NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
574227 |
2m2w   |
18936 | cing | 2-parsed | STAR | distance | general distance | simple | 88 |
data_2m2w_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m2w
_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_2m2w 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m2w
_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 2m2w "Master copy" parsed_2m2w
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m2w
_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 2m2w.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 2 distance "general distance" simple 88 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 5 distance "general distance" simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 7 distance "general distance" simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 8 distance NOE simple 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 10 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2m2w 1
1 2m2w.mr . . XPLOR/CNS 11 unknown "Not applicable" "Not applicable" 0 parsed_2m2w 1
1 2m2w.mr . . "MR format" 12 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m2w 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2m2w
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_2m2w 1
2 1 . . . parsed_2m2w 1
3 1 . . . parsed_2m2w 1
4 1 . . . parsed_2m2w 1
5 1 . . . parsed_2m2w 1
6 1 . . . parsed_2m2w 1
7 1 . . . parsed_2m2w 1
8 1 . . . parsed_2m2w 1
9 1 . . . parsed_2m2w 1
10 1 . . . parsed_2m2w 1
11 1 . . . parsed_2m2w 1
12 1 . . . parsed_2m2w 1
13 1 . . . parsed_2m2w 1
14 1 . . . parsed_2m2w 1
15 1 . . . parsed_2m2w 1
16 1 . . . parsed_2m2w 1
17 1 . . . parsed_2m2w 1
18 1 . . . parsed_2m2w 1
19 1 . . . parsed_2m2w 1
20 1 . . . parsed_2m2w 1
21 1 . . . parsed_2m2w 1
22 1 . . . parsed_2m2w 1
23 1 . . . parsed_2m2w 1
24 1 . . . parsed_2m2w 1
25 1 . . . parsed_2m2w 1
26 1 . . . parsed_2m2w 1
27 1 . . . parsed_2m2w 1
28 1 . . . parsed_2m2w 1
29 1 . . . parsed_2m2w 1
30 1 . . . parsed_2m2w 1
31 1 . . . parsed_2m2w 1
32 1 . . . parsed_2m2w 1
33 1 . . . parsed_2m2w 1
34 1 . . . parsed_2m2w 1
35 1 . . . parsed_2m2w 1
36 1 . . . parsed_2m2w 1
37 1 . . . parsed_2m2w 1
38 1 . . . parsed_2m2w 1
39 1 . . . parsed_2m2w 1
40 1 . . . parsed_2m2w 1
41 1 . . . parsed_2m2w 1
42 1 . . . parsed_2m2w 1
43 1 . . . parsed_2m2w 1
44 1 . . . parsed_2m2w 1
45 1 . . . parsed_2m2w 1
46 1 . . . parsed_2m2w 1
47 1 . . . parsed_2m2w 1
48 1 . . . parsed_2m2w 1
49 1 . . . parsed_2m2w 1
50 1 . . . parsed_2m2w 1
51 1 . . . parsed_2m2w 1
52 1 . . . parsed_2m2w 1
53 1 . . . parsed_2m2w 1
54 1 . . . parsed_2m2w 1
55 1 . . . parsed_2m2w 1
56 1 . . . parsed_2m2w 1
57 1 . . . parsed_2m2w 1
58 1 . . . parsed_2m2w 1
59 1 . . . parsed_2m2w 1
60 1 . . . parsed_2m2w 1
61 1 . . . parsed_2m2w 1
62 1 . . . parsed_2m2w 1
63 1 . . . parsed_2m2w 1
64 1 . . . parsed_2m2w 1
65 1 . . . parsed_2m2w 1
66 1 . . . parsed_2m2w 1
67 1 . . . parsed_2m2w 1
68 1 . . . parsed_2m2w 1
69 1 . . . parsed_2m2w 1
70 1 . . . parsed_2m2w 1
71 1 . . . parsed_2m2w 1
72 1 . . . parsed_2m2w 1
73 1 . . . parsed_2m2w 1
74 1 . . . parsed_2m2w 1
75 1 . . . parsed_2m2w 1
76 1 . . . parsed_2m2w 1
77 1 . . . parsed_2m2w 1
78 1 . . . parsed_2m2w 1
79 1 . . . parsed_2m2w 1
80 1 . . . parsed_2m2w 1
81 1 . . . parsed_2m2w 1
82 1 . . . parsed_2m2w 1
83 1 . . . parsed_2m2w 1
84 1 . . . parsed_2m2w 1
85 1 . . . parsed_2m2w 1
86 1 . . . parsed_2m2w 1
87 1 . . . parsed_2m2w 1
88 1 . . . parsed_2m2w 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 . . . . . . . . A 100 . OD2 parsed_2m2w 1
