NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
33929 |
1j5n   |
4869 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 102 |
data_1j5n_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1j5n
_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_1j5n 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1j5n
_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 1j5n "Master copy" parsed_1j5n
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1j5n
_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 1j5n.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 2 distance NOE ambi 2854 parsed_1j5n 1
1 1j5n.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 76 parsed_1j5n 1
1 1j5n.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 102 parsed_1j5n 1
1 1j5n.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 12 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . XPLOR/CNS 13 planarity "Not applicable" "Not applicable" 0 parsed_1j5n 1
1 1j5n.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1j5n 1
stop_
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1j5n
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1j5n 1
2 1 . . . parsed_1j5n 1
3 1 . . . parsed_1j5n 1
4 1 . . . parsed_1j5n 1
5 1 . . . parsed_1j5n 1
6 1 . . . parsed_1j5n 1
7 1 . . . parsed_1j5n 1
8 1 . . . parsed_1j5n 1
9 1 . . . parsed_1j5n 1
10 1 . . . parsed_1j5n 1
11 1 . . . parsed_1j5n 1
12 1 . . . parsed_1j5n 1
13 1 . . . parsed_1j5n 1
14 1 . . . parsed_1j5n 1
15 1 . . . parsed_1j5n 1
16 1 . . . parsed_1j5n 1
17 1 . . . parsed_1j5n 1
18 1 . . . parsed_1j5n 1
19 1 . . . parsed_1j5n 1
20 1 . . . parsed_1j5n 1
21 1 . . . parsed_1j5n 1
22 1 . . . parsed_1j5n 1
23 1 . . . parsed_1j5n 1
24 1 . . . parsed_1j5n 1
25 1 . . . parsed_1j5n 1
26 1 . . . parsed_1j5n 1
27 1 . . . parsed_1j5n 1
28 1 . . . parsed_1j5n 1
29 1 . . . parsed_1j5n 1
30 1 . . . parsed_1j5n 1
31 1 . . . parsed_1j5n 1
32 1 . . . parsed_1j5n 1
33 1 . . . parsed_1j5n 1
34 1 . . . parsed_1j5n 1
35 1 . . . parsed_1j5n 1
36 1 . . . parsed_1j5n 1
37 1 . . . parsed_1j5n 1
38 1 . . . parsed_1j5n 1
39 1 . . . parsed_1j5n 1
40 1 . . . parsed_1j5n 1
41 1 . . . parsed_1j5n 1
42 1 . . . parsed_1j5n 1
43 1 . . . parsed_1j5n 1
44 1 . . . parsed_1j5n 1
45 1 . . . parsed_1j5n 1
46 1 . . . parsed_1j5n 1
47 1 . . . parsed_1j5n 1
48 1 . . . parsed_1j5n 1
49 1 . . . parsed_1j5n 1
50 1 . . . parsed_1j5n 1
51 1 . . . parsed_1j5n 1
52 1 . . . parsed_1j5n 1
53 1 . . . parsed_1j5n 1
54 1 . . . parsed_1j5n 1
55 1 . . . parsed_1j5n 1
56 1 . . . parsed_1j5n 1
57 1 . . . parsed_1j5n 1
58 1 . . . parsed_1j5n 1
59 1 . . . parsed_1j5n 1
60 1 . . . parsed_1j5n 1
61 1 . . . parsed_1j5n 1
62 1 . . . parsed_1j5n 1
63 1 . . . parsed_1j5n 1
64 1 . . . parsed_1j5n 1
65 1 . . . parsed_1j5n 1
66 1 . . . parsed_1j5n 1
67 1 . . . parsed_1j5n 1
68 1 . . . parsed_1j5n 1
69 1 . . . parsed_1j5n 1
70 1 . . . parsed_1j5n 1
71 1 . . . parsed_1j5n 1
72 1 . . . parsed_1j5n 1
73 1 . . . parsed_1j5n 1
74 1 . . . parsed_1j5n 1
75 1 . . . parsed_1j5n 1
76 1 . . . parsed_1j5n 1
77 1 . . . parsed_1j5n 1
78 1 . . . parsed_1j5n 1
79 1 . . . parsed_1j5n 1
80 1 . . . parsed_1j5n 1
81 1 . . . parsed_1j5n 1
82 1 . . . parsed_1j5n 1
83 1 . . . parsed_1j5n 1
84 1 . . . parsed_1j5n 1
85 1 . . . parsed_1j5n 1
86 1 . . . parsed_1j5n 1
87 1 . . . parsed_1j5n 1
88 1 . . . parsed_1j5n 1
89 1 . . . parsed_1j5n 1
90 1 . . . parsed_1j5n 1
91 1 . . . parsed_1j5n 1
92 1 . . . parsed_1j5n 1
93 1 . . . parsed_1j5n 1
94 1 . . . parsed_1j5n 1
95 1 . . . parsed_1j5n 1
96 1 . . . parsed_1j5n 1
97 1 . . . parsed_1j5n 1
98 1 . . . parsed_1j5n 1
99 1 . . . parsed_1j5n 1
100 1 . . . parsed_1j5n 1
101 1 . . . parsed_1j5n 1
102 1 . . . parsed_1j5n 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 . . . . . . . . . 26 . O parsed_1j5n 1
1 1 2 . . . . . . . . . 29 . HN parsed_1j5n 1
2 1 1 . . . . . . . . . 26 . O parsed_1j5n 1
2 1 2 . . . . . . . . . 29 . N parsed_1j5n 1
3 1 1 . . . . . . . . . 26 . O parsed_1j5n 1
