NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
590218 |
2n0r   |
25534 | cing | 2-parsed | STAR | dihedral angle | 174 |
data_2n0r_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n0r
_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_2n0r 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n0r
_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 2n0r "Master copy" parsed_2n0r
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n0r
_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 2n0r.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n0r 1
1 2n0r.mr . . XPLOR/CNS 2 distance NOE simple 212 parsed_2n0r 1
1 2n0r.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 174 parsed_2n0r 1
1 2n0r.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_2n0r 1
1 2n0r.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n0r 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2n0r
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_2n0r 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_2n0r 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_2n0r 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' parsed_2n0r 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_2n0r 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_2n0r 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_2n0r 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_2n0r 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_2n0r 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2n0r 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_2n0r 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 4 . C4' . 4 . C3' . 4 . O3' . 5 . P parsed_2n0r 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 4 . C3' . 4 . O3' . 5 . P . 5 . O5' parsed_2n0r 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' parsed_2n0r 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 4 . O3' . 5 . P . 5 . O5' . 5 . C5' parsed_2n0r 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' parsed_2n0r 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 5 . C4' . 5 . C3' . 5 . O3' . 6 . P parsed_2n0r 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 5 . C3' . 5 . O3' . 6 . P . 6 . O5' parsed_2n0r 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_2n0r 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' parsed_2n0r 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 6 . C4' . 6 . C3' . 6 . O3' . 7 . P parsed_2n0r 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 6 . C3' . 6 . O3' . 7 . P . 7 . O5' parsed_2n0r 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 6 . O3' . 7 . P . 7 . O5' . 7 . C5' parsed_2n0r 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' parsed_2n0r 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 7 . O5' . 7 . C5' . 7 . C4' . 7 . C3' parsed_2n0r 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 7 . C4' . 7 . C3' . 7 . O3' . 8 . P parsed_2n0r 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 7 . C3' . 7 . O3' . 8 . P . 8 . O5' parsed_2n0r 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 7 . O3' . 8 . P . 8 . O5' . 8 . C5' parsed_2n0r 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' parsed_2n0r 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 8 . O5' . 8 . C5' . 8 . C4' . 8 . C3' parsed_2n0r 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 8 . C4' . 8 . C3' . 8 . O3' . 9 . P parsed_2n0r 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 8 . C3' . 8 . O3' . 9 . P . 9 . O5' parsed_2n0r 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 8 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_2n0r 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 9 . P . 9 . O5' . 9 . C5' . 9 . C4' parsed_2n0r 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 9 . O5' . 9 . C5' . 9 . C4' . 9 . C3' parsed_2n0r 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P parsed_2n0r 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 9 . C3' . 9 . O3' . 10 . P . 10 . O5' parsed_2n0r 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 9 . O3' . 10 . P . 10 . O5' . 10 . C5' parsed_2n0r 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 10 . P . 