . . . . . . . . 46 . HB2 parsed_6x4x 1
75 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
76 1 1 . . . . . . . . . 46 . HB1 parsed_6x4x 1
76 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
77 1 1 . . . . . . . . . 46 . HD1 parsed_6x4x 1
77 1 2 . . . . . . . . . 46 . HN parsed_6x4x 1
78 1 1 . . . . . . . . . 46 . HA parsed_6x4x 1
78 1 2 . . . . . . . . . 46 . HD2 parsed_6x4x 1
79 1 1 . . . . . . . . . 46 . HB1 parsed_6x4x 1
79 1 2 . . . . . . . . . 46 . HD2 parsed_6x4x 1
80 1 1 . . . . . . . . . 46 . HB2 parsed_6x4x 1
80 1 2 . . . . . . . . . 46 . HD1 parsed_6x4x 1
81 1 1 . . . . . . . . . 46 . HA parsed_6x4x 1
81 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
82 1 1 . . . . . . . . . 46 . HB1 parsed_6x4x 1
82 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
83 1 1 . . . . . . . . . 46 . HB2 parsed_6x4x 1
83 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
84 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
84 1 2 . . . . . . . . . 47 . HB1 parsed_6x4x 1
85 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
85 1 2 . . . . . . . . . 47 . HB2 parsed_6x4x 1
86 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
86 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
87 1 1 . . . . . . . . . 47 . HB1 parsed_6x4x 1
87 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
88 1 1 . . . . . . . . . 47 . HB2 parsed_6x4x 1
88 1 2 . . . . . . . . . 47 . HN parsed_6x4x 1
89 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
89 1 2 . . . . . . . . . 47 . HD1 parsed_6x4x 1
90 1 1 . . . . . . . . . 47 . HB1 parsed_6x4x 1
90 1 2 . . . . . . . . . 47 . HD2 parsed_6x4x 1
91 1 1 . . . . . . . . . 47 . HB2 parsed_6x4x 1
91 1 2 . . . . . . . . . 47 . HD1 parsed_6x4x 1
92 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
92 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
93 1 1 . . . . . . . . . 47 . HB1 parsed_6x4x 1
93 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
94 1 1 . . . . . . . . . 47 . HB2 parsed_6x4x 1
94 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
95 1 1 . . . . . . . . . 47 . HD2 parsed_6x4x 1
95 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
96 1 1 . . . . . . . . . 47 . HA parsed_6x4x 1
96 1 2 . . . . . . . . . 48 . HG2# parsed_6x4x 1
97 1 1 . . . . . . . . . 47 . HE2 parsed_6x4x 1
97 1 2 . . . . . . . . . 48 . HA parsed_6x4x 1
98 1 1 . . . . . . . . . 47 . HD2 parsed_6x4x 1
98 1 2 . . . . . . . . . 48 . HA parsed_6x4x 1
99 1 1 . . . . . . . . . 48 . HA parsed_6x4x 1
99 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
100 1 1 . . . . . . . . . 48 . HG2# parsed_6x4x 1
100 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
101 1 1 . . . . . . . . . 48 . HB parsed_6x4x 1
101 1 2 . . . . . . . . . 48 . HN parsed_6x4x 1
102 1 1 . . . . . . . . . 48 . HA parsed_6x4x 1
102 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
103 1 1 . . . . . . . . . 48 . HG2# parsed_6x4x 1
103 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
104 1 1 . . . . . . . . . 48 . HN parsed_6x4x 1
104 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
105 1 1 . . . . . . . . . 48 . HB parsed_6x4x 1
105 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
106 1 1 . . . . . . . . . 48 . HA parsed_6x4x 1
106 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
107 1 1 . . . . . . . . . 48 . HA parsed_6x4x 1
107 1 2 . . . . . . . . . 50 . HD1 parsed_6x4x 1
108 1 1 . . . . . . . . . 49 . HB1 parsed_6x4x 1
108 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
109 1 1 . . . . . . . . . 49 . HB2 parsed_6x4x 1
109 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
110 1 1 . . . . . . . . . 49 . HG# parsed_6x4x 1
110 1 2 . . . . . . . . . 49 . HN parsed_6x4x 1
111 1 1 . . . . . . . . . 49 . HA parsed_6x4x 1
111 1 2 . . . . . . . . . 50 . HB2 parsed_6x4x 1
112 1 1 . . . . . . . . . 49 . HA parsed_6x4x 1
112 1 2 . . . . . . . . . 50 . HG2 parsed_6x4x 1
113 1 1 . . . . . . . . . 49 . HA parsed_6x4x 1
113 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
114 1 1 . . . . . . . . . 49 . HA parsed_6x4x 1
114 1 2 . . . . . . . . . 50 . HD1 parsed_6x4x 1
115 1 1 . . . . . . . . . 49 . HB1 parsed_6x4x 1
115 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
116 1 1 . . . . . . . . . 49 . HB2 parsed_6x4x 1
116 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
117 1 1 . . . . . . . . . 49 . HG# parsed_6x4x 1
117 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
118 1 1 . . . . . . . . . 50 . HB1 parsed_6x4x 1