1 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
2 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
2 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
3 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
3 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
4 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
4 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
5 1 1 . . . . . . . . A 49 . OD2 parsed_2m2w 1
5 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
6 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
6 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
7 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
7 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
8 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
8 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
9 1 1 . . . . . . . . C 1 . PG parsed_2m2w 1
9 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
10 1 1 . . . . . . . . C 1 . PB parsed_2m2w 1
10 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
11 1 1 . . . . . . . . C 1 . PG parsed_2m2w 1
11 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
12 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
12 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
13 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
13 1 2 . . . . . . . . C 1 . O3G parsed_2m2w 1
14 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
14 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
15 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
15 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
16 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
16 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
17 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
17 1 2 . . . . . . . . C 1 . PA parsed_2m2w 1
18 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
18 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
19 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
19 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
20 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
20 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
21 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
21 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
22 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
22 1 2 . . . . . . . . C 1 . O3G parsed_2m2w 1
23 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
23 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
24 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
24 1 2 . . . . . . . . C 1 . PG parsed_2m2w 1
25 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
25 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
26 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
26 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
27 1 1 . . . . . . . . C 1 . O2B parsed_2m2w 1
27 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
28 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
28 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
29 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
29 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
30 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
30 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
31 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
31 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
32 1 1 . . . . . . . . A 49 . OD2 parsed_2m2w 1
32 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