10 . O5' . 10 . C5' . 10 . C4' parsed_2n0r 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 10 . C4' . 10 . C3' . 10 . O3' . 11 . P parsed_2n0r 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 10 . C3' . 10 . O3' . 11 . P . 11 . O5' parsed_2n0r 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_2n0r 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2n0r 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2n0r 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_2n0r 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 14 . C3' . 14 . O3' . 15 . P . 15 . O5' parsed_2n0r 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 14 . O3' . 15 . P . 15 . O5' . 15 . C5' parsed_2n0r 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_2n0r 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' parsed_2n0r 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P parsed_2n0r 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 600.0 . . 15 . C3' . 15 . O3' . 16 . P . 16 . O5' parsed_2n0r 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_2n0r 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_2n0r 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_2n0r 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -105.0 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2n0r 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2n0r 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2n0r 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2n0r 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2n0r 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P parsed_2n0r 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_2n0r 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2n0r 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_2n0r 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P parsed_2n0r 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 18 . C3' . 18 . O3' . 19 . P . 19 . O5' parsed_2n0r 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 18 . O3' . 19 . P . 19 . O5' . 19 . C5' parsed_2n0r 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' parsed_2n0r 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 19 . C4' . 19 . C3' . 19 . O3' . 20 . P parsed_2n0r 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 19 . C3' . 19 . O3' . 20 . P . 20 . O5' parsed_2n0r 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 19 . O3' . 20 . P . 20 . O5' . 20 . C5' parsed_2n0r 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' parsed_2n0r 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 20 . C4' . 20 . C3' . 20 . O3' . 21 . P parsed_2n0r 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 20 . C3' . 20 . O3' . 21 . P . 21 . O5' parsed_2n0r 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 20 . O3' . 21 . P . 21 . O5' . 21 . C5' parsed_2n0r 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 21 . P . 21 . O5' . 21 . C5' . 21 . C4' parsed_2n0r 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 21 . C4' . 21 . C3' . 21 . O3' . 22 . P parsed_2n0r 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 21 . C3' . 21 . O3' . 22 . P . 22 . O5' parsed_2n0r 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 21 . O3' . 22 . P . 22 . O5' . 22 . C5' parsed_2n0r 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 22 . P . 22 . O5' . 22 . C5' . 22 . C4' parsed_2n0r 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 22 . C4' . 22 . C3' . 22 . O3' . 23 . P parsed_2n0r 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 22 . C3' . 22 . O3' . 23 . P . 23 . O5' parsed_2n0r 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 22 . O5' . 22 . C5' . 22 . C4' . 22 . C3' parsed_2n0r 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' parsed_2n0r 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.0 290.0 . . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' parsed_2n0r 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 23 . C4' . 23 . C3' . 23 . O3' . 24 . P parsed_2n0r 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 23 . C3' . 23 . O3' . 24 . P . 