118 1 2 . . . . . . . . . 50 . HD1 parsed_6x4x 1
119 1 1 . . . . . . . . . 50 . HB1 parsed_6x4x 1
119 1 2 . . . . . . . . . 50 . HD2 parsed_6x4x 1
120 1 1 . . . . . . . . . 50 . HA parsed_6x4x 1
120 1 2 . . . . . . . . . 51 . HN parsed_6x4x 1
121 1 1 . . . . . . . . . 51 . HA parsed_6x4x 1
121 1 2 . . . . . . . . . 51 . HN parsed_6x4x 1
122 1 1 . . . . . . . . . 51 . HB parsed_6x4x 1
122 1 2 . . . . . . . . . 51 . HN parsed_6x4x 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 1.8 3.1 parsed_6x4x 1
2 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
3 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
4 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
5 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
6 1 . . . . . 2.5 1.8 3.0 parsed_6x4x 1
7 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
8 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
9 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
10 1 . . . . . 3.0 1.8 3.5 parsed_6x4x 1
11 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
12 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
13 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
14 1 . . . . . 2.5 1.8 3.0 parsed_6x4x 1
15 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
16 1 . . . . . 3.0 1.8 3.5 parsed_6x4x 1
17 1 . . . . . 3.0 1.8 3.3 parsed_6x4x 1
18 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
19 1 . . . . . 2.5 1.8 3.1 parsed_6x4x 1
20 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
21 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
22 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
23 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
24 1 . . . . . 3.0 1.8 4.2 parsed_6x4x 1
25 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
26 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
27 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
28 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
29 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
30 1 . . . . . 2.5 1.8 3.5 parsed_6x4x 1
31 1 . . . . . 2.5 1.8 3.2 parsed_6x4x 1
32 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
33 1 . . . . . 2.5 1.8 3.5 parsed_6x4x 1
34 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
35 1 . . . . . 2.5 1.8 4.3 parsed_6x4x 1
36 1 . . . . . 2.5 1.8 3.5 parsed_6x4x 1
37 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
38 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
39 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
40 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
41 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
42 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
43 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
44 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
45 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
46 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
47 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
48 1 . . . . . 3.0 1.8 3.4 parsed_6x4x 1
49 1 . . . . . 3.0 1.8 3.4 parsed_6x4x 1
50 1 . . . . . 3.0 1.8 3.4 parsed_6x4x 1
51 1 . . . . . 3.0 1.8 3.4 parsed_6x4x 1
52 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
53 1 . . . . . 3.0 1.8 5.0 parsed_6x4x 1
54 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
55 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
56 1 . . . . . 2.5 1.8 3.0 parsed_6x4x 1
57 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
58 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
59 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
60 1 . . . . . 2.5 1.8 3.5 parsed_6x4x 1
61 1 . . . . . 2.5 1.8 3.5 parsed_6x4x 1
62 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
63 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
64 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
65 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
66 1 . . . . . 3.0 1.8 3.3 parsed_6x4x 1
67 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
68 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
69 1 . . . . . 3.0 1.8 4.3 parsed_6x4x 1
70 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
71 1 . . . . . 4.0 1.8 5.2 parsed_6x4x 1
72 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
73 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
74 1 . . . . . 2.5 1.8 3.0 parsed_6x4x 1
75 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
76 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
77 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
