Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
35711 | 1m82 RC | 5528 | cing | 2-parsed | STAR | dihedral angle | 140 |
data_1m82_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1m82
_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_1m82 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1m82
_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 1m82 "Master copy" parsed_1m82
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1m82
_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 1m82.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . XPLOR/CNS 2 distance NOE simple 435 parsed_1m82 1
1 1m82.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . XPLOR/CNS 4 planarity "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 48 parsed_1m82 1
1 1m82.mr . . XPLOR/CNS 7 distance NOE simple 132 parsed_1m82 1
1 1m82.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 140 parsed_1m82 1
1 1m82.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1m82 1
1 1m82.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1m82 1
stop_
save_
save_CNS/XPLOR_dihedral_9
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1m82
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55 115 . . 1 . C5' . 1 . C4' . 1 . C3' . 1 . O3' parsed_1m82 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P parsed_1m82 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 1 . C3' . 1 . O3' . 2 . P . 2 . O5' parsed_1m82 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 1 . O4' . 1 . C1' . 1 . N9 . 1 . C4 parsed_1m82 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 1 . O3' . 2 . P . 2 . O5' . 2 . C5' parsed_1m82 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' parsed_1m82 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' parsed_1m82 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 2 . C5' . 2 . C4' . 2 . C3' . 2 . O3' parsed_1m82 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P parsed_1m82 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' parsed_1m82 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 2 . O4' . 2 . C1' . 2 . N9 . 2 . C4 parsed_1m82 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' parsed_1m82 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' parsed_1m82 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' parsed_1m82 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 3 . C5' . 3 . C4' . 3 . C3' . 3 . O3' parsed_1m82 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P parsed_1m82 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' parsed_1m82 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 3 . O4' . 3 . C1' . 3 . N9 . 3 . C4 parsed_1m82 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' parsed_1m82 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' parsed_1m82 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' parsed_1m82 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 4 . C5' . 4 . C4' . 4 . C3' . 4 . O3' parsed_1m82 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 4 . C3' . 4 . O3' . 5 . P . 5 . O5' parsed_1m82 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 4 . O4' . 4 . C1' . 4 . N9 . 4 . C4 parsed_1m82 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 4 . O3' . 5 . P . 5 . O5' . 5 . C5' parsed_1m82 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' parsed_1m82 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 5 . C5' . 5 . C4' . 5 . C3' . 5 . O3' parsed_1m82 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 5 . C4' . 5 . C3' . 5 . O3' . 6 . P parsed_1m82 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 5 . C3' . 5 . O3' . 6 . P . 6 . O5' parsed_1m82 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 5 . O4' . 5 . C1' . 5 . N9 . 5 . C4 parsed_1m82 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 5 . O3' . 6 . P . 6 . O5' . 6 . C5' parsed_1m82 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' parsed_1m82 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 6 . O5' . 6 . C5' . 6 . C4' . 6 . C3' parsed_1m82 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 6 . C5' . 6 . C4' . 6 . C3' . 6 . O3' parsed_1m82 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 6 . C4' . 6 . C3' . 6 . O3' . 7 . P parsed_1m82 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 6 . O4' . 