3 1 2 . . . . . . . . . 30 . HN parsed_1j5n 1
4 1 1 . . . . . . . . . 26 . O parsed_1j5n 1
4 1 2 . . . . . . . . . 30 . N parsed_1j5n 1
5 1 1 . . . . . . . . . 27 . O parsed_1j5n 1
5 1 2 . . . . . . . . . 31 . HN parsed_1j5n 1
6 1 1 . . . . . . . . . 27 . O parsed_1j5n 1
6 1 2 . . . . . . . . . 31 . N parsed_1j5n 1
7 1 1 . . . . . . . . . 28 . O parsed_1j5n 1
7 1 2 . . . . . . . . . 32 . HN parsed_1j5n 1
8 1 1 . . . . . . . . . 28 . O parsed_1j5n 1
8 1 2 . . . . . . . . . 32 . N parsed_1j5n 1
9 1 1 . . . . . . . . . 29 . O parsed_1j5n 1
9 1 2 . . . . . . . . . 33 . HN parsed_1j5n 1
10 1 1 . . . . . . . . . 29 . O parsed_1j5n 1
10 1 2 . . . . . . . . . 33 . N parsed_1j5n 1
11 1 1 . . . . . . . . . 32 . O parsed_1j5n 1
11 1 2 . . . . . . . . . 36 . HN parsed_1j5n 1
12 1 1 . . . . . . . . . 32 . O parsed_1j5n 1
12 1 2 . . . . . . . . . 36 . N parsed_1j5n 1
13 1 1 . . . . . . . . . 35 . O parsed_1j5n 1
13 1 2 . . . . . . . . . 39 . HN parsed_1j5n 1
14 1 1 . . . . . . . . . 35 . O parsed_1j5n 1
14 1 2 . . . . . . . . . 39 . N parsed_1j5n 1
15 1 1 . . . . . . . . . 39 . O parsed_1j5n 1
15 1 2 . . . . . . . . . 43 . HN parsed_1j5n 1
16 1 1 . . . . . . . . . 39 . O parsed_1j5n 1
16 1 2 . . . . . . . . . 43 . N parsed_1j5n 1
17 1 1 . . . . . . . . . 51 . O parsed_1j5n 1
17 1 2 . . . . . . . . . 55 . HN parsed_1j5n 1
18 1 1 . . . . . . . . . 51 . O parsed_1j5n 1
18 1 2 . . . . . . . . . 55 . N parsed_1j5n 1
19 1 1 . . . . . . . . . 52 . O parsed_1j5n 1
19 1 2 . . . . . . . . . 56 . HN parsed_1j5n 1
20 1 1 . . . . . . . . . 52 . O parsed_1j5n 1
20 1 2 . . . . . . . . . 56 . N parsed_1j5n 1
21 1 1 . . . . . . . . . 53 . O parsed_1j5n 1
21 1 2 . . . . . . . . . 57 . HN parsed_1j5n 1
22 1 1 . . . . . . . . . 53 . O parsed_1j5n 1
22 1 2 . . . . . . . . . 57 . N parsed_1j5n 1
23 1 1 . . . . . . . . . 54 . O parsed_1j5n 1
23 1 2 . . . . . . . . . 58 . HN parsed_1j5n 1
24 1 1 . . . . . . . . . 54 . O parsed_1j5n 1
24 1 2 . . . . . . . . . 58 . N parsed_1j5n 1
25 1 1 . . . . . . . . . 55 . O parsed_1j5n 1
25 1 2 . . . . . . . . . 59 . HN parsed_1j5n 1
26 1 1 . . . . . . . . . 55 . O parsed_1j5n 1
26 1 2 . . . . . . . . . 59 . N parsed_1j5n 1
27 1 1 . . . . . . . . . 56 . O parsed_1j5n 1
27 1 2 . . . . . . . . . 60 . HN parsed_1j5n 1
28 1 1 . . . . . . . . . 56 . O parsed_1j5n 1
28 1 2 . . . . . . . . . 60 . N parsed_1j5n 1
29 1 1 . . . . . . . . . 57 . O parsed_1j5n 1
29 1 2 . . . . . . . . . 61 . HN parsed_1j5n 1
30 1 1 . . . . . . . . . 57 . O parsed_1j5n 1
30 1 2 . . . . . . . . . 61 . N parsed_1j5n 1
31 1 1 . . . . . . . . . 58 . O parsed_1j5n 1
31 1 2 . . . . . . . . . 62 . HN parsed_1j5n 1
32 1 1 . . . . . . . . . 58 . O parsed_1j5n 1
32 1 2 . . . . . . . . . 62 . N parsed_1j5n 1
33 1 1 . . . . . . . . . 63 . O parsed_1j5n 1
33 1 2 . . . . . . . . . 66 . HN parsed_1j5n 1
34 1 1 . . . . . . . . . 63 . O parsed_1j5n 1
34 1 2 . . . . . . . . . 66 . N parsed_1j5n 1
35 1 1 . . . . . . . . . 63 . O parsed_1j5n 1
35 1 2 . . . . . . . . . 67 . HN parsed_1j5n 1
36 1 1 . . . . . . . . . 63 . O parsed_1j5n 1
36 1 2 . . . . . . . . . 67 . N parsed_1j5n 1
37 1 1 . . . . . . . . . 64 . O parsed_1j5n 1
37 1 2 . . . . . . . . . 68 . HN parsed_1j5n 1
38 1 1 . . . . . . . . . 64 . O parsed_1j5n 1
38 1 2 . . . . . . . . . 68 . N parsed_1j5n 1
39 1 1 . . . . . . . . . 66 . O parsed_1j5n 1
39 1 1 . . . . . . . . . 67 . O parsed_1j5n 1
39 1 2 . . . . . . . . . 70 . HN parsed_1j5n 1
40 1 1 . . . . . . . . . 66 . O parsed_1j5n 1
40 1 1 . . . . . . . . . 67 . O parsed_1j5n 1
40 1 2 . . . . . . . . . 70 . N parsed_1j5n 1
41 1 1 . . . . . . . . . 67 . O parsed_1j5n 1
41 1 2 . . . . . . . . . 71 . HN parsed_1j5n 1
42 1 1 . . . . . . . . . 67 . O parsed_1j5n 1
42 1 2 . . . . . . . . . 71 . N parsed_1j5n 1
43 1 1 . . . . . . . . . 69 . O parsed_1j5n 1
43 1 2 . . . . . . . . . 73 . HN parsed_1j5n 1
44 1 1 . . . . . . . . . 69 . O parsed_1j5n 1
44 1 2 . . . . . . . . . 73 . N parsed_1j5n 1