24 . O5' parsed_2n0r 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' parsed_2n0r 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 270.0 330.0 . . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' parsed_2n0r 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' parsed_2n0r 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15.0 95.0 . . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' parsed_2n0r 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -50.0 . . 24 . C4' . 24 . C3' . 24 . O3' . 25 . P parsed_2n0r 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 330.0 . . 24 . C3' . 24 . O3' . 25 . P . 25 . O5' parsed_2n0r 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 3 . H1' . 3 . C1' . 3 . C2' . 3 . H2' parsed_2n0r 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 3 . H2' . 3 . C2' . 3 . C3' . 3 . H3' parsed_2n0r 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 3 . C5' . 3 . C4' . 3 . C3' . 3 . O3' parsed_2n0r 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 7 . H1' . 7 . C1' . 7 . C2' . 7 . H2' parsed_2n0r 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 7 . H2' . 7 . C2' . 7 . C3' . 7 . H3' parsed_2n0r 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 7 . C5' . 7 . C4' . 7 . C3' . 7 . O3' parsed_2n0r 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 8 . H1' . 8 . C1' . 8 . C2' . 8 . H2' parsed_2n0r 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 8 . H2' . 8 . C2' . 8 . C3' . 8 . H3' parsed_2n0r 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 8 . C5' . 8 . C4' . 8 . C3' . 8 . O3' parsed_2n0r 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 9 . H1' . 9 . C1' . 9 . C2' . 9 . H2' parsed_2n0r 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 9 . H2' . 9 . C2' . 9 . C3' . 9 . H3' parsed_2n0r 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 9 . C5' . 9 . C4' . 9 . C3' . 9 . O3' parsed_2n0r 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 10 . H1' . 10 . C1' . 10 . C2' . 10 . H2' parsed_2n0r 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 10 . H2' . 10 . C2' . 10 . C3' . 10 . H3' parsed_2n0r 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 10 . C5' . 10 . C4' . 10 . C3' . 10 . O3' parsed_2n0r 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 14 . H1' . 14 . C1' . 14 . C2' . 14 . H2' parsed_2n0r 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 14 . H2' . 14 . C2' . 14 . C3' . 14 . H3' parsed_2n0r 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 14 . C5' . 14 . C4' . 14 . C3' . 14 . O3' parsed_2n0r 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 15 . H1' . 15 . C1' . 15 . C2' . 15 . H2' parsed_2n0r 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 15 . H2' . 15 . C2' . 15 . C3' . 15 . H3' parsed_2n0r 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 15 . C5' . 15 . C4' . 15 . C3' . 15 . O3' parsed_2n0r 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 16 . H1' . 16 . C1' . 16 . C2' . 16 . H2' parsed_2n0r 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 16 . H2' . 16 . C2' . 16 . C3' . 16 . H3' parsed_2n0r 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 16 . C5' . 16 . C4' . 16 . C3' . 16 . O3' parsed_2n0r 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 17 . H1' . 17 . C1' . 17 . C2' . 17 . H2' parsed_2n0r 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 17 . H2' . 17 . C2' . 17 . C3' . 17 . H3' parsed_2n0r 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 17 . C5' . 17 . C4' . 17 . C3' . 17 . O3' parsed_2n0r 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 18 . H1' . 18 . C1' . 18 . C2' . 18 . H2' parsed_2n0r 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 18 . H2' . 18 . C2' . 18 . C3' . 18 . H3' parsed_2n0r 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 18 . C5' . 18 . C4' . 18 . C3' . 18 . O3' parsed_2n0r 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 22 . H1' . 22 . C1' . 22 . C2' . 22 . H2' parsed_2n0r 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 22 . H2' . 22 . C2' . 22 . C3' . 22 . H3' parsed_2n0r 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 22 . C5' . 22 . C4' . 