6 . C1' . 6 . N1 . 6 . C2 parsed_1m82 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' parsed_1m82 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 7 . C5' . 7 . C4' . 7 . C3' . 7 . O3' parsed_1m82 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 7 . C4' . 7 . C3' . 7 . O3' . 8 . P parsed_1m82 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 7 . O4' . 7 . C1' . 7 . N9 . 7 . C4 parsed_1m82 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' parsed_1m82 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 8 . C5' . 8 . C4' . 8 . C3' . 8 . O3' parsed_1m82 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 8 . C4' . 8 . C3' . 8 . O3' . 9 . P parsed_1m82 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 8 . C3' . 8 . O3' . 9 . P . 9 . O5' parsed_1m82 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 8 . O4' . 8 . C1' . 8 . N9 . 8 . C4 parsed_1m82 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 8 . O3' . 9 . P . 9 . O5' . 9 . C5' parsed_1m82 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 9 . P . 9 . O5' . 9 . C5' . 9 . C4' parsed_1m82 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 9 . O5' . 9 . C5' . 9 . C4' . 9 . C3' parsed_1m82 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 9 . C5' . 9 . C4' . 9 . C3' . 9 . O3' parsed_1m82 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P parsed_1m82 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101 -41 . . 9 . C3' . 9 . O3' . 10 . P . 10 . O5' parsed_1m82 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 9 . O4' . 9 . C1' . 9 . N9 . 9 . C4 parsed_1m82 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98 -38 . . 9 . O3' . 10 . P . 10 . O5' . 10 . C5' parsed_1m82 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 10 . P . 10 . O5' . 10 . C5' . 10 . C4' parsed_1m82 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 10 . O5' . 10 . C5' . 10 . C4' . 10 . C3' parsed_1m82 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 10 . C5' . 10 . C4' . 10 . C3' . 10 . O3' parsed_1m82 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 10 . C4' . 10 . C3' . 10 . O3' . 11 . P parsed_1m82 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101 -41 . . 10 . C3' . 10 . O3' . 11 . P . 11 . O5' parsed_1m82 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 10 . O4' . 10 . C1' . 10 . N1 . 10 . C2 parsed_1m82 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98 -38 . . 10 . O3' . 11 . P . 11 . O5' . 11 . C5' parsed_1m82 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_1m82 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 11 . C5' . 11 . C4' . 11 . C3' . 11 . O3' parsed_1m82 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P parsed_1m82 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101 -41 . . 11 . C3' . 11 . O3' . 12 . P . 12 . O5' parsed_1m82 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 11 . O4' . 11 . C1' . 11 . N1 . 11 . C2 parsed_1m82 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' parsed_1m82 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145 175 . . 12 . C5' . 12 . C4' . 12 . C3' . 12 . O3' parsed_1m82 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 12 . C4' . 12 . C3' . 12 . O3' . 13 . P parsed_1m82 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101 -41 . . 12 . C3' . 12 . O3' . 13 . P . 13 . O5' parsed_1m82 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 12 . O4' . 12 . C1' . 12 . N1 . 12 . C2 parsed_1m82 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98 -38 . . 12 . O3' . 13 . P . 13 . O5' . 13 . C5' parsed_1m82 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' parsed_1m82 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145 175 . . 13 . C5' . 13 . C4' . 13 . C3' . 13 . O3' parsed_1m82 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P parsed_1m82 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 13 . O4' . 13 . C1' . 13 . N1 . 13 . C2 parsed_1m82 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98 -38 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_1m82 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 14 . C5' . 14 . C4' . 14 . C3' . 