45 1 1 . . . . . . . . . 70 . O parsed_1j5n 1
45 1 2 . . . . . . . . . 74 . HN parsed_1j5n 1
46 1 1 . . . . . . . . . 70 . O parsed_1j5n 1
46 1 2 . . . . . . . . . 74 . N parsed_1j5n 1
47 1 1 . . . . . . . . . 71 . O parsed_1j5n 1
47 1 2 . . . . . . . . . 75 . HN parsed_1j5n 1
48 1 1 . . . . . . . . . 71 . O parsed_1j5n 1
48 1 2 . . . . . . . . . 75 . N parsed_1j5n 1
49 1 1 . . . . . . . . . 72 . O parsed_1j5n 1
49 1 2 . . . . . . . . . 76 . HN parsed_1j5n 1
50 1 1 . . . . . . . . . 72 . O parsed_1j5n 1
50 1 2 . . . . . . . . . 76 . N parsed_1j5n 1
51 1 1 . . . . . . . . . 73 . O parsed_1j5n 1
51 1 2 . . . . . . . . . 77 . HN parsed_1j5n 1
52 1 1 . . . . . . . . . 73 . O parsed_1j5n 1
52 1 2 . . . . . . . . . 77 . N parsed_1j5n 1
53 1 1 . . . . . . . . . 74 . O parsed_1j5n 1
53 1 2 . . . . . . . . . 78 . HN parsed_1j5n 1
54 1 1 . . . . . . . . . 74 . O parsed_1j5n 1
54 1 2 . . . . . . . . . 78 . N parsed_1j5n 1
55 1 1 . . . . . . . . . 30 . O parsed_1j5n 1
55 1 2 . . . . . . . . . 34 . HN parsed_1j5n 1
56 1 1 . . . . . . . . . 30 . O parsed_1j5n 1
56 1 2 . . . . . . . . . 34 . N parsed_1j5n 1
57 1 1 . . . . . . . . . 31 . O parsed_1j5n 1
57 1 2 . . . . . . . . . 35 . HN parsed_1j5n 1
58 1 1 . . . . . . . . . 31 . O parsed_1j5n 1
58 1 2 . . . . . . . . . 35 . N parsed_1j5n 1
59 1 1 . . . . . . . . . 34 . O parsed_1j5n 1
59 1 2 . . . . . . . . . 38 . HN parsed_1j5n 1
60 1 1 . . . . . . . . . 34 . O parsed_1j5n 1
60 1 2 . . . . . . . . . 38 . N parsed_1j5n 1
61 1 1 . . . . . . . . . 35 . O parsed_1j5n 1
61 1 2 . . . . . . . . . 39 . HN parsed_1j5n 1
62 1 1 . . . . . . . . . 35 . O parsed_1j5n 1
62 1 2 . . . . . . . . . 39 . N parsed_1j5n 1
63 1 1 . . . . . . . . . 36 . O parsed_1j5n 1
63 1 2 . . . . . . . . . 40 . HN parsed_1j5n 1
64 1 1 . . . . . . . . . 36 . O parsed_1j5n 1
64 1 2 . . . . . . . . . 40 . N parsed_1j5n 1
65 1 1 . . . . . . . . . 37 . O parsed_1j5n 1
65 1 2 . . . . . . . . . 41 . HN parsed_1j5n 1
66 1 1 . . . . . . . . . 37 . O parsed_1j5n 1
66 1 2 . . . . . . . . . 41 . N parsed_1j5n 1
67 1 1 . . . . . . . . . 38 . O parsed_1j5n 1
67 1 2 . . . . . . . . . 42 . HN parsed_1j5n 1
68 1 1 . . . . . . . . . 38 . O parsed_1j5n 1
68 1 2 . . . . . . . . . 42 . N parsed_1j5n 1
69 1 1 . . . . . . . . . 47 . O parsed_1j5n 1
69 1 2 . . . . . . . . . 51 . HN parsed_1j5n 1
70 1 1 . . . . . . . . . 47 . O parsed_1j5n 1
70 1 2 . . . . . . . . . 51 . N parsed_1j5n 1
71 1 1 . . . . . . . . . 48 . O parsed_1j5n 1
71 1 2 . . . . . . . . . 52 . HN parsed_1j5n 1
72 1 1 . . . . . . . . . 48 . O parsed_1j5n 1
72 1 2 . . . . . . . . . 52 . N parsed_1j5n 1
73 1 1 . . . . . . . . . 50 . O parsed_1j5n 1
73 1 2 . . . . . . . . . 54 . HN parsed_1j5n 1
74 1 1 . . . . . . . . . 50 . O parsed_1j5n 1
74 1 2 . . . . . . . . . 54 . N parsed_1j5n 1
75 1 1 . . . . . . . . . 68 . O parsed_1j5n 1
75 1 2 . . . . . . . . . 72 . HN parsed_1j5n 1
76 1 1 . . . . . . . . . 68 . O parsed_1j5n 1
76 1 2 . . . . . . . . . 72 . N parsed_1j5n 1
77 1 1 . . . . . . . . . 75 . O parsed_1j5n 1
77 1 2 . . . . . . . . . 79 . HN parsed_1j5n 1
78 1 1 . . . . . . . . . 75 . O parsed_1j5n 1
78 1 2 . . . . . . . . . 79 . N parsed_1j5n 1
79 1 1 . . . . . . . . . 77 . O parsed_1j5n 1
79 1 2 . . . . . . . . . 81 . HN parsed_1j5n 1
80 1 1 . . . . . . . . . 77 . O parsed_1j5n 1
80 1 2 . . . . . . . . . 81 . N parsed_1j5n 1
81 1 1 . . . . . . . . . 78 . O parsed_1j5n 1
81 1 2 . . . . . . . . . 82 . HN parsed_1j5n 1
82 1 1 . . . . . . . . . 78 . O parsed_1j5n 1
82 1 2 . . . . . . . . . 82 . N parsed_1j5n 1
83 1 1 . . . . . . . . . 79 . O parsed_1j5n 1
83 1 2 . . . . . . . . . 83 . HN parsed_1j5n 1
84 1 1 . . . . . . . . . 79 . O parsed_1j5n 1
84 1 2 . . . . . . . . . 83 . N parsed_1j5n 1
85 1 1 . . . . . . . . . 81 . O parsed_1j5n 1
85 1 2 . . . . . . . . . 85 . HN parsed_1j5n 1
86 1 1 . . . . . . . . . 81 . O parsed_1j5n 1
86 1 2 . . . . . . . . . 85 . N parsed_1j5n 1
87 1 1 . . . . . . . . . 82 . O parsed_1j5n 1
