NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
532178 |
2lk3   |
17972 | cing | 2-parsed | STAR | dihedral angle | 92 |
data_2lk3_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lk3
_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_2lk3 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lk3
_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 2lk3 "Master copy" parsed_2lk3
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lk3
_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 2lk3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lk3 1
1 2lk3.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 47 parsed_2lk3 1
1 2lk3.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 92 parsed_2lk3 1
1 2lk3.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lk3 1
1 2lk3.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lk3 1
1 2lk3.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_2lk3 1
1 2lk3.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lk3 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lk3
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 1 . O5' . 1 . C5' . 1 . C4' . 1 . C3' parsed_2lk3 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 1 . C5' . 1 . C4' . 1 . C3' . 1 . O3' parsed_2lk3 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P parsed_2lk3 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 1 . C3' . 1 . O3' . 2 . P . 2 . O5' parsed_2lk3 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_2lk3 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_2lk3 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' parsed_2lk3 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 2 . C5' . 2 . C4' . 2 . C3' . 2 . O3' parsed_2lk3 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_2lk3 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' parsed_2lk3 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_2lk3 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_2lk3 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_2lk3 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 3 . C5' . 3 . C4' . 3 . C3' . 3 . O3' parsed_2lk3 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_2lk3 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_2lk3 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2lk3 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_2lk3 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' parsed_2lk3 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 7 . O5' . 7 . C5' . 7 . C4' . 7 . C3' parsed_2lk3 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 7 . C5' . 7 . C4' . 7 . C3' . 7 . O3' parsed_2lk3 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 7 . C4' . 7 . C3' . 7 . O3' . 8 . P parsed_2lk3 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 7 . C3' . 7 . O3' . 8 . P . 8 . O5' parsed_2lk3 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 7 . O3' . 8 . P . 8 . O5' . 8 . C5' parsed_2lk3 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' parsed_2lk3 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 8 . O5' . 8 . C5' . 8 . C4' . 8 . C3' parsed_2lk3 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 8 . C5' . 8 . C4' . 8 . C3' . 8 . O3' parsed_2lk3 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 8 . C4' . 8 . C3' . 8 . O3' . 9 . P parsed_2lk3 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 8 . C3' . 8 . O3' . 9 . P . 9 . O5' parsed_2lk3 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 8 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_2lk3 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 9 . P . 9 . O5' . 9 . C5' . 9 . C4' parsed_2lk3 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 9 . O5' . 9 . C5' . 9 . C4' . 9 . C3' parsed_2lk3 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 9 . C5' . 9 . C4' . 9 . C3' . 9 . O3' parsed_2lk3 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P parsed_2lk3 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 9 . C3' . 9 . O3' . 10 . P . 10 . O5' parsed_2lk3 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 9 . O3' . 10 . P . 10 . O5' . 10 . C5' parsed_2lk3 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 10 . P . 10 . O5' . 10 . C5' . 10 . C4' parsed_2lk3 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 10 . O5' . 10 . C5' . 10 . C4' . 10 . C3' parsed_2lk3 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 10 . C5' . 10 . C4' . 10 . C3' . 10 . O3' parsed_2lk3 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 10 . C4' . 10 . C3' . 10 . O3' . 11 . P parsed_2lk3 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 10 . C3' . 10 . O3' . 11 . P . 