14 . O3' parsed_1m82 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P parsed_1m82 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' parsed_1m82 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 15 . C5' . 15 . C4' . 15 . C3' . 15 . O3' parsed_1m82 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P parsed_1m82 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 15 . C3' . 15 . O3' . 16 . P . 16 . O5' parsed_1m82 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 15 . O4' . 15 . C1' . 15 . N9 . 15 . C4 parsed_1m82 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 15 . O3' . 16 . P . 16 . O5' . 16 . C5' parsed_1m82 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' parsed_1m82 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' parsed_1m82 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 16 . C5' . 16 . C4' . 16 . C3' . 16 . O3' parsed_1m82 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183 -123 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_1m82 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_1m82 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 16 . O4' . 16 . C1' . 16 . N1 . 16 . C2 parsed_1m82 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_1m82 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_1m82 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_1m82 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 105 . . 17 . C5' . 17 . C4' . 17 . C3' . 17 . O3' parsed_1m82 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_1m82 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 17 . O4' . 17 . C1' . 17 . N1 . 17 . C2 parsed_1m82 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_1m82 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_1m82 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140 180 . . 18 . C5' . 18 . C4' . 18 . C3' . 18 . O3' parsed_1m82 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P parsed_1m82 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' parsed_1m82 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 19 . C4' . 19 . C3' . 19 . O3' . 20 . P parsed_1m82 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 19 . O4' . 19 . C1' . 19 . N1 . 19 . C2 parsed_1m82 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' parsed_1m82 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 20 . C5' . 20 . C4' . 20 . C3' . 20 . O3' parsed_1m82 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 190 290 . . 20 . C4' . 20 . C3' . 20 . O3' . 21 . P parsed_1m82 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 20 . C3' . 20 . O3' . 21 . P . 21 . O5' parsed_1m82 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 20 . O4' . 20 . C1' . 20 . N9 . 20 . C4 parsed_1m82 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 20 . O3' . 21 . P . 21 . O5' . 21 . C5' parsed_1m82 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 148 208 . . 21 . P . 21 . O5' . 21 . C5' . 21 . C4' parsed_1m82 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 21 . C5' . 21 . C4' . 21 . C3' . 21 . O3' parsed_1m82 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 21 . C4' . 21 . C3' . 21 . O3' . 22 . P parsed_1m82 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 21 . C3' . 21 . O3' . 22 . P . 22 . O5' parsed_1m82 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 21 . O4' . 21 . C1' . 21 . N1 . 21 . C2 parsed_1m82 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 21 . O3' . 22 . P . 22 . O5' . 22 . C5' parsed_1m82 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 22 . P . 22 . O5' . 22 . C5' . 22 . C4' parsed_1m82 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 22 . O5' . 22 . C5' . 22 . C4' . 22 . C3' parsed_1m82 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 22 . C5' . 22 . C4' . 22 . C3' . 22 . O3' parsed_1m82 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 22 . C4' . 22 . C3' . 22 . O3' . 23 . P parsed_1m82 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 22 . C3' . 22 . O3' . 23 . P . 23 . O5' parsed_1m82 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 22 . O4' . 22 . C1' . 22 . N1 . 22 . C2 parsed_1m82 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' parsed_1m82 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' parsed_1m82 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' parsed_1m82 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 23 . C5' . 