22 . C3' . 22 . O3' parsed_2n0r 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 23 . H1' . 23 . C1' . 23 . C2' . 23 . H2' parsed_2n0r 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 23 . H2' . 23 . C2' . 23 . C3' . 23 . H3' parsed_2n0r 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 23 . C5' . 23 . C4' . 23 . C3' . 23 . O3' parsed_2n0r 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.0 119.0 . . 24 . H1' . 24 . C1' . 24 . C2' . 24 . H2' parsed_2n0r 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18.0 58.0 . . 24 . H2' . 24 . C2' . 24 . C3' . 24 . H3' parsed_2n0r 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 52.0 112.0 . . 24 . C5' . 24 . C4' . 24 . C3' . 24 . O3' parsed_2n0r 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 180.0 . . 4 . H1' . 4 . C1' . 4 . C2' . 4 . H2' parsed_2n0r 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 4 . H2' . 4 . C2' . 4 . C3' . 4 . H3' parsed_2n0r 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 4 . C5' . 4 . C4' . 4 . C3' . 4 . O3' parsed_2n0r 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 180.0 . . 5 . H1' . 5 . C1' . 5 . C2' . 5 . H2' parsed_2n0r 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 5 . H2' . 5 . C2' . 5 . C3' . 5 . H3' parsed_2n0r 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 5 . C5' . 5 . C4' . 5 . C3' . 5 . O3' parsed_2n0r 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 180.0 . . 19 . H1' . 19 . C1' . 19 . C2' . 19 . H2' parsed_2n0r 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 19 . H2' . 19 . C2' . 19 . C3' . 19 . H3' parsed_2n0r 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 19 . C5' . 19 . C4' . 19 . C3' . 19 . O3' parsed_2n0r 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 180.0 . . 20 . H1' . 20 . C1' . 20 . C2' . 20 . H2' parsed_2n0r 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 20 . H2' . 20 . C2' . 20 . C3' . 20 . H3' parsed_2n0r 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 20 . C5' . 20 . C4' . 20 . C3' . 20 . O3' parsed_2n0r 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 180.0 . . 21 . H1' . 21 . C1' . 21 . C2' . 21 . H2' parsed_2n0r 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 -5.0 . . 21 . H2' . 21 . C2' . 21 . C3' . 21 . H3' parsed_2n0r 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 190.0 . . 21 . C5' . 21 . C4' . 21 . C3' . 21 . O3' parsed_2n0r 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_2n0r 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_2n0r 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_2n0r 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 5 . C3' . 5 . O3' . 6 . P . 6 . O5' parsed_2n0r 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2n0r 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_2n0r 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 19 . O3' . 20 . P . 20 . O5' . 20 . C5' parsed_2n0r 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 19 . C3' . 19 . O3' . 20 . P . 20 . O5' parsed_2n0r 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 20 . O3' . 21 . P . 21 . O5' . 21 . C5' parsed_2n0r 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 120.0 . . 20 . C3' . 20 . O3' . 21 . P . 21 . O5' parsed_2n0r 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 3 . O4' . 3 . C1' . 3 . N1 . 3 . C2 parsed_2n0r 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 4 . O4' . 4 . C1' . 4 . N9 . 4 . C4 parsed_2n0r 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 5 . O4' . 5 . C1' . 5 . N9 . 5 . C4 parsed_2n0r 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 6 . O4' . 6 . C1' . 5 . N9 . 6 . C4 parsed_2n0r 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 7 . O4' . 7 . C1' . 7 . N1 . 7 . C2 parsed_2n0r 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 8 . O4' . 8 . C1' . 8 . N1 . 8 . C2 parsed_2n0r 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 9 . O4' . 9 . C1' . 9 . N1 . 9 . C2 parsed_2n0r 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 10 . O4' . 10 . C1' . 10 . N9 . 10 . C4 parsed_2n0r 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 15 . O4' . 15 . C1' . 15 . N9 . 