Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
617341 | 5nce RC | 34113 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 66 |
data_5nce_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5nce
_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_5nce 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5nce
_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 5nce "Master copy" parsed_5nce
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5nce
_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 5nce.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5nce 1
1 5nce.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 66 parsed_5nce 1
1 5nce.mr . . DYANA/DIANA 3 distance "general distance" simple 0 parsed_5nce 1
1 5nce.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_5nce 1
1 5nce.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5nce 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5nce
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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_5nce 1
2 1 . . . parsed_5nce 1
3 1 . . . parsed_5nce 1
4 1 . . . parsed_5nce 1
5 1 . . . parsed_5nce 1
6 1 . . . parsed_5nce 1
7 1 . . . parsed_5nce 1
8 1 . . . parsed_5nce 1
9 1 . . . parsed_5nce 1
10 1 . . . parsed_5nce 1
11 1 . . . parsed_5nce 1
12 1 . . . parsed_5nce 1
13 1 . . . parsed_5nce 1
14 1 . . . parsed_5nce 1
15 1 . . . parsed_5nce 1
16 1 . . . parsed_5nce 1
17 1 . . . parsed_5nce 1
18 1 . . . parsed_5nce 1
19 1 . . . parsed_5nce 1
20 1 . . . parsed_5nce 1
21 1 . . . parsed_5nce 1
22 1 . . . parsed_5nce 1
23 1 . . . parsed_5nce 1
24 1 . . . parsed_5nce 1
25 1 . . . parsed_5nce 1
26 1 . . . parsed_5nce 1
27 1 . . . parsed_5nce 1
28 1 . . . parsed_5nce 1
29 1 . . . parsed_5nce 1
30 1 . . . parsed_5nce 1
31 1 . . . parsed_5nce 1
32 1 . . . parsed_5nce 1
33 1 . . . parsed_5nce 1
34 1 . . . parsed_5nce 1
35 1 . . . parsed_5nce 1
36 1 . . . parsed_5nce 1
37 1 . . . parsed_5nce 1
38 1 . . . parsed_5nce 1
39 1 . . . parsed_5nce 1
40 1 . . . parsed_5nce 1
41 1 . . . parsed_5nce 1
42 1 . . . parsed_5nce 1
43 1 . . . parsed_5nce 1
44 1 . . . parsed_5nce 1
45 1 . . . parsed_5nce 1
46 1 . . . parsed_5nce 1
47 1 . . . parsed_5nce 1
48 1 . . . parsed_5nce 1
49 1 . . . parsed_5nce 1
50 1 . . . parsed_5nce 1
51 1 . . . parsed_5nce 1
52 1 . . . parsed_5nce 1
53 1 . . . parsed_5nce 1
54 1 . . . parsed_5nce 1
55 1 . . . parsed_5nce 1
56 1 . . . parsed_5nce 1
57 1 . . . parsed_5nce 1
58 1 . . . parsed_5nce 1
59 1 . . . parsed_5nce 1
60 1 . . . parsed_5nce 1
61 1 . . . parsed_5nce 1
62 1 . . . parsed_5nce 1
63 1 . . . parsed_5nce 1
64 1 . . . parsed_5nce 1
65 1 . . . parsed_5nce 1
66 1 . . . parsed_5nce 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 . . . . . . . . . 18 THR H parsed_5nce 1