87 1 2 . . . . . . . . . 86 . HN parsed_1j5n 1
88 1 1 . . . . . . . . . 82 . O parsed_1j5n 1
88 1 2 . . . . . . . . . 86 . N parsed_1j5n 1
89 1 1 . . . . . . . . . 83 . O parsed_1j5n 1
89 1 2 . . . . . . . . . 87 . HN parsed_1j5n 1
90 1 1 . . . . . . . . . 83 . O parsed_1j5n 1
90 1 2 . . . . . . . . . 87 . N parsed_1j5n 1
91 1 1 . . . . . . . . . 84 . O parsed_1j5n 1
91 1 2 . . . . . . . . . 88 . HN parsed_1j5n 1
92 1 1 . . . . . . . . . 84 . O parsed_1j5n 1
92 1 2 . . . . . . . . . 88 . N parsed_1j5n 1
93 1 1 . . . . . . . . . 85 . O parsed_1j5n 1
93 1 2 . . . . . . . . . 89 . HN parsed_1j5n 1
94 1 1 . . . . . . . . . 85 . O parsed_1j5n 1
94 1 2 . . . . . . . . . 89 . N parsed_1j5n 1
95 1 1 . . . . . . . . . 86 . O parsed_1j5n 1
95 1 2 . . . . . . . . . 90 . HN parsed_1j5n 1
96 1 1 . . . . . . . . . 86 . O parsed_1j5n 1
96 1 2 . . . . . . . . . 90 . N parsed_1j5n 1
97 1 1 . . . . . . . . . 87 . O parsed_1j5n 1
97 1 2 . . . . . . . . . 91 . HN parsed_1j5n 1
98 1 1 . . . . . . . . . 87 . O parsed_1j5n 1
98 1 2 . . . . . . . . . 91 . N parsed_1j5n 1
99 1 1 . . . . . . . . . 88 . O parsed_1j5n 1
99 1 2 . . . . . . . . . 92 . HN parsed_1j5n 1
100 1 1 . . . . . . . . . 88 . O parsed_1j5n 1
100 1 2 . . . . . . . . . 92 . N parsed_1j5n 1
101 1 1 . . . . . . . . . 89 . O parsed_1j5n 1
101 1 2 . . . . . . . . . 93 . HN parsed_1j5n 1
102 1 1 . . . . . . . . . 89 . O parsed_1j5n 1
102 1 2 . . . . . . . . . 93 . N parsed_1j5n 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 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
2 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
3 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
4 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
5 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
6 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
7 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
8 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
9 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
10 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
11 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
12 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
13 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
14 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
15 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
16 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
17 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
18 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
19 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
20 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
21 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
22 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
23 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
24 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
25 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
26 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
27 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
28 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
29 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
30 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
31 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
32 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
33 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
34 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
35 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
36 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
37 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
38 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
39 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
40 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
41 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
42 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
43 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