15 . C4 parsed_2n0r 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 16 . O4' . 16 . C1' . 16 . N9 . 16 . C4 parsed_2n0r 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 17 . O4' . 17 . C1' . 17 . N1 . 17 . C2 parsed_2n0r 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 18 . O4' . 18 . C1' . 18 . N9 . 18 . C4 parsed_2n0r 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 120.0 . . 19 . O4' . 19 . C1' . 19 . N9 . 19 . C4 parsed_2n0r 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 20 . O4' . 20 . C1' . 20 . N1 . 20 . C2 parsed_2n0r 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 21 . O4' . 21 . C1' . 21 . N9 . 21 . C4 parsed_2n0r 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 22 . O4' . 22 . C1' . 22 . N9 . 22 . C4 parsed_2n0r 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 23 . O4' . 23 . C1' . 23 . N1 . 23 . C2 parsed_2n0r 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.0 290.0 . . 24 . O4' . 24 . C1' . 24 . N9 . 24 . C4 parsed_2n0r 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 "[c2] alpha" 2 90 2 104 parsed_2n0r 1
2 "[c2] beta" 4 90 4 103 parsed_2n0r 1
3 "[c2] epsilon" 6 89 6 103 parsed_2n0r 1
4 "[c2] zeta" 8 89 8 100 parsed_2n0r 1
5 "[u3] alpha" 11 90 11 104 parsed_2n0r 1
6 "[u3] beta" 13 90 13 104 parsed_2n0r 1
7 "[u3] epsilon" 15 89 15 103 parsed_2n0r 1
8 "[u3] zeta" 17 90 17 104 parsed_2n0r 1
9 "[u3] gamma" 20 89 20 102 parsed_2n0r 1
10 "[g4] alpha" 25 90 25 105 parsed_2n0r 1
11 "[g4] beta" 27 90 27 104 parsed_2n0r 1
12 "[g4] epsilon" 29 89 29 103 parsed_2n0r 1
13 "[g4] zeta" 31 90 31 102 parsed_2n0r 1
14 "[g4] gamma" 35 89 35 102 parsed_2n0r 1
15 "[a5] alpha" 40 90 40 109 parsed_2n0r 1
16 "[a5] beta" 42 90 42 106 parsed_2n0r 1
17 "[a5] epsilon" 44 89 44 103 parsed_2n0r 1
18 "[a5] zeta" 46 90 46 108 parsed_2n0r 1
19 "[g6] alpha" 50 90 50 108 parsed_2n0r 1
20 "[g6] beta" 52 90 52 106 parsed_2n0r 1
21 [g6] 54 89 54 96 parsed_2n0r 1
22 [g6] 56 89 56 96 parsed_2n0r 1
23 "[c7] alpha" 60 89 60 103 parsed_2n0r 1
24 "[c7] beta" 62 89 62 100 parsed_2n0r 1
25 "[c7] gamma" 64 89 64 101 parsed_2n0r 1
26 "[c7] epsilon" 66 89 66 103 parsed_2n0r 1
27 "[c7] zeta" 68 89 68 100 parsed_2n0r 1
28 "[u8] alpha" 72 89 72 102 parsed_2n0r 1
29 "[u8] beta" 74 89 74 100 parsed_2n0r 1
30 "[u8] gamma" 76 89 76 101 parsed_2n0r 1
31 "[u8] epsilon" 78 89 78 102 parsed_2n0r 1
32 "[u8] zeta" 80 89 80 100 parsed_2n0r 1
33 "[c9] alpha" 84 89 84 103 parsed_2n0r 1
34 "[c9] beta" 86 89 86 100 parsed_2n0r 1
35 "[c9] gamma" 88 89 88 101 parsed_2n0r 1
36 "[c9] epsilon" 90 90 90 103 parsed_2n0r 1
37 "[c9] zeta" 92 91 92 102 parsed_2n0r 1
38 "[g10] alpha" 95 92 95 107 parsed_2n0r 1
39 "[g10] beta" 97 92 97 104 parsed_2n0r 1
40 "[g10] epsilon" 99 91 99 105 parsed_2n0r 1
41 "[g10] zeta" 101 92 101 104 parsed_2n0r 1
42 "[g14] alpha" 105 91 105 105 parsed_2n0r 1
43 "[g14] beta" 107 91 107 103 parsed_2n0r 1
44 "[g14] gamma" 109 91 109 104 parsed_2n0r 1
45 "[g14] epsilon" 111 91 111 105 parsed_2n0r 1
46 "[g14] zeta" 113 91 113 103 parsed_2n0r 1
47 "[a15] alpha" 117 91 117 104 parsed_2n0r 1
48 "[a15] beta" 119 91 119 103 parsed_2n0r 1
49 "[a15] gamma" 121 91 121 104 parsed_2n0r 1
50 "[a15] epsilon" 123 91 123 105 parsed_2n0r 1
51 "[a15] zeta" 125 92 125 104 parsed_2n0r 1
52 "[g16] alpha" 129 91 129 105 parsed_2n0r 1
53 "[g16] beta" 131 91 131 103 parsed_2n0r 1
54 "[g16] gamma" 133 91 133 104 parsed_2n0r 1
55 "[g16] epsilon" 135 91 135 105 parsed_2n0r 1
56 "[g16] zeta" 137 91 137 103 parsed_2n0r 1
57 "[c17] alpha" 141 91 141 106 parsed_2n0r 1
58 "[c17] beta" 143 91 143 103 parsed_2n0r 1
59 "[c17] gamma" 145 91 145 104 parsed_2n0r 1
60 "[c17] epsilon" 147 91 147 106 parsed_2n0r 1
61 "[c17] zeta" 149 92 149 106 parsed_2n0r 1
62 "[a18] alpha" 153 91 153 105 parsed_2n0r 1
63 "[a18] beta" 155 92 155 104 parsed_2n0r 1
64 "[a18] epsilon" 157 91 157 105 parsed_2n0r 1
65 "[a18] zeta" 159 92 159 104 parsed_2n0r 1
66 "[a19] alpha" 162 93 162 107 parsed_2n0r 1
67 "[a19] beta" 164 93 164 105 parsed_2n0r 1
68 "[a19] epsilon" 166 91 166 105 parsed_2n0r 1
69 "[a19] zeta" 168 92 168 104 parsed_2n0r 1
70 [u20] 172 93 172 101 parsed_2n0r 1