1 1 2 . . . . . . . . . 16 ASN OD1 parsed_5nce 1
2 1 1 . . . . . . . . . 21 LYS H parsed_5nce 1
2 1 2 . . . . . . . . . 17 ASN O parsed_5nce 1
3 1 1 . . . . . . . . . 21 LYS N parsed_5nce 1
3 1 2 . . . . . . . . . 17 ASN O parsed_5nce 1
4 1 1 . . . . . . . . . 23 VAL H parsed_5nce 1
4 1 2 . . . . . . . . . 19 ASN O parsed_5nce 1
5 1 1 . . . . . . . . . 23 VAL N parsed_5nce 1
5 1 2 . . . . . . . . . 19 ASN O parsed_5nce 1
6 1 1 . . . . . . . . . 28 GLY H parsed_5nce 1
6 1 2 . . . . . . . . . 24 CYSS O parsed_5nce 1
7 1 1 . . . . . . . . . 28 GLY N parsed_5nce 1
7 1 2 . . . . . . . . . 24 CYSS O parsed_5nce 1
8 1 1 . . . . . . . . . 34 CYSS H parsed_5nce 1
8 1 2 . . . . . . . . . 17 ASN OD1 parsed_5nce 1
9 1 1 . . . . . . . . . 35 ASP H parsed_5nce 1
9 1 2 . . . . . . . . . 42 LYS O parsed_5nce 1
10 1 1 . . . . . . . . . 35 ASP N parsed_5nce 1
10 1 2 . . . . . . . . . 42 LYS O parsed_5nce 1
11 1 1 . . . . . . . . . 36 PHE H parsed_5nce 1
11 1 2 . . . . . . . . . 35 ASP OD2 parsed_5nce 1
12 1 1 . . . . . . . . . 42 LYS H parsed_5nce 1
12 1 2 . . . . . . . . . 35 ASP O parsed_5nce 1
13 1 1 . . . . . . . . . 42 LYS N parsed_5nce 1
13 1 2 . . . . . . . . . 35 ASP O parsed_5nce 1
14 1 1 . . . . . . . . . 44 TYR H parsed_5nce 1
14 1 2 . . . . . . . . . 33 SER O parsed_5nce 1
15 1 1 . . . . . . . . . 44 TYR N parsed_5nce 1
15 1 2 . . . . . . . . . 33 SER O parsed_5nce 1
16 1 1 . . . . . . . . . 49 CYSS H parsed_5nce 1
16 1 2 . . . . . . . . . 1 ARG O parsed_5nce 1
17 1 1 . . . . . . . . . 49 CYSS N parsed_5nce 1
17 1 2 . . . . . . . . . 1 ARG O parsed_5nce 1
18 1 1 . . . . . . . . . 20 CYSS O parsed_5nce 1
18 1 2 . . . . . . . . . 24 CYSS H parsed_5nce 1
19 1 1 . . . . . . . . . 20 CYSS O parsed_5nce 1
19 1 2 . . . . . . . . . 24 CYSS N parsed_5nce 1
20 1 1 . . . . . . . . . 21 LYS O parsed_5nce 1
20 1 2 . . . . . . . . . 25 ARG H parsed_5nce 1
21 1 1 . . . . . . . . . 21 LYS O parsed_5nce 1
21 1 2 . . . . . . . . . 25 ARG N parsed_5nce 1
22 1 1 . . . . . . . . . 22 ASN O parsed_5nce 1
22 1 2 . . . . . . . . . 26 THR H parsed_5nce 1
23 1 1 . . . . . . . . . 22 ASN O parsed_5nce 1
23 1 2 . . . . . . . . . 26 THR N parsed_5nce 1
24 1 1 . . . . . . . . . 23 VAL O parsed_5nce 1
24 1 2 . . . . . . . . . 27 GLU N parsed_5nce 1
25 1 1 . . . . . . . . . 24 CYSS O parsed_5nce 1
25 1 2 . . . . . . . . . 29 PHE H parsed_5nce 1
26 1 1 . . . . . . . . . 24 CYSS O parsed_5nce 1
26 1 2 . . . . . . . . . 29 PHE N parsed_5nce 1
27 1 1 . . . . . . . . . 33 SER H parsed_5nce 1
27 1 2 . . . . . . . . . 44 TYR O parsed_5nce 1
28 1 1 . . . . . . . . . 33 SER N parsed_5nce 1
28 1 2 . . . . . . . . . 44 TYR O parsed_5nce 1
29 1 1 . . . . . . . . . 5 THR O parsed_5nce 1
29 1 2 . . . . . . . . . 45 CYSS H parsed_5nce 1