44 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
45 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
46 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
47 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
48 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
49 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
50 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
51 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
52 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
53 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
54 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
55 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
56 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
57 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
58 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
59 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
60 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
61 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
62 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
63 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
64 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
65 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
66 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
67 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
68 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
69 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
70 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
71 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
72 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
73 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
74 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
75 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
76 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
77 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
78 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
79 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
80 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
81 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
82 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
83 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
84 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
85 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
86 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
87 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
88 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
89 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
90 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
91 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
92 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
93 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
94 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
95 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
96 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
97 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
98 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
99 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
100 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 1
101 1 . . . . . 2.00 1.70 2.20 parsed_1j5n 1
102 1 . . . . . 2.90 2.70 3.20 parsed_1j5n 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
;
Helix 1:
!assi (resid 25 and name HN) (resid 21 and name O) 2.500 0.700 0.500 !L25HN appears to be h-bonded to D77OD instead
assign (resid 21 and name O) (resid 25 and name HN) 2.00 0.30 0.20 !L25HN appears to be h-bonded to D77OD instead
assign (resid 21 and name O) (resid 25 and name N) 2.90 0.20 0.30 !L25HN appears to be h-bonded to D77OD instead
!assi (resid 26 and name HN) (resid 22 and name O) 2.500 0.700 0.500 !S26HN appears to be h-bonded to M29SD instead
assign (resid 22 and name O) (resid 26 and name HN) 2.00 0.30 0.20 !S26HN appears to be h-bonded to M29SD instead