33 1 1 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
33 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
34 1 1 . . . . . . . . A 100 . OD2 parsed_2m2w 1
34 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
35 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
35 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
36 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
36 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
37 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
37 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
38 1 1 . . . . . . . . A 49 . OD2 parsed_2m2w 1
38 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
39 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
39 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
40 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
40 1 2 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
41 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
41 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
42 1 1 . . . . . . . . C 1 . PG parsed_2m2w 1
42 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
43 1 1 . . . . . . . . C 1 . PB parsed_2m2w 1
43 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
44 1 1 . . . . . . . . C 1 . PG parsed_2m2w 1
44 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
45 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
45 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
46 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
46 1 2 . . . . . . . . C 1 . O3G parsed_2m2w 1
47 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
47 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
48 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
48 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
49 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
49 1 2 . . . . . . . . C 1 . PB parsed_2m2w 1
50 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
50 1 2 . . . . . . . . C 1 . PA parsed_2m2w 1
51 1 1 . . . . . . . . B 23 . O3' parsed_2m2w 1
51 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
52 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
52 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
53 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
53 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
54 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
54 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
55 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
55 1 2 . . . . . . . . C 1 . O3G parsed_2m2w 1
56 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
56 1 2 . . . . . . . . C 1 . O2B parsed_2m2w 1
57 1 1 . . . . . . . . C 1 . PA parsed_2m2w 1
57 1 2 . . . . . . . . C 1 . PG parsed_2m2w 1
58 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
58 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
59 1 1 . . . . . . . . A 51 . OD1 parsed_2m2w 1
59 1 2 . . . . . . . . C 1 . O1A parsed_2m2w 1
60 1 1 . . . . . . . . C 1 . O2B parsed_2m2w 1
60 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
61 1 1 . . . . . . . . C 1 . O3G parsed_2m2w 1
61 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
62 1 1 . . . . . . . . A 49 . OD1 parsed_2m2w 1
62 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
63 1 1 . . . . . . . . A 51 . OD2 parsed_2m2w 1
63 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
64 1 1 . . . . . . . . C 1 . O1A parsed_2m2w 1
64 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
65 1 1 . . . . . . . . A 49 . OD2 parsed_2m2w 1