23 . C4' . 23 . C3' . 23 . O3' parsed_1m82 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 23 . C4' . 23 . C3' . 23 . O3' . 24 . P parsed_1m82 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 23 . C3' . 23 . O3' . 24 . P . 24 . O5' parsed_1m82 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 23 . O4' . 23 . C1' . 23 . N1 . 23 . C2 parsed_1m82 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' parsed_1m82 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' parsed_1m82 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' parsed_1m82 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 100 . . 24 . C5' . 24 . C4' . 24 . C3' . 24 . O3' parsed_1m82 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168 -138 . . 24 . C4' . 24 . C3' . 24 . O3' . 25 . P parsed_1m82 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -56 . . 24 . C3' . 24 . O3' . 25 . P . 25 . O5' parsed_1m82 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 24 . O4' . 24 . C1' . 24 . N1 . 24 . C2 parsed_1m82 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -53 . . 24 . O3' . 25 . P . 25 . O5' . 25 . C5' parsed_1m82 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 163 193 . . 25 . P . 25 . O5' . 25 . C5' . 25 . C4' parsed_1m82 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 39 69 . . 25 . O5' . 25 . C5' . 25 . C4' . 25 . C3' parsed_1m82 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55 115 . . 25 . C5' . 25 . C4' . 25 . C3' . 25 . O3' parsed_1m82 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -143 . . 25 . O4' . 25 . C1' . 25 . N1 . 25 . C2 parsed_1m82 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
;
g1 beta is unconstrained
g1 gamma is unconstrained
g1 delta
;
1 1 5 11 parsed_1m82 1
2 "g1 epsilon" 10 1 10 13 parsed_1m82 1
3 "g1 zeta" 15 1 15 10 parsed_1m82 1
4 "g1 chi" 20 1 20 9 parsed_1m82 1
5 "g2 alpha" 25 1 25 11 parsed_1m82 1
6 "g2 beta" 30 1 30 10 parsed_1m82 1
7 "g2 gamma" 35 1 35 11 parsed_1m82 1
8 "g2 delta" 40 1 40 11 parsed_1m82 1
9 "g2 epsilon" 45 1 45 13 parsed_1m82 1
10 "g2 zeta" 50 1 50 10 parsed_1m82 1
11 "g2 chi" 55 1 55 9 parsed_1m82 1
12 "a3 alpha" 60 1 60 11 parsed_1m82 1
13 "a3 beta" 65 1 65 10 parsed_1m82 1
14 "a3 gamma" 70 1 70 11 parsed_1m82 1
15 "a3 delta" 75 1 75 11 parsed_1m82 1
16 "a3 epsilon" 80 1 80 13 parsed_1m82 1
17 "a3 zeta" 85 1 85 10 parsed_1m82 1
18 "a3 chi" 90 1 90 9 parsed_1m82 1
19 "a4 alpha" 95 1 95 11 parsed_1m82 1
20 "a4 beta" 100 1 100 10 parsed_1m82 1
21 "a4 gamma" 105 1 105 11 parsed_1m82 1
22 "a4 delta" 110 1 110 11 parsed_1m82 1
23
;
a4 epsilon is unconstrained
a4 zeta
;
115 1 117 10 parsed_1m82 1
24 "a4 chi" 122 1 122 9 parsed_1m82 1
25 "g5 alpha" 127 1 127 11 parsed_1m82 1
26 "g5 beta" 132 1 132 10 parsed_1m82 1
27
;
g5 gamma is unconstrained
g5 delta
;
137 1 139 11 parsed_1m82 1
28 "g5 epsilon" 144 1 144 13 parsed_1m82 1
29 "g5 zeta" 149 1 149 10 parsed_1m82 1
30 "g5 chi" 154 1 154 9 parsed_1m82 1
31 "c6 alpha" 159 1 159 11 parsed_1m82 1
32 "c6 beta" 164 1 164 10 parsed_1m82 1
33 "c6 gamma" 169 1 169 11 parsed_1m82 1
34 "c6 delta" 174 1 174 11 parsed_1m82 1
35 "c6 epsilon" 179 1 179 13 parsed_1m82 1
36
;
c6 zeta is unconstrained
c6 chi
;
184 1 186 9 parsed_1m82 1
37
;
a7 alpha is unconstrained
a7 beta
;
191 1 193 10 parsed_1m82 1
38
;
a7 gamma is unconstrained
a7 delta
;
198 1 200 11 parsed_1m82 1
39 "a7 epsilon" 205 1 205 13 parsed_1m82 1
40
;
a7 zeta is unconstrained
a7 chi
;
210 1 212 9 parsed_1m82 1
41
;
g8 alpha is unconstrained
g8 beta
;
217 1 219 10 parsed_1m82 1
42
;
g8 gamma is unconstrained
g8 delta
;
224 1 226 11 parsed_1m82 1
43 "g8 epsilon" 231 1 231 13 parsed_1m82 1
44 "g8 zeta" 236 1 236 10 parsed_1m82 1
45 "g8 chi" 241 1 241 9 parsed_1m82 1
46 "g9 alpha" 246 1 246 11 parsed_1m82 1
47 "g9 beta" 251 1 251 10 parsed_1m82 1
48 "g9 gamma" 256 1 256 11 parsed_1m82 1
49 "g9 delta" 261 1 261 11 parsed_1m82 1
50 "g9 epsilon" 266 1 266 13 parsed_1m82 1
51 "g9 zeta" 271 1 271 10 parsed_1m82 1
52 "g9 chi" 276 1 276 9 parsed_1m82 1
53 "c10 alpha" 281 1 281 12 parsed_1m82 1
54 "c10 beta" 286 1 286 11 parsed_1m82 1
55 "c10 gamma" 291 1 291 12 parsed_1m82 1
56 "c10 delta" 296 1 296 12 parsed_1m82 1
57 "c10 epsilon" 301 1 301 14 parsed_1m82 1
58 "c10 zeta" 306 1 306 11 parsed_1m82 1