assign (resid 22 and name O) (resid 26 and name N) 2.90 0.20 0.30 !S26HN appears to be h-bonded to M29SD instead
assi (resid 29 and name HN) (resid 26 and name O) 2.500 0.700 0.500 !M29HN appears to be h-bonded to S26CO instead of L25CO
structure calculations could not support h-bond to L25
;
2 1 10 126 parsed_1j5n 1
2
;
M29HN appears to be h-bonded to S26CO instead of L25CO
structure calculations could not support h-bond to L25
;
11 71 12 126 parsed_1j5n 1
3
;
M29HN appears to be h-bonded to S26CO instead of L25CO
structure calculations could not support h-bond to L25
assi (resid 30 and name HN) (resid 26 and name O) 2.500 0.700 0.500 !OK
;
13 71 15 74 parsed_1j5n 1
4 OK 16 71 16 74 parsed_1j5n 1
5
;
OK
assi (resid 31 and name HN) (resid 27 and name O) 2.500 0.700 0.500 !OK
;
17 71 18 74 parsed_1j5n 1
6 OK 19 71 19 74 parsed_1j5n 1
7
;
OK
assi (resid 32 and name HN) (resid 28 and name O) 2.500 0.700 0.500 !OK
;
20 71 21 74 parsed_1j5n 1
8 OK 22 71 22 74 parsed_1j5n 1
9
;
OK
assi (resid 33 and name HN) (resid 29 and name O) 2.500 0.700 0.500 !OK
;
23 71 24 74 parsed_1j5n 1
10 OK 25 71 25 74 parsed_1j5n 1
11
;
OK
assi (resid 36 and name HN) (resid 32 and name O) 2.500 0.700 0.500 !OK
;
26 71 27 74 parsed_1j5n 1
12 OK 28 71 28 74 parsed_1j5n 1
13
;
OK
assi (resid 39 and name HN) (resid 35 and name O) 2.500 0.700 0.500 !OK
;
29 71 30 74 parsed_1j5n 1
14 OK 31 71 31 74 parsed_1j5n 1
15
;
OK
assi (resid 43 and name HN) (resid 39 and name O) 2.500 0.700 0.500 !OK
;
32 71 33 74 parsed_1j5n 1
16 OK 34 71 34 74 parsed_1j5n 1
17
;
OK
Helix 2:
assi (resid 55 and name HN) (resid 51 and name O) 2.500 0.700 0.500 !OK
;
35 71 39 73 parsed_1j5n 1
18 OK 40 70 40 73 parsed_1j5n 1
19
;
OK
assi (resid 56 and name HN) (resid 52 and name O) 2.500 0.700 0.500 !OK
;
41 70 42 73 parsed_1j5n 1
20 OK 43 70 43 73 parsed_1j5n 1
21
;
OK
assi (resid 57 and name HN) (resid 53 and name O) 2.500 0.700 0.500 !may be correct, but K53 extended along DNA so few
short-range restraints
;
44 70 46 97 parsed_1j5n 1
22
;
may be correct, but K53 extended along DNA so few
short-range restraints
;
47 70 48 97 parsed_1j5n 1
23
;
may be correct, but K53 extended along DNA so few
short-range restraints
assi (resid 58 and name HN) (resid 54 and name O) 2.500 0.700 0.500 !few restraints but looks OK
;
49 70 51 98 parsed_1j5n 1
24 "few restraints but looks OK" 52 70 52 98 parsed_1j5n 1
25
;
few restraints but looks OK
assi (resid 59 and name HN) (resid 55 and name O) 2.500 0.700 0.500 !OK
;
53 70 54 73 parsed_1j5n 1
26 OK 55 70 55 73 parsed_1j5n 1
27
;
OK
assi (resid 60 and name HN) (resid 56 and name O) 2.500 0.700 0.500 !OK
;
56 70 57 73 parsed_1j5n 1
28 OK 58 70 58 73 parsed_1j5n 1
29
;
OK
assi (resid 61 and name HN) (resid 57 and name O) 2.500 0.700 0.500 !57HO or 58HO (probably 57)
;
59 70 60 97 parsed_1j5n 1
30 "57HO or 58HO (probably 57)" 61 70 61 97 parsed_1j5n 1
31
;
57HO or 58HO (probably 57)
assi (resid 62 and name HN) (resid 58 and name O) 2.500 0.700 0.500 !58HO or 59HO (probably 58)
;
62 70 63 97 parsed_1j5n 1
32 "58HO or 59HO (probably 58)" 64 70 64 97 parsed_1j5n 1
33
;
58HO or 59HO (probably 58)
Helix 3:
assi (resid 66 and name HN) (resid 63 and name O) 2.500 0.700 0.500 !removed because cannot be well fit by
structures--63 instead of 62
;
65 70 70 103 parsed_1j5n 1
34 "63HN instead of 62 or maybe 63OG?1" 71 70 71 106 parsed_1j5n 1
35
;
63HN instead of 62 or maybe 63OG?1
assi (resid 67 and name HN) (resid 63 and name O) 2.500 0.700 0.500 !63 or 64 (probably 63)
;
72 70 73 93 parsed_1j5n 1
36 "63 or 64 (probably 63)" 74 70 74 93 parsed_1j5n 1
37
;
63 or 64 (probably 63)
assi (resid 68 and name HN) (resid 64 and name O) 2.500 0.700 0.500 !64 or 65 (probably 64)
;
75 70 76 93 parsed_1j5n 1
38 "64 or 65 (probably 64)" 77 70 77 93 parsed_1j5n 1
39
;
64 or 65 (probably 64)
assi (resid 70 and name HN) (resid 66 and name O) 2.500 0.700 0.500 !66 or 67 (probably 66)