71 "[u20] beta" 174 93 174 105 parsed_2n0r 1
72 "[u20] epsilon" 176 92 176 106 parsed_2n0r 1
73 "[u20] zeta" 178 93 178 105 parsed_2n0r 1
74 [g21] 181 93 181 101 parsed_2n0r 1
75 "[g21] beta" 183 93 183 105 parsed_2n0r 1
76 "[g21] epsilon" 185 91 185 105 parsed_2n0r 1
77 "[g21] zeta" 187 93 187 105 parsed_2n0r 1
78 "[a22] alpha" 191 92 191 107 parsed_2n0r 1
79 "[a22] beta" 193 92 193 104 parsed_2n0r 1
80 "[a22] epsilon" 195 91 195 105 parsed_2n0r 1
81 "[a22] zeta" 197 92 197 104 parsed_2n0r 1
82 "[a22] gamma" 200 91 200 104 parsed_2n0r 1
83 "[u23] alpha" 205 92 205 108 parsed_2n0r 1
84 "[u23] beta" 207 92 207 104 parsed_2n0r 1
85 "[u23] epsilon" 209 91 209 105 parsed_2n0r 1
86 "[u23] zeta" 211 92 211 108 parsed_2n0r 1
87 "[u23] gamma" 214 91 214 105 parsed_2n0r 1
88 "[g24] alpha" 218 91 218 107 parsed_2n0r 1
89 "[g24] beta" 220 91 220 103 parsed_2n0r 1
90 "[g24] gamma" 222 91 222 104 parsed_2n0r 1
91 "[g24] epsilon" 224 91 224 106 parsed_2n0r 1
92 "[g24] zeta" 226 92 226 106 parsed_2n0r 1
93 "[u3] N/C3' endo" 232 89 232 108 parsed_2n0r 1
94 "[u3] N delta" 234 89 234 108 parsed_2n0r 1
95 "[c7] N/C3' endo" 240 89 240 106 parsed_2n0r 1
96 "[c7] N delta" 242 89 242 103 parsed_2n0r 1
97 "[u8] N/C3' endo" 247 89 247 107 parsed_2n0r 1
98 "[u8] N delta" 249 89 249 103 parsed_2n0r 1
99 "[c9] N/C3' endo" 254 89 254 106 parsed_2n0r 1
100 "[c9] N delta" 256 89 256 103 parsed_2n0r 1
101 "[g10] N/C3' endo" 261 91 261 109 parsed_2n0r 1
102 "[g10] N delta" 263 91 263 106 parsed_2n0r 1
103 "[g14] N/C3' endo" 268 91 268 109 parsed_2n0r 1
104 "[g14] N delta" 270 91 270 106 parsed_2n0r 1
105 "[a15] N/C3' endo" 275 91 275 109 parsed_2n0r 1
106 "[a15] N delta" 277 91 277 106 parsed_2n0r 1
107 "[g16] N/C3' endo" 283 91 283 109 parsed_2n0r 1
108 "[g16] N delta" 285 91 285 106 parsed_2n0r 1
109 "[c17] N/C3' endo" 290 91 290 109 parsed_2n0r 1
110 "[c17] N delta" 292 91 292 106 parsed_2n0r 1
111 "[a18] N/C3' endo" 298 91 298 109 parsed_2n0r 1
112 "[a18] N delta" 300 91 300 106 parsed_2n0r 1
113 "40 [a22] N/C3' endo" 305 91 305 112 parsed_2n0r 1
114 "[a22] N delta" 307 91 307 106 parsed_2n0r 1
115 "[u23] N/C3' endo" 312 91 312 109 parsed_2n0r 1
116 "[u23] N delta" 314 91 314 106 parsed_2n0r 1
117 "[g24] N/C3' endo" 320 91 320 109 parsed_2n0r 1
118 "[g24] N delta" 322 91 322 106 parsed_2n0r 1
119 "[g4] S/C2'" 329 90 329 104 parsed_2n0r 1
120 "[g4] S delta" 331 89 331 103 parsed_2n0r 1
121 "[a5] S/C2'" 336 90 336 105 parsed_2n0r 1
122 "[a5] S delta" 338 89 338 103 parsed_2n0r 1
123 "[a19] S/C2'" 343 92 343 107 parsed_2n0r 1
124 "[a19] S delta" 345 91 345 111 parsed_2n0r 1
125 "[u20] S/C2'" 350 92 350 107 parsed_2n0r 1
126 "[u20] S delta" 352 91 352 111 parsed_2n0r 1
127 "[g21] S/C2'" 357 92 357 108 parsed_2n0r 1
128
;
[g21] S delta
from 31P chemical shifts
;
359 91 363 26 parsed_2n0r 1
129 "[g4] alpha" 366 90 366 102 parsed_2n0r 1
130 "[g4] zeta" 368 91 368 102 parsed_2n0r 1
131 "[g6] alpha" 371 90 371 102 parsed_2n0r 1
132 "[g6] zeta" 373 91 373 102 parsed_2n0r 1
133 "[a18] alpha" 376 93 376 106 parsed_2n0r 1
134 "[a18] zeta" 378 93 378 105 parsed_2n0r 1
135 "[u20] alpha" 381 92 381 105 parsed_2n0r 1
136 "[u20] zeta" 383 93 383 105 parsed_2n0r 1
137 "[g21] alpha" 386 93 386 106 parsed_2n0r 1
138 "[g21] zeta" 388 93 388 105 parsed_2n0r 1
139 "U3 anti" 391 101 391 110 parsed_2n0r 1
140 "G4 anti" 394 101 394 110 parsed_2n0r 1
141 "A5 anti" 397 101 397 110 parsed_2n0r 1
142 "G6 anti" 400 101 400 110 parsed_2n0r 1
143 "C7 anti" 403 101 403 110 parsed_2n0r 1
144 "U8 anti" 406 101 406 110 parsed_2n0r 1
145 "c9 anti" 409 101 409 110 parsed_2n0r 1
146 "G10 anti" 412 101 412 111 parsed_2n0r 1
147 "A15 anti" 415 101 415 111 parsed_2n0r 1
148 "G16 anti" 418 101 418 111 parsed_2n0r 1
149 "C17 anti" 421 101 421 111 parsed_2n0r 1
150 "A18 anti" 424 101 424 111 parsed_2n0r 1
151 "A19 syn" 427 101 427 110 parsed_2n0r 1
152 "U20 anti" 430 101 430 111 parsed_2n0r 1
153 "G21 anti" 433 101 433 111 parsed_2n0r 1
154 "A22 anti" 436 101 436 111 parsed_2n0r 1
155 "U23 anti" 439 101 439 111 parsed_2n0r 1
156 "G24 anti" 442 101 442 111 parsed_2n0r 1
stop_
save_
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