59 "c10 chi" 311 1 311 10 parsed_1m82 1
60 "u11 alpha" 316 1 316 12 parsed_1m82 1
61 "u11 beta" 321 1 321 11 parsed_1m82 1
62
;
u11 gamma is unconstrained
u11 delta
;
326 1 328 12 parsed_1m82 1
63 "u11 epsilon" 333 1 333 14 parsed_1m82 1
64 "u11 zeta" 338 1 338 11 parsed_1m82 1
65 "u11 chi" 343 1 343 10 parsed_1m82 1
66
;
u12 alpha is unconstrained
u12 beta
;
348 1 350 11 parsed_1m82 1
67
;
u12 gamma is unconstrained
u12 delta
;
355 1 357 12 parsed_1m82 1
68 "u12 epsilon" 362 1 362 14 parsed_1m82 1
69 "u12 zeta" 367 1 367 11 parsed_1m82 1
70 "u12 chi" 372 1 372 10 parsed_1m82 1
71 "c13 alpha" 377 1 377 12 parsed_1m82 1
72 "c13 beta" 382 1 382 11 parsed_1m82 1
73
;
c13 gamma is unconstrained
c13 delta
;
387 1 389 12 parsed_1m82 1
74 "c13 epsilon" 394 1 394 14 parsed_1m82 1
75
;
c13 zeta is unconstrained
c13 chi
;
399 1 401 10 parsed_1m82 1
76 "g14 alpha" 406 1 406 12 parsed_1m82 1
77
;
g14 beta is unconstrained
g14 gamma is unconstrained
g14 delta
;
411 1 415 12 parsed_1m82 1
78 "g14 epsilon" 420 1 420 14 parsed_1m82 1
79
;
g14 zeta is unconstrained
g14 chi is unconstrained
g15 alpha is unconstrained
g15 beta
;
425 1 431 11 parsed_1m82 1
80
;
g15 gamma is unconstrained
g15 delta
;
436 1 438 12 parsed_1m82 1
81 "g15 epsilon" 443 1 443 14 parsed_1m82 1
82 "g15 zeta" 448 1 448 11 parsed_1m82 1
83 "g15 chi" 453 1 453 10 parsed_1m82 1
84 "c16 alpha" 458 1 458 12 parsed_1m82 1
85 "c16 beta" 463 1 463 11 parsed_1m82 1
86 "c16 gamma" 468 1 468 12 parsed_1m82 1
87 "c16 delta" 473 1 473 12 parsed_1m82 1
88 "c16 epsilon" 478 1 478 14 parsed_1m82 1
89 "c16 zeta" 483 1 483 11 parsed_1m82 1
90 "c16 chi" 488 1 488 10 parsed_1m82 1
91 "c17 alpha" 493 1 493 12 parsed_1m82 1
92 "c17 beta" 498 1 498 11 parsed_1m82 1
93 "c17 gamma" 503 1 503 12 parsed_1m82 1
94 "c17 delta" 508 1 508 12 parsed_1m82 1
95
;
c17 epsilon is unconstrained
c17 zeta
;
513 1 515 11 parsed_1m82 1
96 "c17 chi" 520 1 520 10 parsed_1m82 1
97 "u18 alpha" 525 1 525 12 parsed_1m82 1
98 "u18 beta" 530 1 530 11 parsed_1m82 1
99
;
u18 gamma is unconstrained
u18 delta
;
535 1 537 12 parsed_1m82 1
100 "u18 epsilon" 542 1 542 14 parsed_1m82 1
101
;
u19 alpha is unconstrained
u19 beta
;
554 1 556 11 parsed_1m82 1
102
;
u19 gamma is unconstrained
u19 delta is unconstrained
u19 epsilon
;
561 1 565 14 parsed_1m82 1
103
;
u19 zeta is unconstrained
u19 chi
;
570 1 572 10 parsed_1m82 1
104
;
g20 alpha is unconstrained
g20 beta
;
577 1 579 11 parsed_1m82 1
105
;
g20 gamma is unconstrained
g20 delta
;
584 1 586 12 parsed_1m82 1
106 "g20 epsilon" 591 1 591 14 parsed_1m82 1
107 "g20 zeta" 596 1 596 11 parsed_1m82 1
108 "g20 chi" 601 1 601 10 parsed_1m82 1
109 "u21 alpha" 606 1 606 12 parsed_1m82 1
110 "u21 beta" 611 1 611 11 parsed_1m82 1
111
;
u21 gamma is unconstrained
u21 delta
;
616 1 618 12 parsed_1m82 1
112 "u21 epsilon" 623 1 623 14 parsed_1m82 1
113 "u21 zeta" 628 1 628 11 parsed_1m82 1
114 "u21 chi" 633 1 633 10 parsed_1m82 1
115 "u22 alpha" 638 1 638 12 parsed_1m82 1
116 "u22 beta" 643 1 643 11 parsed_1m82 1
117 "u22 gamma" 648 1 648 12 parsed_1m82 1
118 "u22 delta" 653 1 653 12 parsed_1m82 1
119 "u22 epsilon" 658 1 658 14 parsed_1m82 1
120 "u22 zeta" 663 1 663 11 parsed_1m82 1
121 "u22 chi" 668 1 668 10 parsed_1m82 1
122 "u23 alpha" 673 1 673 12 parsed_1m82 1
123 "u23 beta" 678 1 678 11 parsed_1m82 1
124 "u23 gamma" 683 1 683 12 parsed_1m82 1
125 "u23 delta" 688 1 688 12 parsed_1m82 1
126 "u23 epsilon" 693 1 693 14 parsed_1m82 1
127 "u23 zeta" 698 1 698 11 parsed_1m82 1
128 "u23 chi" 703 1 703 10 parsed_1m82 1
129 "c24 alpha" 708 1 708 12 parsed_1m82 1
130 "c24 beta" 713 1 713 11 parsed_1m82 1
131 "c24 gamma" 718 1 718 12 parsed_1m82 1
132 "c24 delta" 723 1 723 12 parsed_1m82 1
133 "c24 epsilon" 728 1 728 14 parsed_1m82 1
134 "c24 zeta" 733 1 733 11 parsed_1m82 1
135 "c24 chi" 738 1 738 10 parsed_1m82 1
136 "c25 alpha" 743 1 743 12 parsed_1m82 1
137 "c25 beta" 748 1 748 11 parsed_1m82 1
138 "c25 gamma" 753 1 753 12 parsed_1m82 1
139 "c25 delta" 758 1 758 12 parsed_1m82 1
140 "c25 chi" 763 1 763 10 parsed_1m82 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1
;
assign (resid 18 and name O4') (resid 18 and name C1')
(resid 18 and name N1 ) (reisd 18 and name C2 )
1 -158 15 2
;
550 1 552 18 parsed_1m82 1
stop_
save_