78 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
79 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
80 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
81 1 . . . . . 2.5 1.8 2.8 parsed_6x4x 1
82 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
83 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
84 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
85 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
86 1 . . . . . 2.5 1.8 3.0 parsed_6x4x 1
87 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
88 1 . . . . . 2.5 1.8 3.3 parsed_6x4x 1
89 1 . . . . . 2.5 1.8 2.8 parsed_6x4x 1
90 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
91 1 . . . . . 2.5 1.8 2.9 parsed_6x4x 1
92 1 . . . . . 2.5 1.8 2.7 parsed_6x4x 1
93 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
94 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
95 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
96 1 . . . . . 4.0 1.8 5.5 parsed_6x4x 1
97 1 . . . . . 4.0 1.8 6.0 parsed_6x4x 1
98 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
99 1 . . . . . 3.0 1.8 3.5 parsed_6x4x 1
100 1 . . . . . 3.0 1.8 3.5 parsed_6x4x 1
101 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
102 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
103 1 . . . . . 3.0 1.8 5.0 parsed_6x4x 1
104 1 . . . . . 3.0 1.8 4.2 parsed_6x4x 1
105 1 . . . . . 3.0 1.8 4.5 parsed_6x4x 1
106 1 . . . . . 3.0 1.8 4.2 parsed_6x4x 1
107 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
108 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
109 1 . . . . . 3.0 1.8 3.8 parsed_6x4x 1
110 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
111 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
112 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
113 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
114 1 . . . . . 3.0 1.8 4.3 parsed_6x4x 1
115 1 . . . . . 4.0 1.8 4.5 parsed_6x4x 1
116 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
117 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
118 1 . . . . . 3.0 1.8 3.3 parsed_6x4x 1
119 1 . . . . . 4.0 1.8 5.0 parsed_6x4x 1
120 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 1
121 1 . . . . . 3.0 1.8 3.5 parsed_6x4x 1
122 1 . . . . . 3.0 1.8 4.0 parsed_6x4x 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 C40 1 1 1 6 parsed_6x4x 1
2 "B.397 at -4.94e+06" 5 77 5 98 parsed_6x4x 1
3 "B.396 at -2.40e+06" 6 77 6 98 parsed_6x4x 1
4 "B.412 at -1.44e+06" 7 77 7 98 parsed_6x4x 1
5 "B.411 at -6.39e+05" 8 77 8 98 parsed_6x4x 1
6 "C.12 at 6.74e+06" 9 77 9 97 parsed_6x4x 1
7 "C.31 at 1.79e+06" 11 77 11 97 parsed_6x4x 1
8
;
C.340 at 3.51e+06
!!!assign (resid 40 and name HB2 ) (resid 43 and name HB2 ) 4.0 2.2 2.0 ! A.703 at 1.03e+06
!!!assign (resid 40 and name HB1 ) (resid 43 and name HB2 ) 4.0 2.2 1.0 ! A.705 at 7.94e+05
;
12 77 14 101 parsed_6x4x 1
9 G41 22 1 22 6 parsed_6x4x 1
10 "E.56 at 3.98e+08" 24 77 24 97 parsed_6x4x 1
11 "E.200 at 1.27e+09" 25 77 25 97 parsed_6x4x 1
12 "E.201 at 1.27e+09" 26 77 26 97 parsed_6x4x 1
13
;
C.269 at 2.62e+06
E42
;
27 77 29 6 parsed_6x4x 1
14
;
A.710 at -7.84e+06
!!assign (resid 42 and name HB1 ) (resid 43 and name HA ) 4.0 2.2 1.0 ! A.706 at -1.33e+07
;
33 77 34 101 parsed_6x4x 1
15 "assign (resid 42 and name HN ) (resid 43 and name HB1 ) 4.0 2.2 2.0" 40 1 40 77 parsed_6x4x 1
16 R43 46 1 46 6 parsed_6x4x 1
17 "A.720 at 2.84e+06" 47 77 47 97 parsed_6x4x 1
18 "A.711 at -4.23e+06" 48 77 48 98 parsed_6x4x 1
19 "A.714 at 2.57e+06" 49 77 49 97 parsed_6x4x 1
20 "A.717 at 2.14e+06" 50 77 50 97 parsed_6x4x 1
21 "C.458 at 1.53e+06" 51 77 51 97 parsed_6x4x 1
22 "C.459 at 2.52e+06" 52 77 52 97 parsed_6x4x 1
23 "C.460 at 2.67e+06" 53 77 53 97 parsed_6x4x 1
24 "C.461 at 2.80e+06" 54 77 54 97 parsed_6x4x 1
25 "C.226 at 6.90e+06" 55 77 55 97 parsed_6x4x 1
26 G44 68 1 68 6 parsed_6x4x 1
27 "C.328 at 6.92e+06" 71 77 71 97 parsed_6x4x 1
28 "C.329 at 1.01e+07" 72 77 72 97 parsed_6x4x 1
29 Y45 77 1 77 6 parsed_6x4x 1
30 "C.326 at 2.62e+06" 81 77 81 97 parsed_6x4x 1
31 "C.330 at 5.83e+06" 82 77 82 97 parsed_6x4x 1
32 "C.331 at 5.19e+06" 83 77 83 97 parsed_6x4x 1
33 "C.376 at 8.71e+06" 84 77 84 97 parsed_6x4x 1
34 "C.377 at 8.73e+06" 85 77 85 97 parsed_6x4x 1
35 "C.321 at 3.25e+06" 90 77 90 97 parsed_6x4x 1
36 "C.322 at 3.35e+06" 91 77 91 97 parsed_6x4x 1
37 "C.324 at 9.14e+06" 92 77 92 97 parsed_6x4x 1
38 "C.327 at 3.61e+06" 93 77 93 97 parsed_6x4x 1
39 "C.375 at 3.24e+06" 95 77 95 97 parsed_6x4x 1
40
;
E.