11 . O5' parsed_2lk3 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 10 . O3' . 11 . P . 11 . O5' . 11 . C5' parsed_2lk3 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_2lk3 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' parsed_2lk3 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 11 . C5' . 11 . C4' . 11 . C3' . 11 . O3' parsed_2lk3 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2lk3 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2lk3 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 16 . C5' . 16 . C4' . 16 . C3' . 16 . O3' parsed_2lk3 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2lk3 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2lk3 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2lk3 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2lk3 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2lk3 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 17 . C5' . 17 . C4' . 17 . C3' . 17 . O3' parsed_2lk3 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P parsed_2lk3 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_2lk3 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2lk3 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_2lk3 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' parsed_2lk3 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 18 . C5' . 18 . C4' . 18 . C3' . 18 . O3' parsed_2lk3 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P parsed_2lk3 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 18 . C3' . 18 . O3' . 19 . P . 19 . O5' parsed_2lk3 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 18 . O3' . 19 . P . 19 . O5' . 19 . C5' parsed_2lk3 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' parsed_2lk3 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 19 . O5' . 19 . C5' . 19 . C4' . 19 . C3' parsed_2lk3 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 19 . C5' . 19 . C4' . 19 . C3' . 19 . O3' parsed_2lk3 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 19 . C4' . 19 . C3' . 19 . O3' . 20 . P parsed_2lk3 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 19 . C3' . 19 . O3' . 20 . P . 20 . O5' parsed_2lk3 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 19 . O3' . 20 . P . 20 . O5' . 20 . C5' parsed_2lk3 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' parsed_2lk3 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 20 . O5' . 20 . C5' . 20 . C4' . 20 . C3' parsed_2lk3 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 21 . P . 21 . O5' . 21 . C5' . 21 . C4' parsed_2lk3 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 21 . O5' . 21 . C5' . 21 . C4' . 21 . C3' parsed_2lk3 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 21 . C5' . 21 . C4' . 21 . C3' . 21 . O3' parsed_2lk3 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 21 . C4' . 21 . C3' . 21 . O3' . 22 . P parsed_2lk3 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 21 . C3' . 21 . O3' . 22 . P . 22 . O5' parsed_2lk3 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 21 . O3' . 22 . P . 22 . O5' . 22 . C5' parsed_2lk3 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 22 . P . 22 . O5' . 22 . C5' . 22 . C4' parsed_2lk3 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 22 . O5' . 22 . C5' . 22 . C4' . 22 . C3' parsed_2lk3 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 22 . C5' . 22 . C4' . 22 . C3' . 22 . O3' parsed_2lk3 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 22 . C4' . 22 . C3' . 22 . O3' . 23 . P parsed_2lk3 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 22 . C3' . 22 . O3' . 23 . P . 23 . O5' parsed_2lk3 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' parsed_2lk3 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' parsed_2lk3 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' parsed_2lk3 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 23 . C5' . 23 . C4' . 23 . C3' . 23 . O3' parsed_2lk3 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166.7 -136.7 . . 23 . C4' . 23 . C3' . 23 . O3' . 24 . P parsed_2lk3 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.6 -58.6 . . 23 . C3' . 23 . O3' . 24 . P . 24 . O5' parsed_2lk3 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.1 -47.1 . . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' parsed_2lk3 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.9 -164.9 . . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' parsed_2lk3 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 32.44 62.44 . . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' parsed_2lk3 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 68.45 98.45 . . 24 . C5' . 24 . C4' . 24 . C3' . 24 . O3' parsed_2lk3 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "*backbone dihedral angles*" 1 1 1 1 parsed_2lk3 1