30 1 1 . . . . . . . . . 5 THR O parsed_5nce 1
30 1 2 . . . . . . . . . 45 CYSS N parsed_5nce 1
31 1 1 . . . . . . . . . 31 THR O parsed_5nce 1
31 1 2 . . . . . . . . . 46 TYR H parsed_5nce 1
32 1 1 . . . . . . . . . 31 THR O parsed_5nce 1
32 1 2 . . . . . . . . . 46 TYR N parsed_5nce 1
33 1 1 . . . . . . . . . 3 CYSS O parsed_5nce 1
33 1 2 . . . . . . . . . 47 LYS N parsed_5nce 1
34 1 1 . . . . . . . . . 18 THR H parsed_5nce 1
34 1 2 . . . . . . . . . 16 ASN OD1 parsed_5nce 1
35 1 1 . . . . . . . . . 21 LYS H parsed_5nce 1
35 1 2 . . . . . . . . . 17 ASN O parsed_5nce 1
36 1 1 . . . . . . . . . 21 LYS N parsed_5nce 1
36 1 2 . . . . . . . . . 17 ASN O parsed_5nce 1
37 1 1 . . . . . . . . . 23 VAL H parsed_5nce 1
37 1 2 . . . . . . . . . 19 ASN O parsed_5nce 1
38 1 1 . . . . . . . . . 23 VAL N parsed_5nce 1
38 1 2 . . . . . . . . . 19 ASN O parsed_5nce 1
39 1 1 . . . . . . . . . 28 GLY H parsed_5nce 1
39 1 2 . . . . . . . . . 24 CYSS O parsed_5nce 1
40 1 1 . . . . . . . . . 28 GLY N parsed_5nce 1
40 1 2 . . . . . . . . . 24 CYSS O parsed_5nce 1
41 1 1 . . . . . . . . . 34 CYSS H parsed_5nce 1
41 1 2 . . . . . . . . . 17 ASN OD1 parsed_5nce 1
42 1 1 . . . . . . . . . 35 ASP H parsed_5nce 1
42 1 2 . . . . . . . . . 42 LYS O parsed_5nce 1
43 1 1 . . . . . . . . . 35 ASP N parsed_5nce 1
43 1 2 . . . . . . . . . 42 LYS O parsed_5nce 1
44 1 1 . . . . . . . . . 36 PHE H parsed_5nce 1
44 1 2 . . . . . . . . . 35 ASP OD2 parsed_5nce 1
45 1 1 . . . . . . . . . 42 LYS H parsed_5nce 1
45 1 2 . . . . . . . . . 35 ASP O parsed_5nce 1
46 1 1 . . . . . . . . . 42 LYS N parsed_5nce 1
46 1 2 . . . . . . . . . 35 ASP O parsed_5nce 1
47 1 1 . . . . . . . . . 44 TYR H parsed_5nce 1
47 1 2 . . . . . . . . . 33 SER O parsed_5nce 1
48 1 1 . . . . . . . . . 44 TYR N parsed_5nce 1
48 1 2 . . . . . . . . . 33 SER O parsed_5nce 1
49 1 1 . . . . . . . . . 49 CYSS H parsed_5nce 1
49 1 2 . . . . . . . . . 1 ARG O parsed_5nce 1
50 1 1 . . . . . . . . . 49 CYSS N parsed_5nce 1
50 1 2 . . . . . . . . . 1 ARG O parsed_5nce 1
51 1 1 . . . . . . . . . 20 CYSS O parsed_5nce 1
51 1 2 . . . . . . . . . 24 CYSS H parsed_5nce 1
52 1 1 . . . . . . . . . 20 CYSS O parsed_5nce 1
52 1 2 . . . . . . . . . 24 CYSS N parsed_5nce 1
53 1 1 . . . . . . . . . 21 LYS O parsed_5nce 1
53 1 2 . . . . . . . . . 25 ARG H parsed_5nce 1
54 1 1 . . . . . . . . . 21 LYS O parsed_5nce 1
54 1 2 . . . . . . . . . 25 ARG N parsed_5nce 1
55 1 1 . . . . . . . . . 22 ASN O parsed_5nce 1
55 1 2 . . . . . . . . . 26 THR H parsed_5nce 1
56 1 1 . . . . . . . . . 22 ASN O parsed_5nce 1
56 1 2 . . . . . . . . . 26 THR N parsed_5nce 1
57 1 1 . . . . . . . . . 23 VAL O parsed_5nce 1
57 1 2 . . . . . . . . . 27 GLU N parsed_5nce 1
58 1 1 . . . . . . . . . 24 CYSS O parsed_5nce 1