!assign (resid 45 and name HB1 ) (resid 47 and name HN ) 4.0 2.2 2.0
F46
;
96 77 100 6 parsed_6x4x 1
41 "E.97 at 9.12e+08" 103 77 103 97 parsed_6x4x 1
42 "C.320 at 3.15e+06" 104 77 104 97 parsed_6x4x 1
43 "C.319 at 4.84e+06" 105 77 105 97 parsed_6x4x 1
44 "C.325 at 1.40e+06" 106 77 106 97 parsed_6x4x 1
45 "C.383 at 5.43e+06" 107 77 107 97 parsed_6x4x 1
46 "C.391 at 7.22e+06" 108 77 108 97 parsed_6x4x 1
47 "C.392 at 7.68e+06" 109 77 109 97 parsed_6x4x 1
48 "C.230 at 1.65e+07" 110 77 110 97 parsed_6x4x 1
49 "E.126 at 5.81e+08" 111 77 111 96 parsed_6x4x 1
50
;
C.352 at 1.49e+06
!!!assign (resid 46 and name HD2 ) (resid 48 and name HG2# ) 4.0 2.2 2.0
Y47
;
112 77 115 6 parsed_6x4x 1
51 "C.349 at 9.80e+06" 119 77 119 97 parsed_6x4x 1
52 "C.350 at 9.17e+06" 120 77 120 97 parsed_6x4x 1
53 "C.378 at 4.66e+06" 121 77 121 97 parsed_6x4x 1
54 "C.399 at 1.41e+07" 122 77 122 97 parsed_6x4x 1
55 "C.400 at 1.29e+07" 123 77 123 97 parsed_6x4x 1
56 "C.194 at 1.33e+07" 126 77 126 97 parsed_6x4x 1
57 "C.334 at 1.85e+06" 127 77 127 97 parsed_6x4x 1
58
;
C.335 at 2.93e+06
!!assign (resid 47 and name HD2 ) (resid 48 and name HG2# ) 4.0 2.2 1.9 ! D.35 at 8.25e+05
;
128 77 129 100 parsed_6x4x 1
59 "E.130 at 4.22e+08" 131 77 131 97 parsed_6x4x 1
60 E. 135 77 135 81 parsed_6x4x 1
61
;
E.
assign (resid 47 and name HE2 ) (resid 50 and name HD2 ) 4.0 2.2 2.0 ! E.140 at 1.22e+08
assign (resid 47 and name HE2 ) (resid 49 and name HB2 ) 4.0 2.2 2.2 !
assign (resid 47 and name HE2 ) (resid 49 and name HG# ) 4.0 2.2 2.0 ! A.706 at 2.08e+08
T48
;
136 77 143 6 parsed_6x4x 1
62 "C.200 at 4.35e+06" 145 77 145 97 parsed_6x4x 1
63 "C.342 at 3.65e+06" 146 77 146 97 parsed_6x4x 1
64 "C.239 at 1.62e+07" 148 77 148 97 parsed_6x4x 1
65 "C.318 at 2.59e+06" 149 77 149 97 parsed_6x4x 1
66 "E.46 at 6.14e+08" 153 77 153 96 parsed_6x4x 1
67
;
E.47 at 8.79e+08
!assign (resid 48 and name HB ) (resid 51 and name HN ) 3.0 1.2 1.8
K49
;
154 77 158 6 parsed_6x4x 1
68 "C.355 at 3.26e+06" 160 77 160 97 parsed_6x4x 1
69 "C.356 at 5.99e+06" 161 77 161 97 parsed_6x4x 1
70 "C.357 at 3.73e+06" 162 77 162 97 parsed_6x4x 1
71 "C.481 at 4.67e+06" 165 77 165 97 parsed_6x4x 1
72 "C.482 at 4.47e+06" 166 77 166 97 parsed_6x4x 1
73 P50 171 1 171 6 parsed_6x4x 1
74 "C.485 at 1.01e+06" 172 77 172 97 parsed_6x4x 1
75 "C.486 at 9.69e+05" 173 77 173 97 parsed_6x4x 1
76
;
C.248 at 1.24e+07
T51
;
174 77 176 6 parsed_6x4x 1
77 "C.249 at 1.57e+06" 178 77 178 97 parsed_6x4x 1
stop_
save_
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