2 "*to constrain these regions to ideal A form RNA*" 2 1 2 1 parsed_2lk3 1
3 *gamma* 7 59 7 59 parsed_2lk3 1
4 *delta* 12 59 12 59 parsed_2lk3 1
5 *epsilon* 17 59 17 59 parsed_2lk3 1
6 *zeta* 23 59 23 59 parsed_2lk3 1
7 *alpha* 28 59 28 59 parsed_2lk3 1
8 *beta* 33 59 33 59 parsed_2lk3 1
9 *gamma* 38 59 38 59 parsed_2lk3 1
10 *delta* 43 59 43 59 parsed_2lk3 1
11 *epsilon* 48 59 48 59 parsed_2lk3 1
12 *zeta* 53 59 53 59 parsed_2lk3 1
13 *alpha* 58 59 58 59 parsed_2lk3 1
14 *beta* 63 59 63 59 parsed_2lk3 1
15 *gamma* 68 59 68 59 parsed_2lk3 1
16 *delta* 73 59 73 59 parsed_2lk3 1
17 *epsilon* 78 59 78 59 parsed_2lk3 1
18 *zeta* 83 59 83 59 parsed_2lk3 1
19 *alpha* 88 59 88 59 parsed_2lk3 1
20 *beta* 93 59 93 59 parsed_2lk3 1
21
;
assign (resi 4 and name O5' )
(resi 4 and name C5' )
(resi 4 and name C4' )
(resi 4 and name C3' ) 1.0 47.44 15.0 2 {*gamma*}
assign (resi 4 and name C5' )
(resi 4 and name C4' )
(resi 4 and name C3' )
(resi 4 and name O3' ) 1.0 83.45 15.0 2 {*delta*}
;
95 1 103 69 parsed_2lk3 1
22 "*---bulge region---*" 105 1 105 1 parsed_2lk3 1
23 "*---end bulge region---*" 107 1 107 1 parsed_2lk3 1
24 *beta* 112 59 112 59 parsed_2lk3 1
25 *gamma* 117 59 117 59 parsed_2lk3 1
26 *delta* 122 59 122 59 parsed_2lk3 1
27 *epsilon* 127 59 127 59 parsed_2lk3 1
28 *zeta* 132 59 132 59 parsed_2lk3 1
29 *alpha* 137 59 137 59 parsed_2lk3 1
30 *beta* 142 59 142 59 parsed_2lk3 1
31 *gamma* 147 59 147 59 parsed_2lk3 1
32 *delta* 152 59 152 59 parsed_2lk3 1
33 *epsilon* 157 59 157 59 parsed_2lk3 1
34 *zeta* 162 59 162 59 parsed_2lk3 1
35 *alpha* 167 59 167 59 parsed_2lk3 1
36 *beta* 172 59 172 59 parsed_2lk3 1
37 *gamma* 177 59 177 59 parsed_2lk3 1
38 *delta* 182 59 182 59 parsed_2lk3 1
39 *epsilon* 187 59 187 59 parsed_2lk3 1
40 *zeta* 192 59 192 59 parsed_2lk3 1
41 *alpha* 197 59 197 59 parsed_2lk3 1
42 *beta* 202 59 202 59 parsed_2lk3 1
43 *gamma* 207 59 207 59 parsed_2lk3 1
44 *delta* 212 59 212 59 parsed_2lk3 1
45 *epsilon* 217 59 217 59 parsed_2lk3 1
46 *zeta* 222 59 222 59 parsed_2lk3 1
47 *alpha* 227 59 227 59 parsed_2lk3 1
48 *beta* 232 59 232 59 parsed_2lk3 1
49 *gamma* 237 59 237 59 parsed_2lk3 1
50 *delta* 242 59 242 59 parsed_2lk3 1
51 "*---Loop Region---*" 244 1 244 1 parsed_2lk3 1
52 "*---End Loop Region---*" 245 1 245 1 parsed_2lk3 1
53 *beta* 250 59 250 59 parsed_2lk3 1
54 *gamma* 255 59 255 59 parsed_2lk3 1
55 *delta* 260 59 260 59 parsed_2lk3 1
56 *epsilon* 265 59 265 59 parsed_2lk3 1
57 *zeta* 270 59 270 59 parsed_2lk3 1
58 *alpha* 275 59 275 59 parsed_2lk3 1
59 *beta* 280 59 280 59 parsed_2lk3 1
60 *gamma* 285 59 285 59 parsed_2lk3 1
61 *delta* 290 59 290 59 parsed_2lk3 1
62 *epsilon* 295 59 295 59 parsed_2lk3 1
63 *zeta* 300 59 300 59 parsed_2lk3 1
64 *alpha* 305 59 305 59 parsed_2lk3 1
65 *beta* 310 59 310 59 parsed_2lk3 1
66 *gamma* 315 59 315 59 parsed_2lk3 1
67 *delta* 320 59 320 59 parsed_2lk3 1
68 *epsilon* 325 59 325 59 parsed_2lk3 1
69 *zeta* 330 59 330 59 parsed_2lk3 1
70 *alpha* 335 59 335 59 parsed_2lk3 1
71 *beta* 340 59 340 59 parsed_2lk3 1
72 *gamma* 345 59 345 59 parsed_2lk3 1
73 *delta* 350 59 350 59 parsed_2lk3 1
74 *epsilon* 355 59 355 59 parsed_2lk3 1
75 *zeta* 360 59 360 59 parsed_2lk3 1
76 *alpha* 365 59 365 59 parsed_2lk3 1
77 *beta* 370 59 370 59 parsed_2lk3 1
78 *gamma* 375 59 375 59 parsed_2lk3 1
79
;
assign (resi 20 and name C5' )
(resi 20 and name C4' )
(resi 20 and name C3' )
(resi 20 and name O3' ) 1.0 83.45 15.0 2 {*delta*}
;
377 1 380 69 parsed_2lk3 1
80 "*---bulge region---*" 382 1 382 1 parsed_2lk3 1
81 "*---end bulge region---*" 384 1 384 1 parsed_2lk3 1
82 *beta* 389 59 389 59 parsed_2lk3 1
83 *gamma* 394 59 394 59 parsed_2lk3 1
84 *delta* 399 59 399 59 parsed_2lk3 1
85 *epsilon* 404 59 404 59 parsed_2lk3 1
86 *zeta* 409 59 409 59 parsed_2lk3 1
87 *alpha* 414 59 414 59 parsed_2lk3 1
88 *beta* 419 59 419 59 parsed_2lk3 1
89 *gamma* 424 59 424 59 parsed_2lk3 1
90 *delta* 429 59 429 59 parsed_2lk3 1
91 *epsilon* 434 59 434 59 parsed_2lk3 1
92 *zeta* 439 59 439 59 parsed_2lk3 1
93 *alpha* 444 59 444 59 parsed_2lk3 1
94 *beta* 449 59 449 59 parsed_2lk3 1
95 *gamma* 454 59 454 59 parsed_2lk3 1
96 *delta* 459 59 459 59 parsed_2lk3 1
97 *epsilon* 464 59 464 59 parsed_2lk3 1
98 *zeta* 469 59 469 59 parsed_2lk3 1
99 *alpha* 474 59 474 59 parsed_2lk3 1
100 *beta* 479 59 479 59 parsed_2lk3 1
101 *gamma* 484 59 484 59 parsed_2lk3 1
102 *delta* 489 59 489 59 parsed_2lk3 1
stop_
save_
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