K67O added to next two restraints based on structures
;
78 70 80 56 parsed_1j5n 1
40 "66 or 67 (probably 66)" 81 97 81 120 parsed_1j5n 1
41
;
66 or 67 (probably 66)
assi (resid 71 and name HN) (resid 67 and name O) 2.500 0.700 0.500 !OK
;
82 97 83 73 parsed_1j5n 1
42 OK 84 70 84 73 parsed_1j5n 1
43
;
OK
assi (resid 73 and name HN) (resid 69 and name O) 2.500 0.700 0.500 !69 or 68 (probably 69)
;
85 70 86 93 parsed_1j5n 1
44 "69 or 68 (probably 69)" 87 70 87 93 parsed_1j5n 1
45
;
69 or 68 (probably 69)
assi (resid 74 and name HN) (resid 70 and name O) 2.500 0.700 0.500 !OK
;
88 70 89 73 parsed_1j5n 1
46 OK 90 70 90 73 parsed_1j5n 1
47
;
OK
assi (resid 75 and name HN) (resid 71 and name O) 2.500 0.700 0.500 !OK
;
91 70 92 73 parsed_1j5n 1
48 OK 93 70 93 73 parsed_1j5n 1
49
;
OK
assi (resid 76 and name HN) (resid 72 and name O) 2.500 0.700 0.500 !OK
;
94 70 95 73 parsed_1j5n 1
50 OK 96 70 96 73 parsed_1j5n 1
51
;
OK
assi (resid 77 and name HN) (resid 73 and name O) 2.500 0.700 0.500 !OK
;
97 70 98 73 parsed_1j5n 1
52 OK 99 70 99 73 parsed_1j5n 1
53
;
OK
assi (resid 78 and name HN) (resid 74 and name O) 2.500 0.700 0.500 !OK
;
100 70 101 73 parsed_1j5n 1
54 OK 102 70 102 73 parsed_1j5n 1
55
;
OK
Extra A-helix restraints (not supported by deuterium exchange experiment:
assi (resid 34 and name HN) (resid 30 and name O) 2.500 0.700 0.500 !may also be to F31HO if exists
;
103 70 108 101 parsed_1j5n 1
56 "may also be to F31HO if exists" 109 70 109 101 parsed_1j5n 1
57
;
may also be to F31HO if exists
assi (resid 35 and name HN) (resid 31 and name O) 2.500 0.700 0.500 !looks OK
;
110 70 111 79 parsed_1j5n 1
58 "looks OK" 112 70 112 79 parsed_1j5n 1
59
;
looks OK
!assi (resid 37 and name HN) (resid 33 and name O) 2.500 0.700 0.500 !few restraints--probably no h-bond
assign (resid 33 and name O) (resid 37 and name HN) 2.00 0.30 0.20 !few restraints--probably no h-bond
assign (resid 33 and name O) (resid 37 and name N) 2.90 0.20 0.30 !few restraints--probably no h-bond
assi (resid 38 and name HN) (resid 34 and name O) 2.500 0.700 0.500 !may exist but no n+3 connectivity (n+4 instead)
;
113 70 117 118 parsed_1j5n 1
60 "may exist but no n+3 connectivity (n+4 instead)" 118 70 118 118 parsed_1j5n 1
61
;
may exist but no n+3 connectivity (n+4 instead)
assi (resid 39 and name HN) (resid 35 and name O) 2.500 0.700 0.500 !looks OK
;
119 70 120 79 parsed_1j5n 1
62 "looks OK" 121 70 121 79 parsed_1j5n 1
63
;
looks OK
assi (resid 40 and name HN) (resid 36 and name O) 2.500 0.700 0.500 !looks OK
;
122 70 123 79 parsed_1j5n 1
64 "looks OK" 124 70 124 79 parsed_1j5n 1
65
;
looks OK
assi (resid 41 and name HN) (resid 37 and name O) 2.500 0.700 0.500 !looks OK
;
125 70 126 79 parsed_1j5n 1
66 "looks OK" 127 70 127 79 parsed_1j5n 1
67
;
looks OK
assi (resid 42 and name HN) (resid 38 and name O) 2.500 0.700 0.500 !looks OK
;
128 70 129 79 parsed_1j5n 1
68 "looks OK" 130 70 130 79 parsed_1j5n 1
69
;
looks OK
assi (resid 51 and name HN) (resid 47 and name O) 2.500 0.700 0.500 !looks OK
;
131 70 134 79 parsed_1j5n 1
70 "looks OK" 135 70 135 79 parsed_1j5n 1
71
;
looks OK
assi (resid 52 and name HN) (resid 48 and name O) 2.500 0.700 0.500 !looks OK
;
136 70 137 79 parsed_1j5n 1
72 "looks OK" 138 70 138 79 parsed_1j5n 1
73
;
looks OK
!assi (resid 53 and name HN) (resid 49 and name O) 2.500 0.700 0.500 !few restraints--no evidence for h-bond
assign (resid 49 and name O) (resid 53 and name HN) 2.00 0.30 0.20 !few restraints--no evidence for h-bond
assign (resid 49 and name O) (resid 53 and name N) 2.90 0.20 0.30 !few restraints--no evidence for h-bond
assi (resid 54 and name HN) (resid 50 and name O) 2.500 0.700 0.500 !50HO or 49HO (probably 50?)
;
139 70 143 98 parsed_1j5n 1
74 "50HO or 49HO (probably 50?)" 144 70 144 98 parsed_1j5n 1
75
;
50HO or 49HO (probably 50?)
assi (resid 72 and name HN) (resid 68 and name O) 2.500 0.700 0.500 !A72HN may not actually be h-bonded (to 68 or 67?)
