NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
51916 |
2kbq   |
cing | 2-parsed | STAR | dihedral angle | 114 |
data_2kbq_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kbq
_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_2kbq 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kbq
_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 2kbq "Master copy" parsed_2kbq
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kbq
_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 2kbq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kbq 1
1 2kbq.mr . . XPLOR/CNS 2 distance NOE simple 1199 parsed_2kbq 1
1 2kbq.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 70 parsed_2kbq 1
1 2kbq.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 114 parsed_2kbq 1
1 2kbq.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kbq 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2kbq
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.69 -52.17 . A 4 . c A 5 . n A 5 . ca A 5 . c parsed_2kbq 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.88 -23.88 . A 4 . n A 4 . ca A 4 . c A 5 . n parsed_2kbq 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.58 -52.98 . A 5 . c A 6 . n A 6 . ca A 6 . c parsed_2kbq 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.74 -26.18 . A 5 . n A 5 . ca A 5 . c A 6 . n parsed_2kbq 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.81 -57.13 . A 6 . c A 7 . n A 7 . ca A 7 . c parsed_2kbq 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.46 -30.78 . A 6 . n A 6 . ca A 6 . c A 7 . n parsed_2kbq 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.05 -50.25 . A 7 . c A 8 . n A 8 . ca A 8 . c parsed_2kbq 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.58 -26.34 . A 7 . n A 7 . ca A 7 . c A 8 . n parsed_2kbq 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.56 -60.20 . A 8 . c A 9 . n A 9 . ca A 9 . c parsed_2kbq 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.63 -30.51 . A 8 . n A 8 . ca A 8 . c A 9 . n parsed_2kbq 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.27 -53.43 . A 9 . c A 10 . n A 10 . ca A 10 . c parsed_2kbq 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.74 -32.42 . A 9 . n A 9 . ca A 9 . c A 10 . n parsed_2kbq 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.23 -53.11 . A 10 . c A 11 . n A 11 . ca A 11 . c parsed_2kbq 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.07 -29.91 . A 10 . n A 10 . ca A 10 . c A 11 . n parsed_2kbq 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.80 -57.32 . A 11 . c A 12 . n A 12 . ca A 12 . c parsed_2kbq 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.18 -35.22 . A 11 . n A 11 . ca A 11 . c A 12 . n parsed_2kbq 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.25 -52.69 . A 12 . c A 13 . n A 13 . ca A 13 . c parsed_2kbq 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.80 -22.44 . A 12 . n A 12 . ca A 12 . c A 13 . n parsed_2kbq 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.36 -57.92 . A 13 . c A 14 . n A 14 . ca A 14 . c parsed_2kbq 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.61 -37.01 . A 13 . n A 13 . ca A 13 . c A 14 . n parsed_2kbq 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.78 -50.70 . A 14 . c A 15 . n A 15 . ca A 15 . c parsed_2kbq 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.28 -15.44 . A 14 . n A 14 . ca A 14 . c A 15 . n parsed_2kbq 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.00 -43.12 . A 15 . c A 16 . n A 16 . ca A 16 . c parsed_2kbq 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.79 -13.59 . A 15 . n A 15 . ca A 15 . c A 16 . n parsed_2kbq 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.71 -35.03 . A 18 . c A 19 . n A 19 . ca A 19 . c parsed_2kbq 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.61 1.07 . A 18 . n A 18 . ca A 18 . c A 19 . n parsed_2kbq 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -66.96 -47.76 . A 20 . c A 21 . n A 21 . ca A 21 . c parsed_2kbq 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.77 -18.29 . A 20 . n A 20 . ca A 20 . c A 21 . n parsed_2kbq 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.94 -50.82 . A 21 . c A 22 . n A 22 . ca A 22 . c parsed_2kbq 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.55 -30.55 . A 21 . n A 21 . ca A 21 . c A 22 . n parsed_2kbq 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.86 -58.30 . A 22 . c A 23 . n A 23 . ca A 23 . c parsed_2kbq 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.64 -34.00 . A 22 . n A 22 . ca A 22 . c A 23 . n parsed_2kbq 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.78 -52.62 . A 23 . c A 24 . n A 24 . ca A 24 . c parsed_2kbq 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.56 -28.48 . A 23 . n A 23 . ca A 23 . c A 24 . n parsed_2kbq 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.58 -52.78 . A 24 . c A 25 . n A 25 . ca A 25 . c parsed_2kbq 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.60 -28.72 . A 24 . n A 24 . ca A 24 . c A 25 . n parsed_2kbq 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.94 -40.90 . A 25 . c A 26 . n A 26 . ca A 26 . c parsed_2kbq 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.26 -27.62 . A 25 . n A 25 . ca A 25 . c A 26 . n parsed_2kbq 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.23 -48.79 . A 26 . c A 27 . n A 27 . ca A 27 . c parsed_2kbq 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.89 -28.57 . A 26 . n A 26 . ca A 26 . c A 27 . n parsed_2kbq 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.22 -54.50 . A 27 . c A 28 . n A 28 . ca A 28 . c parsed_2kbq 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.35 -32.15 . A 27 . n A 27 . ca A 27 . c A 28 . n parsed_2kbq 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.05 -50.81 . A 28 . c A 29 . n A 29 . ca A 29 . c parsed_2kbq 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.54 -20.26 . A 28 . n A 28 . ca A 28 . c A 29 . n parsed_2kbq 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.70 -56.54 . A 29 . c A 30 . n A 30 . ca A 30 . c parsed_2kbq 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.46 -31.94 . A 29 . n A 29 . ca A 29 . c A 30 . n parsed_2kbq 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.87 -40.43 . A 30 . c A 31 . n A 31 . ca A 31 . c parsed_2kbq 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.10 -12.62 . A 30 . n A 30 . ca A 30 . c A 31 . n parsed_2kbq 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.10 -50.54 . A 32 . c A 33 . n A 33 . ca A 33 . c parsed_2kbq 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.44 -18.08 . A 32 . n A 32 . ca A 32 . c A 33 . n parsed_2kbq 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.83 -54.07 . A 33 . c A 34 . n A 34 . ca A 34 . c parsed_2kbq 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.61 -26.21 . A 33 . n A 33 . ca A 33 . c A 34 . n parsed_2kbq 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.67 -50.71 . A 34 . c A 35 . n A 35 . ca A 35 . c parsed_2kbq 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.15 -28.27 . A 34 . n A 34 . ca A 34 . c A 35 . n parsed_2kbq 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.66 -51.22 . A 35 . c A 36 . n A 36 . ca A 36 . c parsed_2kbq 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.25 -9.45 . A 35 . n A 35 . ca A 35 . c A 36 . n parsed_2kbq 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.42 -28.50 . A 39 . c A 40 . n A 40 . ca A 40 . c parsed_2kbq 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.39 10.93 . A 39 . n A 39 . ca A 39 . c A 40 . n parsed_2kbq 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.43 -53.55 . A 40 . c A 41 . n A 41 . ca A 41 . c parsed_2kbq 