65 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
66 1 1 . . . . . . . . C 2 . MG+2 parsed_2m2w 1
66 1 2 . . . . . . . . C 3 . MG+2 parsed_2m2w 1
67 1 1 . . . . . . . . C 1 . C1' parsed_2m2w 1
67 1 2 . . . . . . . . C 1 . C8 parsed_2m2w 1
68 1 1 . . . . . . . . B 10 . N2 parsed_2m2w 1
68 1 2 . . . . . . . . C 1 . N7 parsed_2m2w 1
69 1 1 . . . . . . . . B 10 . N1 parsed_2m2w 1
69 1 2 . . . . . . . . C 1 . N7 parsed_2m2w 1
70 1 1 . . . . . . . . B 10 . N1 parsed_2m2w 1
70 1 2 . . . . . . . . C 1 . O6 parsed_2m2w 1
71 1 1 . . . . . . . . B 10 . N2 parsed_2m2w 1
71 1 2 . . . . . . . . C 1 . O6 parsed_2m2w 1
72 1 1 . . . . . . . . B 10 . O6 parsed_2m2w 1
72 1 2 . . . . . . . . C 1 . O6 parsed_2m2w 1
73 1 1 . . . . . . . . B 10 . H22 parsed_2m2w 1
73 1 2 . . . . . . . . C 1 . N7 parsed_2m2w 1
74 1 1 . . . . . . . . C 1 . O2A parsed_2m2w 1
74 1 2 . . . . . . . . C 1 . N2 parsed_2m2w 1
75 1 1 . . . . . . . . A 115 . HE2 parsed_2m2w 1
75 1 2 . . . . . . . . C 1 . N7 parsed_2m2w 1
76 1 1 . . . . . . . . A 120 . HG1* parsed_2m2w 1
76 1 2 . . . . . . . . B 10 . H1 parsed_2m2w 1
77 1 1 . . . . . . . . A 124 . HD1* parsed_2m2w 1
77 1 2 . . . . . . . . B 10 . H1 parsed_2m2w 1
78 1 1 . . . . . . . . A 127 . HE parsed_2m2w 1
78 1 2 . . . . . . . . B 10 . H1 parsed_2m2w 1
79 1 1 . . . . . . . . A 115 . HE2 parsed_2m2w 1
79 1 2 . . . . . . . . B 11 . H1 parsed_2m2w 1
80 1 1 . . . . . . . . B 10 . C1' parsed_2m2w 1
80 1 2 . . . . . . . . C 1 . C1' parsed_2m2w 1
81 1 1 . . . . . . . . B 7 . C1' parsed_2m2w 1
81 1 2 . . . . . . . . B 3 . C1' parsed_2m2w 1
82 1 1 . . . . . . . . B 8 . C1' parsed_2m2w 1
82 1 2 . . . . . . . . B 2 . C1' parsed_2m2w 1
83 1 1 . . . . . . . . B 9 . C1' parsed_2m2w 1
83 1 2 . . . . . . . . B 1 . C1' parsed_2m2w 1
84 1 1 . . . . . . . . B 11 . C1' parsed_2m2w 1
84 1 2 . . . . . . . . B 23 . C1' parsed_2m2w 1
85 1 1 . . . . . . . . B 12 . C1' parsed_2m2w 1
85 1 2 . . . . . . . . B 22 . C1' parsed_2m2w 1
86 1 1 . . . . . . . . B 13 . C1' parsed_2m2w 1
86 1 2 . . . . . . . . B 21 . C1' parsed_2m2w 1
87 1 1 . . . . . . . . B 14 . C1' parsed_2m2w 1
87 1 2 . . . . . . . . B 20 . C1' parsed_2m2w 1
88 1 1 . . . . . . . . B 15 . C1' parsed_2m2w 1
88 1 2 . . . . . . . . B 19 . C1' parsed_2m2w 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 . . . . . 2.2 1.9 2.4 parsed_2m2w 1
2 1 . . . . . 2.2 1.9 2.4 parsed_2m2w 1
3 1 . . . . . 2.0 1.7 2.2 parsed_2m2w 1
4 1 . . . . . 2.2 1.9 2.4 parsed_2m2w 1
5 1 . . . . . 2.1 1.8 2.3 parsed_2m2w 1
6 1 . . . . . 4.0 3.7 4.2 parsed_2m2w 1
7 1 . . . . . 3.3 3.0 3.5 parsed_2m2w 1
8 1 . . . . . 3.1 2.8 3.3 parsed_2m2w 1
9 1 . . . . . 2.7 2.4 2.9 parsed_2m2w 1
10 1 . . . . . 3.1 2.8 3.3 parsed_2m2w 1
11 1 . . . . . 3.3 3.0 3.5 parsed_2m2w 1
12 1 . . . . . 3.1 2.8 3.3 parsed_2m2w 1
13 1 . . . . . 3.1 2.8 3.3 parsed_2m2w 1
14 1 . . . . . 2.76 2.46 2.96 parsed_2m2w 1
15 1 . . . . . 3.4 3.1 3.6 parsed_2m2w 1
16 1 . . . . . 2.93 2.63 3.13 parsed_2m2w 1
17 1 . . . . . 3.4 3.1 4.1 parsed_2m2w 1
18 1 . . . . . 3.14 2.84 3.84 parsed_2m2w 1
19 1 . . . . . 3.07 2.77 3.77 parsed_2m2w 1
20 1 . . . . . 4.76 4.46 5.46 parsed_2m2w 1
21 1 . . . . . 2.9 2.6 3.6 parsed_2m2w 1
22 1 . . . . . 2.73 2.43 3.43 parsed_2m2w 1
23 1 . . . . . 3.93 3.63 4.63 parsed_2m2w 1
24 1 . . . . . 4.3 4.0 4.5 parsed_2m2w 1
25 1 . . . . . 2.82 2.52 3.52 parsed_2m2w 1
26 1 . . . . . 3.07 2.77 3.77 parsed_2m2w 1
27 1 . . . . . 2.1 1.8 2.3 parsed_2m2w 1
28 1 . . . . . 2.1 1.8 2.3 parsed_2m2w 1
29 1 . . . . . 2.0 1.7 2.2 parsed_2m2w 1