58 1 2 . . . . . . . . . 29 PHE H parsed_5nce 1
59 1 1 . . . . . . . . . 24 CYSS O parsed_5nce 1
59 1 2 . . . . . . . . . 29 PHE N parsed_5nce 1
60 1 1 . . . . . . . . . 33 SER H parsed_5nce 1
60 1 2 . . . . . . . . . 44 TYR O parsed_5nce 1
61 1 1 . . . . . . . . . 33 SER N parsed_5nce 1
61 1 2 . . . . . . . . . 44 TYR O parsed_5nce 1
62 1 1 . . . . . . . . . 5 THR O parsed_5nce 1
62 1 2 . . . . . . . . . 45 CYSS H parsed_5nce 1
63 1 1 . . . . . . . . . 5 THR O parsed_5nce 1
63 1 2 . . . . . . . . . 45 CYSS N parsed_5nce 1
64 1 1 . . . . . . . . . 31 THR O parsed_5nce 1
64 1 2 . . . . . . . . . 46 TYR H parsed_5nce 1
65 1 1 . . . . . . . . . 31 THR O parsed_5nce 1
65 1 2 . . . . . . . . . 46 TYR N parsed_5nce 1
66 1 1 . . . . . . . . . 3 CYSS O parsed_5nce 1
66 1 2 . . . . . . . . . 47 LYS N parsed_5nce 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 . . . . . . . 1.80 parsed_5nce 1
2 1 . . . . . . . 1.80 parsed_5nce 1
3 1 . . . . . . . 2.70 parsed_5nce 1
4 1 . . . . . . . 1.80 parsed_5nce 1
5 1 . . . . . . . 2.70 parsed_5nce 1
6 1 . . . . . . . 1.80 parsed_5nce 1
7 1 . . . . . . . 2.70 parsed_5nce 1
8 1 . . . . . . . 1.80 parsed_5nce 1
9 1 . . . . . . . 1.80 parsed_5nce 1
10 1 . . . . . . . 2.70 parsed_5nce 1
11 1 . . . . . . . 1.80 parsed_5nce 1
12 1 . . . . . . . 1.80 parsed_5nce 1
13 1 . . . . . . . 2.70 parsed_5nce 1
14 1 . . . . . . . 1.80 parsed_5nce 1
15 1 . . . . . . . 2.70 parsed_5nce 1
16 1 . . . . . . . 1.80 parsed_5nce 1
17 1 . . . . . . . 2.70 parsed_5nce 1
18 1 . . . . . . . 1.80 parsed_5nce 1
19 1 . . . . . . . 2.70 parsed_5nce 1
20 1 . . . . . . . 1.80 parsed_5nce 1
21 1 . . . . . . . 2.70 parsed_5nce 1
22 1 . . . . . . . 1.80 parsed_5nce 1
23 1 . . . . . . . 2.70 parsed_5nce 1
24 1 . . . . . . . 2.70 parsed_5nce 1
25 1 . . . . . . . 1.80 parsed_5nce 1
26 1 . . . . . . . 2.70 parsed_5nce 1
27 1 . . . . . . . 1.80 parsed_5nce 1
28 1 . . . . . . . 2.70 parsed_5nce 1
29 1 . . . . . . . 1.80 parsed_5nce 1
30 1 . . . . . . . 2.70 parsed_5nce 1
31 1 . . . . . . . 1.80 parsed_5nce 1
32 1 . . . . . . . 2.70 parsed_5nce 1
33 1 . . . . . . . 2.70 parsed_5nce 1
34 1 . . . . . . . 3.00 parsed_5nce 1
35 1 . . . . . . . 2.00 parsed_5nce 1
36 1 . . . . . . . 3.00 parsed_5nce 1
37 1 . . . . . . . 2.00 parsed_5nce 1
38 1 . . . . . . . 3.00 parsed_5nce 1
39 1 . . . . . . . 2.00 parsed_5nce 1
40 1 . . . . . . . 3.00 parsed_5nce 1
41 1 . . . . . . . 3.00 parsed_5nce 1
42 1 . . . . . . . 2.00 parsed_5nce 1
43 1 . . . . . . . 3.00 parsed_5nce 1
44 1 . . . . . . . 3.00 parsed_5nce 1
45 1 . . . . . . . 2.00 parsed_5nce 1
46 1 . . . . . . . 3.00 parsed_5nce 1
47 1 . . . . . . . 2.00 parsed_5nce 1
48 1 . . . . . . . 3.00 parsed_5nce 1
49 1 . . . . . . . 2.00 parsed_5nce 1