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.54 -23.06 . A 40 . n A 40 . ca A 40 . c A 41 . n parsed_2kbq 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.74 -58.22 . A 41 . c A 42 . n A 42 . ca A 42 . c parsed_2kbq 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.31 -36.43 . A 41 . n A 41 . ca A 41 . c A 42 . n parsed_2kbq 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.05 -52.97 . A 42 . c A 43 . n A 43 . ca A 43 . c parsed_2kbq 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.19 -32.51 . A 42 . n A 42 . ca A 42 . c A 43 . n parsed_2kbq 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.76 -52.48 . A 43 . c A 44 . n A 44 . ca A 44 . c parsed_2kbq 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.25 -39.61 . A 43 . n A 43 . ca A 43 . c A 44 . n parsed_2kbq 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.04 -53.52 . A 44 . c A 45 . n A 45 . ca A 45 . c parsed_2kbq 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.32 -24.76 . A 44 . n A 44 . ca A 44 . c A 45 . n parsed_2kbq 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.25 -50.53 . A 45 . c A 46 . n A 46 . ca A 46 . c parsed_2kbq 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.47 -26.51 . A 45 . n A 45 . ca A 45 . c A 46 . n parsed_2kbq 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -52.8 . A 46 . c A 47 . n A 47 . ca A 47 . c parsed_2kbq 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.36 -20.48 . A 46 . n A 46 . ca A 46 . c A 47 . n parsed_2kbq 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.17 -50.09 . A 47 . c A 48 . n A 48 . ca A 48 . c parsed_2kbq 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.67 -31.35 . A 47 . n A 47 . ca A 47 . c A 48 . n parsed_2kbq 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.23 -50.51 . A 48 . c A 49 . n A 49 . ca A 49 . c parsed_2kbq 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.98 -4.02 . A 48 . n A 48 . ca A 48 . c A 49 . n parsed_2kbq 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.58 -46.62 . A 53 . c A 54 . n A 54 . ca A 54 . c parsed_2kbq 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.31 -19.47 . A 53 . n A 53 . ca A 53 . c A 54 . n parsed_2kbq 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.99 -44.83 . A 54 . c A 55 . n A 55 . ca A 55 . c parsed_2kbq 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.09 -5.25 . A 54 . n A 54 . ca A 54 . c A 55 . n parsed_2kbq 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.64 -42.08 . A 55 . c A 56 . n A 56 . ca A 56 . c parsed_2kbq 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.92 13.32 . A 55 . n A 55 . ca A 55 . c A 56 . n parsed_2kbq 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.75 -29.95 . A 56 . c A 57 . n A 57 . ca A 57 . c parsed_2kbq 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.30 -24.34 . A 56 . n A 56 . ca A 56 . c A 57 . n parsed_2kbq 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.59 -53.39 . A 57 . c A 58 . n A 58 . ca A 58 . c parsed_2kbq 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.33 -18.37 . A 57 . n A 57 . ca A 57 . c A 58 . n parsed_2kbq 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.46 -50.26 . A 58 . c A 59 . n A 59 . ca A 59 . c parsed_2kbq 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.40 -28.52 . A 58 . n A 58 . ca A 58 . c A 59 . n parsed_2kbq 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.39 -53.87 . A 59 . c A 60 . n A 60 . ca A 60 . c parsed_2kbq 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.36 -30.40 . A 59 . n A 59 . ca A 59 . c A 60 . n parsed_2kbq 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.17 -59.85 . A 60 . c A 61 . n A 61 . ca A 61 . c parsed_2kbq 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.35 -8.55 . A 60 . n A 60 . ca A 60 . c A 61 . n parsed_2kbq 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.38 -56.82 . A 61 . c A 62 . n A 62 . ca A 62 . c parsed_2kbq 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.89 -12.77 . A 61 . n A 61 . ca A 61 . c A 62 . n parsed_2kbq 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.33 -57.49 . A 62 . c A 63 . n A 63 . ca A 63 . c parsed_2kbq 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.42 -30.66 . A 62 . n A 62 . ca A 62 . c A 63 . n parsed_2kbq 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.39 -35.51 . A 63 . c A 64 . n A 64 . ca A 64 . c parsed_2kbq 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.48 -26.96 . A 63 . n A 63 . ca A 63 . c A 64 . n parsed_2kbq 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.48 -51.88 . A 64 . c A 65 . n A 65 . ca A 65 . c parsed_2kbq 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.39 -11.59 . A 64 . n A 64 . ca A 64 . c A 65 . n parsed_2kbq 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.83 -50.43 . A 67 . c A 68 . n A 68 . ca A 68 . c parsed_2kbq 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.15 157.27 . A 67 . n A 67 . ca A 67 . c A 68 . n parsed_2kbq 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.80 -51.76 . A 71 . c A 72 . n A 72 . ca A 72 . c parsed_2kbq 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.70 -18.26 . A 71 . n A 71 . ca A 71 . c A 72 . n parsed_2kbq 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.73 -47.61 . A 72 . c A 73 . n A 73 . ca A 73 . c parsed_2kbq 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.59 -27.99 . A 72 . n A 72 . ca A 72 . c A 73 . n parsed_2kbq 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.65 -54.01 . A 73 . c A 74 . n A 74 . ca A 74 . c parsed_2kbq 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.68 -21.60 . A 73 . n A 73 . ca A 73 . c A 74 . n parsed_2kbq 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.39 -46.23 . A 74 . c A 75 . n A 75 . ca A 75 . c parsed_2kbq 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.54 -33.02 . A 74 . n A 74 . ca A 74 . c A 75 . n parsed_2kbq 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.66 -56.82 . A 75 . c A 76 . n A 76 . ca A 76 . c parsed_2kbq 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.27 -22.15 . A 75 . n A 75 . ca A 75 . c A 76 . n parsed_2kbq 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.75 -45.51 . A 76 . c A 77 . n A 77 . ca A 77 . c parsed_2kbq 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.74 -7.62 . A 76 . n A 76 . ca A 76 . c A 77 . n parsed_2kbq 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 "phi: 4 - 5" 1 1 1 17 parsed_2kbq 1
2 "psi: 4 - 5" 5 1 5 17 parsed_2kbq 1
3 "phi: 5 - 6" 9 1 9 17 parsed_2kbq 1
4 "psi: 5 - 6" 13 1 13 17 parsed_2kbq 1
5 "phi: 6 - 7" 17 1 17 17 parsed_2kbq 1
6 "psi: 6 - 7" 21 1 21 17 parsed_2kbq 1
7 "phi: 7 - 8" 25 1 25 17 parsed_2kbq 1
8 "psi: 7 - 8" 29 1 29 17 parsed_2kbq 1
9 "phi: 8 - 9" 33 1 33 17 parsed_2kbq 1
10 "psi: 8 - 9" 37 1 37 17 parsed_2kbq 1
11 "phi: 9 - 10" 41 1 41 17 parsed_2kbq 1
12 "psi: 9 - 10" 45 1 45 17 parsed_2kbq 1
13 "phi: 10 - 11" 49 1 49 17 parsed_2kbq 1
14 "psi: 10 - 11" 53 1 53 17 parsed_2kbq 1
15 "phi: 11 - 12" 57 1 57 17 parsed_2kbq 1
16 "psi: 11 - 12" 61 1 61 17 parsed_2kbq 1
17 "phi: 12 - 13" 65 1 65 17 parsed_2kbq 1
18 "psi: 12 - 13" 69 1 69 17 parsed_2kbq 1
19 "phi: 13 - 14" 73 1 73 17 parsed_2kbq 1
20 "psi: 13 - 14" 77 1 77 17 parsed_2kbq 1
21 "phi: 14 - 15" 81 1 81 17 parsed_2kbq 1
22 "psi: 14 - 15" 85 1 85 17 parsed_2kbq 1
23 "phi: 15 - 16" 89 1 89 17 parsed_2kbq 1
24 "psi: 15 - 16" 93 1 93 17 parsed_2kbq 1
25 "phi: 18 - 19" 97 1 97 17 parsed_2kbq 1
26 "psi: 18 - 19" 101 1 101 17 parsed_2kbq 1
27 "phi: 20 - 21" 105 1 105 17 parsed_2kbq 1
28 "psi: 20 - 21" 109 1 109 17 parsed_2kbq 1
29 "phi: 21 - 22" 113 1 113 17 parsed_2kbq 1
30 "psi: 21 - 22" 117 1 117 17 parsed_2kbq 1
31 "phi: 22 - 23" 121 1 121 17 parsed_2kbq 1