;
145 70 148 120 parsed_1j5n 1
76 "A72HN may not actually be h-bonded (to 68 or 67?)" 149 70 149 120 parsed_1j5n 1
77
;
A72HN may not actually be h-bonded (to 68 or 67?)
assi (resid 79 and name HN) (resid 75 and name O) 2.500 0.700 0.500 !probably OK but only a few restraints
;
150 70 151 109 parsed_1j5n 1
78 "probably OK but only a few restraints" 152 71 152 109 parsed_1j5n 1
79
;
probably OK but only a few restraints
!assi (resid 80 and name HN) (resid 76 and name O) 2.500 0.700 0.500 !may be OK but more n+2 restraints than n+3
assign (resid 76 and name O) (resid 80 and name HN) 2.00 0.30 0.20 !may be OK but more n+2 restraints than n+3
assign (resid 76 and name O) (resid 80 and name N) 2.90 0.20 0.30 !may be OK but more n+2 restraints than n+3
assi (resid 81 and name HN) (resid 77 and name O) 2.500 0.700 0.500 !looks OK
;
153 71 157 80 parsed_1j5n 1
80 "looks OK" 158 71 158 80 parsed_1j5n 1
81
;
looks OK
assi (resid 82 and name HN) (resid 78 and name O) 2.500 0.700 0.500 !may be OK but as many n+2 restraints as n+3
;
159 71 160 115 parsed_1j5n 1
82 "may be OK but as many n+2 restraints as n+3" 161 71 161 115 parsed_1j5n 1
83
;
may be OK but as many n+2 restraints as n+3
assi (resid 83 and name HN) (resid 79 and name O) 2.500 0.700 0.500 !probably OK but only a few restraints.
83HN could also h-bond with R80CO
;
162 71 164 109 parsed_1j5n 1
84
;
probably OK but only a few restraints.
83HN could also h-bond with R80CO
;
165 71 166 109 parsed_1j5n 1
85
;
probably OK but only a few restraints.
83HN could also h-bond with R80CO
!assi (resid 84 and name HN) (resid 80 and name O) 2.500 0.700 0.500 !only a few restraints. could also hbond to Y81CO
assign (resid 80 and name O) (resid 84 and name HN) 2.00 0.30 0.20 !only a few restraints. could also hbond to Y81CO
assign (resid 80 and name O) (resid 84 and name N) 2.90 0.20 0.30 !only a few restraints. could also hbond to Y81CO
assi (resid 85 and name HN) (resid 81 and name O) 2.500 0.700 0.500 !looks OK
;
167 71 172 80 parsed_1j5n 1
86 "looks OK" 173 71 173 80 parsed_1j5n 1
87
;
looks OK
assi (resid 86 and name HN) (resid 82 and name O) 2.500 0.700 0.500 !looks OK
;
174 71 175 80 parsed_1j5n 1
88 "looks OK" 176 71 176 80 parsed_1j5n 1
89
;
looks OK
assi (resid 87 and name HN) (resid 83 and name O) 2.500 0.700 0.500 !may be OK but as many n+2 restraints as n+3 (6 tot)
;
177 71 178 123 parsed_1j5n 1
90 "may be OK but as many n+2 restraints as n+3 (6 tot)" 179 71 179 123 parsed_1j5n 1
91
;
may be OK but as many n+2 restraints as n+3 (6 tot)
assi (resid 88 and name HN) (resid 84 and name O) 2.500 0.700 0.500 !looks OK
;
180 71 181 80 parsed_1j5n 1
92 "looks OK" 182 71 182 80 parsed_1j5n 1
93
;
looks OK
assi (resid 89 and name HN) (resid 85 and name O) 2.500 0.700 0.500 !looks OK
;
183 71 184 80 parsed_1j5n 1
94 "looks OK" 185 71 185 80 parsed_1j5n 1
95
;
looks OK
assi (resid 90 and name HN) (resid 86 and name O) 2.500 0.700 0.500 !looks OK
;
186 71 187 80 parsed_1j5n 1
96 "looks OK" 188 71 188 80 parsed_1j5n 1
97
;
looks OK
assi (resid 91 and name HN) (resid 87 and name O) 2.500 0.700 0.500 !looks OK
;
189 71 190 80 parsed_1j5n 1
98 "looks OK" 191 71 191 80 parsed_1j5n 1
99
;
looks OK
assi (resid 92 and name HN) (resid 88 and name O) 2.500 0.700 0.500 !looks OK
;
192 71 193 80 parsed_1j5n 1
100 "looks OK" 194 71 194 80 parsed_1j5n 1
101
;
looks OK
assi (resid 93 and name HN) (resid 89 and name O) 2.500 0.700 0.500 !looks OK
;
195 71 196 80 parsed_1j5n 1
102 "looks OK" 197 71 197 80 parsed_1j5n 1
103 "looks OK" 198 71 198 80 parsed_1j5n 1
stop_
save_
Contact the webmaster for help, if required. Thursday, April 25, 2024 3:34:33 PM GMT (wattos1)