50 1 . . . . . . . 3.00 parsed_5nce 1
51 1 . . . . . . . 2.00 parsed_5nce 1
52 1 . . . . . . . 3.00 parsed_5nce 1
53 1 . . . . . . . 2.00 parsed_5nce 1
54 1 . . . . . . . 3.00 parsed_5nce 1
55 1 . . . . . . . 2.00 parsed_5nce 1
56 1 . . . . . . . 3.00 parsed_5nce 1
57 1 . . . . . . . 3.00 parsed_5nce 1
58 1 . . . . . . . 2.00 parsed_5nce 1
59 1 . . . . . . . 3.00 parsed_5nce 1
60 1 . . . . . . . 2.00 parsed_5nce 1
61 1 . . . . . . . 3.00 parsed_5nce 1
62 1 . . . . . . . 2.00 parsed_5nce 1
63 1 . . . . . . . 3.00 parsed_5nce 1
64 1 . . . . . . . 2.00 parsed_5nce 1
65 1 . . . . . . . 3.00 parsed_5nce 1
66 1 . . . . . . . 3.00 parsed_5nce 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 "Restraints file 1: hbonds.lol" 1 1 1 31 parsed_5nce 1
2 "3 CYSS H 47 LYS O 1.80" 2 1 2 37 parsed_5nce 1
3 "3 CYSS N 47 LYS O 2.70" 3 1 3 37 parsed_5nce 1
4 "5 THR H 45 CYSS O 1.80" 4 1 4 37 parsed_5nce 1
5 "5 THR N 45 CYSS O 2.70" 5 1 5 37 parsed_5nce 1
6 "7 SER H 43 CYSS O 1.80" 6 1 6 37 parsed_5nce 1
7 "7 SER N 43 CYSS O 2.70" 7 1 7 37 parsed_5nce 1
8 "9 LYS H 7 SER OG 1.80" 8 1 8 37 parsed_5nce 1
9 "10 PHE H 7 SER OG 1.80" 9 1 9 37 parsed_5nce 1
10 "20 CYSS H 16 ASN O 1.80" 13 1 13 37 parsed_5nce 1
11 "20 CYSS N 16 ASN O 2.70" 14 1 14 37 parsed_5nce 1
12 "22 ASN H 18 THR O 1.80" 17 1 17 37 parsed_5nce 1
13 "22 ASN N 18 THR O 2.70" 18 1 18 37 parsed_5nce 1
14 "24 CYSS H 20 CYSS O 1.80" 21 1 21 37 parsed_5nce 1
15 "input H-bond manualy for G40-C14" 29 1 29 34 parsed_5nce 1
16 "23 VAL O 27 GLU H 1.80" 43 1 43 38 parsed_5nce 1
17 "31 THR H 46 TYR O 1.80" 47 1 47 38 parsed_5nce 1
18 "31 THR N 46 TYR O 2.70" 48 1 48 38 parsed_5nce 1
19 "3 CYSS O 47 LYS H 1.80" 55 1 55 38 parsed_5nce 1
20 "Restraints file 2: hbonds.upl" 57 1 57 31 parsed_5nce 1
21 "3 CYSS H 47 LYS O 2.00" 58 1 58 37 parsed_5nce 1
22 "3 CYSS N 47 LYS O 3.00" 59 1 59 37 parsed_5nce 1
23 "5 THR H 45 CYSS O 2.00" 60 1 60 37 parsed_5nce 1
24 "5 THR N 45 CYSS O 3.00" 61 1 61 37 parsed_5nce 1
25 "7 SER H 43 CYSS O 2.00" 62 1 62 37 parsed_5nce 1
26 "7 SER N 43 CYSS O 3.00" 63 1 63 37 parsed_5nce 1
27 "9 LYS H 7 SER OG 2.00" 64 1 64 37 parsed_5nce 1
28 "10 PHE H 7 SER OG 2.00" 65 1 65 37 parsed_5nce 1
29 "20 CYSS H 16 ASN O 2.00" 69 1 69 37 parsed_5nce 1
30 "20 CYSS N 16 ASN O 3.00" 70 1 70 37 parsed_5nce 1
31 "22 ASN H 18 THR O 2.00" 73 1 73 37 parsed_5nce 1
32 "22 ASN N 18 THR O 3.00" 74 1 74 37 parsed_5nce 1
33 "24 CYSS H 20 CYSS O 2.60" 77 1 77 37 parsed_5nce 1
34 "input H-bond manualy for G40-C14" 85 1 85 34 parsed_5nce 1
35 "23 VAL O 27 GLU H 2.00" 99 1 99 38 parsed_5nce 1
36 "31 THR H 46 TYR O 2.00" 103 1 103 38 parsed_5nce 1
37 "31 THR N 46 TYR O 3.00" 104 1 104 38 parsed_5nce 1
38 "3 CYSS O 47 LYS H 2.00" 111 1 111 38 parsed_5nce 1
stop_
save_