32 "psi: 22 - 23" 125 1 125 17 parsed_2kbq 1
33 "phi: 23 - 24" 129 1 129 17 parsed_2kbq 1
34 "psi: 23 - 24" 133 1 133 17 parsed_2kbq 1
35 "phi: 24 - 25" 137 1 137 17 parsed_2kbq 1
36 "psi: 24 - 25" 141 1 141 17 parsed_2kbq 1
37 "phi: 25 - 26" 145 1 145 17 parsed_2kbq 1
38 "psi: 25 - 26" 149 1 149 17 parsed_2kbq 1
39 "phi: 26 - 27" 153 1 153 17 parsed_2kbq 1
40 "psi: 26 - 27" 157 1 157 17 parsed_2kbq 1
41 "phi: 27 - 28" 161 1 161 17 parsed_2kbq 1
42 "psi: 27 - 28" 165 1 165 17 parsed_2kbq 1
43 "phi: 28 - 29" 169 1 169 17 parsed_2kbq 1
44 "psi: 28 - 29" 173 1 173 17 parsed_2kbq 1
45 "phi: 29 - 30" 177 1 177 17 parsed_2kbq 1
46 "psi: 29 - 30" 181 1 181 17 parsed_2kbq 1
47 "phi: 30 - 31" 185 1 185 17 parsed_2kbq 1
48 "psi: 30 - 31" 189 1 189 17 parsed_2kbq 1
49 "phi: 32 - 33" 193 1 193 17 parsed_2kbq 1
50 "psi: 32 - 33" 197 1 197 17 parsed_2kbq 1
51 "phi: 33 - 34" 201 1 201 17 parsed_2kbq 1
52 "psi: 33 - 34" 205 1 205 17 parsed_2kbq 1
53 "phi: 34 - 35" 209 1 209 17 parsed_2kbq 1
54 "psi: 34 - 35" 213 1 213 17 parsed_2kbq 1
55 "phi: 35 - 36" 217 1 217 17 parsed_2kbq 1
56 "psi: 35 - 36" 221 1 221 17 parsed_2kbq 1
57 "phi: 39 - 40" 225 1 225 17 parsed_2kbq 1
58 "psi: 39 - 40" 229 1 229 17 parsed_2kbq 1
59 "phi: 40 - 41" 233 1 233 17 parsed_2kbq 1
60 "psi: 40 - 41" 237 1 237 17 parsed_2kbq 1
61 "phi: 41 - 42" 241 1 241 17 parsed_2kbq 1
62 "psi: 41 - 42" 245 1 245 17 parsed_2kbq 1
63 "phi: 42 - 43" 249 1 249 17 parsed_2kbq 1
64 "psi: 42 - 43" 253 1 253 17 parsed_2kbq 1
65 "phi: 43 - 44" 257 1 257 17 parsed_2kbq 1
66 "psi: 43 - 44" 261 1 261 17 parsed_2kbq 1
67 "phi: 44 - 45" 265 1 265 17 parsed_2kbq 1
68 "psi: 44 - 45" 269 1 269 17 parsed_2kbq 1
69 "phi: 45 - 46" 273 1 273 17 parsed_2kbq 1
70 "psi: 45 - 46" 277 1 277 17 parsed_2kbq 1
71 "phi: 46 - 47" 281 1 281 17 parsed_2kbq 1
72 "psi: 46 - 47" 285 1 285 17 parsed_2kbq 1
73 "phi: 47 - 48" 289 1 289 17 parsed_2kbq 1
74 "psi: 47 - 48" 293 1 293 17 parsed_2kbq 1
75 "phi: 48 - 49" 297 1 297 17 parsed_2kbq 1
76 "psi: 48 - 49" 301 1 301 17 parsed_2kbq 1
77 "phi: 53 - 54" 305 1 305 17 parsed_2kbq 1
78 "psi: 53 - 54" 309 1 309 17 parsed_2kbq 1
79 "phi: 54 - 55" 313 1 313 17 parsed_2kbq 1
80 "psi: 54 - 55" 317 1 317 17 parsed_2kbq 1
81 "phi: 55 - 56" 321 1 321 17 parsed_2kbq 1
82 "psi: 55 - 56" 325 1 325 17 parsed_2kbq 1
83 "phi: 56 - 57" 329 1 329 17 parsed_2kbq 1
84 "psi: 56 - 57" 333 1 333 17 parsed_2kbq 1
85 "phi: 57 - 58" 337 1 337 17 parsed_2kbq 1
86 "psi: 57 - 58" 341 1 341 17 parsed_2kbq 1
87 "phi: 58 - 59" 345 1 345 17 parsed_2kbq 1
88 "psi: 58 - 59" 349 1 349 17 parsed_2kbq 1
89 "phi: 59 - 60" 353 1 353 17 parsed_2kbq 1
90 "psi: 59 - 60" 357 1 357 17 parsed_2kbq 1
91 "phi: 60 - 61" 361 1 361 17 parsed_2kbq 1
92 "psi: 60 - 61" 365 1 365 17 parsed_2kbq 1
93 "phi: 61 - 62" 369 1 369 17 parsed_2kbq 1
94 "psi: 61 - 62" 373 1 373 17 parsed_2kbq 1
95 "phi: 62 - 63" 377 1 377 17 parsed_2kbq 1
96 "psi: 62 - 63" 381 1 381 17 parsed_2kbq 1
97 "phi: 63 - 64" 385 1 385 17 parsed_2kbq 1
98 "psi: 63 - 64" 389 1 389 17 parsed_2kbq 1
99 "phi: 64 - 65" 393 1 393 17 parsed_2kbq 1
100 "psi: 64 - 65" 397 1 397 17 parsed_2kbq 1
101 "phi: 67 - 68" 401 1 401 17 parsed_2kbq 1
102 "psi: 67 - 68" 405 1 405 17 parsed_2kbq 1
103 "phi: 71 - 72" 409 1 409 17 parsed_2kbq 1
104 "psi: 71 - 72" 413 1 413 17 parsed_2kbq 1
105 "phi: 72 - 73" 417 1 417 17 parsed_2kbq 1
106 "psi: 72 - 73" 421 1 421 17 parsed_2kbq 1
107 "phi: 73 - 74" 425 1 425 17 parsed_2kbq 1
108 "psi: 73 - 74" 429 1 429 17 parsed_2kbq 1
109 "phi: 74 - 75" 433 1 433 17 parsed_2kbq 1
110 "psi: 74 - 75" 437 1 437 17 parsed_2kbq 1
111 "phi: 75 - 76" 441 1 441 17 parsed_2kbq 1
112 "psi: 75 - 76" 445 1 445 17 parsed_2kbq 1
113 "phi: 76 - 77" 449 1 449 17 parsed_2kbq 1
114 "psi: 76 - 77" 453 1 453 17 parsed_2kbq 1
stop_
save_
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