30 1 . . . . . 2.0 1.7 2.2 parsed_2m2w 1
31 1 . . . . . 2.1 1.8 2.3 parsed_2m2w 1
32 1 . . . . . 3.4 3.1 3.6 parsed_2m2w 1
33 1 . . . . . 4.0 3.7 4.2 parsed_2m2w 1
34 1 . . . . . 2.15 2.14 2.16 parsed_2m2w 1
35 1 . . . . . 2.2 2.19 2.21 parsed_2m2w 1
36 1 . . . . . 2.01 2.00 2.02 parsed_2m2w 1
37 1 . . . . . 2.2 2.19 2.21 parsed_2m2w 1
38 1 . . . . . 2.05 2.04 2.06 parsed_2m2w 1
39 1 . . . . . 3.50 3.49 3.51 parsed_2m2w 1
40 1 . . . . . 3.3 3.29 3.31 parsed_2m2w 1
41 1 . . . . . 3.1 3.09 3.11 parsed_2m2w 1
42 1 . . . . . 2.7 2.69 2.71 parsed_2m2w 1
43 1 . . . . . 3.1 3.09 3.11 parsed_2m2w 1
44 1 . . . . . 3.3 3.29 3.31 parsed_2m2w 1
45 1 . . . . . 3.1 3.09 3.11 parsed_2m2w 1
46 1 . . . . . 3.1 3.09 3.11 parsed_2m2w 1
47 1 . . . . . 2.76 2.75 2.77 parsed_2m2w 1
48 1 . . . . . 3.4 3.39 3.41 parsed_2m2w 1
49 1 . . . . . 2.93 2.92 2.94 parsed_2m2w 1
50 1 . . . . . 3.4 3.39 3.41 parsed_2m2w 1
51 1 . . . . . 3.14 3.13 3.15 parsed_2m2w 1
52 1 . . . . . 3.07 3.06 3.08 parsed_2m2w 1
53 1 . . . . . 4.76 4.75 4.77 parsed_2m2w 1
54 1 . . . . . 2.9 2.89 2.91 parsed_2m2w 1
55 1 . . . . . 2.73 2.72 2.74 parsed_2m2w 1
56 1 . . . . . 3.93 3.92 3.94 parsed_2m2w 1
57 1 . . . . . 4.3 4.29 4.31 parsed_2m2w 1
58 1 . . . . . 2.82 2.81 2.83 parsed_2m2w 1
59 1 . . . . . 3.07 3.06 3.08 parsed_2m2w 1
60 1 . . . . . 2.04 2.03 2.05 parsed_2m2w 1
61 1 . . . . . 2.08 2.07 2.09 parsed_2m2w 1
62 1 . . . . . 1.95 1.94 1.96 parsed_2m2w 1
63 1 . . . . . 2.02 2.01 2.03 parsed_2m2w 1
64 1 . . . . . 2.06 2.05 2.07 parsed_2m2w 1
65 1 . . . . . 3.40 3.39 3.41 parsed_2m2w 1
66 1 . . . . . 3.5 3.49 3.51 parsed_2m2w 1
67 1 . . . . . 2.5 2.2 2.8 parsed_2m2w 1
68 1 . . . . . 2.80 2.79 2.81 parsed_2m2w 1
69 1 . . . . . 3.46 3.45 3.47 parsed_2m2w 1
70 1 . . . . . 3.01 3.00 3.02 parsed_2m2w 1
71 1 . . . . . 4.42 4.41 4.43 parsed_2m2w 1
72 1 . . . . . 2.96 2.95 2.97 parsed_2m2w 1
73 1 . . . . . 1.70 1.69 1.71 parsed_2m2w 1
74 1 . . . . . 3.5 3.2 3.7 parsed_2m2w 1
75 1 . . . . . 2.70 2.60 2.80 parsed_2m2w 1
76 1 . . . . . 5.0 1.8 6.0 parsed_2m2w 1
77 1 . . . . . 5.0 1.8 6.0 parsed_2m2w 1
78 1 . . . . . 5.0 1.8 6.0 parsed_2m2w 1
79 1 . . . . . 5.0 1.8 6.0 parsed_2m2w 1
80 1 . . . . . 11.0 10.95 11.05 parsed_2m2w 1
81 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
82 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
83 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
84 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
85 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
86 1 . . . . . 10.5 10.49 10.51 parsed_2m2w 1
87 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 1
88 1 . . . . . 10.7 10.69 10.71 parsed_2m2w 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 vw 85 99 85 102 parsed_2m2w 1
2 vw 86 99 86 102 parsed_2m2w 1
3 vw 87 98 87 101 parsed_2m2w 1
4 vw 88 98 88 101 parsed_2m2w 1
5 vw 89 100 89 103 parsed_2m2w 1
6 vw 90 98 90 101 parsed_2m2w 1
7 vw 91 98 91 101 parsed_2m2w 1
8 vw 92 98 92 101 parsed_2m2w 1
9 vw 93 100 93 103 parsed_2m2w 1
10 vw 94 100 94 103 parsed_2m2w 1
11 vw 95 100 95 103 parsed_2m2w 1
12 vw 96 100 96 103 parsed_2m2w 1
13 vw 97 100 97 103 parsed_2m2w 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1
;
#
# 33 "tighter" distance restraints used during the second and the final stages, the semi-flexible
# simulated annealing and final water-refinement, to obtain the 10 final models
;
34 1 37 79 parsed_2m2w 1
2
;
#
# distance restraints used throughout the calculations
;
72 1 74 54 parsed_2m2w 1
stop_
save_
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