NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
640382 |
6e98   |
30504 | cing | 2-parsed | STAR | dihedral angle | 134 |
data_6e98_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6e98
_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_6e98 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6e98
_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 6e98 "Master copy" parsed_6e98
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6e98
_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 6e98.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6e98 1
1 6e98.mr . . XPLOR/CNS 2 distance NOE ambi 1428 parsed_6e98 1
1 6e98.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 134 parsed_6e98 1
1 6e98.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_6e98 1
1 6e98.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6e98 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6e98
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -57.44 . " A" 4 . C " A" 5 . N " A" 5 . CA " A" 5 . C parsed_6e98 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 197.72 . " A" 5 . N " A" 5 . CA " A" 5 . C " A" 6 . N parsed_6e98 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -50.16 . " A" 7 . C " A" 8 . N " A" 8 . CA " A" 8 . C parsed_6e98 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 20.00 . " A" 8 . N " A" 8 . CA " A" 8 . C " A" 9 . N parsed_6e98 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -40.00 . " A" 9 . C " A" 10 . N " A" 10 . CA " A" 10 . C parsed_6e98 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 150.00 . " A" 10 . N " A" 10 . CA " A" 10 . C " A" 11 . N parsed_6e98 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -68.82 . " A" 10 . C " A" 11 . N " A" 11 . CA " A" 11 . C parsed_6e98 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 147.84 . " A" 11 . N " A" 11 . CA " A" 11 . C " A" 12 . N parsed_6e98 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -93.52 . " A" 11 . C " A" 12 . N " A" 12 . CA " A" 12 . C parsed_6e98 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 183.38 . " A" 12 . N " A" 12 . CA " A" 12 . C " A" 13 . N parsed_6e98 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -82.32 . " A" 12 . C " A" 13 . N " A" 13 . CA " A" 13 . C parsed_6e98 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 159.08 . " A" 13 . N " A" 13 . CA " A" 13 . C " A" 14 . N parsed_6e98 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -74.64 . " A" 13 . C " A" 14 . N " A" 14 . CA " A" 14 . C parsed_6e98 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 180.68 . " A" 14 . N " A" 14 . CA " A" 14 . C " A" 15 . N parsed_6e98 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -55.42 . " A" 14 . C " A" 15 . N " A" 15 . CA " A" 15 . C parsed_6e98 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 10.36 . " A" 15 . N " A" 15 . CA " A" 15 . C " A" 16 . N parsed_6e98 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -48.92 . " A" 15 . C " A" 16 . N " A" 16 . CA " A" 16 . C parsed_6e98 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 161.06 . " A" 16 . N " A" 16 . CA " A" 16 . C " A" 17 . N parsed_6e98 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -89.18 . " A" 16 . C " A" 17 . N " A" 17 . CA " A" 17 . C parsed_6e98 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 164.64 . " A" 17 . N " A" 17 . CA " A" 17 . C " A" 18 . N parsed_6e98 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -98.26 . " A" 17 . C " A" 18 . N " A" 18 . CA " A" 18 . C parsed_6e98 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 171.16 . " A" 18 . N " A" 18 . CA " A" 18 . C " A" 19 . N parsed_6e98 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.02 . " A" 18 . C " A" 19 . N " A" 19 . CA " A" 19 . C parsed_6e98 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 161.40 . " A" 19 . N " A" 19 . CA " A" 19 . C " A" 20 . N parsed_6e98 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -21.10 . " A" 19 . C " A" 20 . N " A" 20 . CA " A" 20 . C parsed_6e98 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 3.12 . " A" 20 . N " A" 20 . CA " A" 20 . C " A" 21 . N parsed_6e98 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -55.94 . " A" 20 . C " A" 21 . N " A" 21 . CA " A" 21 . C parsed_6e98 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 32.48 . " A" 21 . N " A" 21 . CA " A" 21 . C " A" 22 . N parsed_6e98 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -38.06 . " A" 21 . C " A" 22 . N " A" 22 . CA " A" 22 . C parsed_6e98 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 200.92 . " A" 22 . N " A" 22 . CA " A" 22 . C " A" 23 . N parsed_6e98 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -33.06 . " A" 22 . C " A" 23 . N " A" 23 . CA " A" 23 . C parsed_6e98 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.66 . " A" 23 . N " A" 23 . CA " A" 23 . C " A" 24 . N parsed_6e98 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.84 . " A" 23 . C " A" 24 . N " A" 24 . CA " A" 24 . C parsed_6e98 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -8.42 . " A" 24 . N " A" 24 . CA " A" 24 . C " A" 25 . N parsed_6e98 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.12 . " A" 24 . C " A" 25 . N " A" 25 . CA " A" 25 . C parsed_6e98 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -16.62 . " A" 25 . N " A" 25 . CA " A" 25 . C " A" 26 . N parsed_6e98 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.48 . " A" 25 . C " A" 26 . N " A" 26 . CA " A" 26 . C parsed_6e98 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -14.34 . " A" 26 . N " A" 26 . CA " A" 26 . C " A" 27 . N parsed_6e98 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.60 . " A" 26 . C " A" 27 . N " A" 27 . CA " A" 27 . C parsed_6e98 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.40 . " A" 27 . N " A" 27 . CA " A" 27 . C " A" 28 . N parsed_6e98 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.80 . " A" 27 . C " A" 28 . N " A" 28 . CA " A" 28 . C parsed_6e98 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.50 . " A" 28 . N " A" 28 . CA " A" 28 . C " A" 29 . N parsed_6e98 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.22 . " A" 28 . C " A" 29 . N " A" 29 . CA " A" 29 . C parsed_6e98 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -11.42 . " A" 29 . N " A" 29 . CA " A" 29 . C " A" 30 . N parsed_6e98 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -33.58 . " A" 29 . C " A" 30 . N " A" 30 . CA " A" 30 . C parsed_6e98 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -17.10 . " A" 30 . N " A" 30 . CA " A" 30 . C " A" 31 . N parsed_6e98 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -46.72 . " A" 30 . C " A" 31 . N " A" 31 . CA " A" 31 . C parsed_6e98 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 -2.12 . " A" 31 . N " A" 31 . CA " A" 31 . C " A" 32 . N parsed_6e98 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -68.02 . " A" 31 . C " A" 32 . N " A" 32 . CA " A" 32 . C parsed_6e98 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.00 27.82 . " A" 32 . N " A" 32 . CA " A" 32 . C " A" 33 . N parsed_6e98 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.00 98.66 . " A" 32 . C " A" 33 . N " A" 33 . CA " A" 33 . C parsed_6e98 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10.00 71.08 . " A" 33 . N " A" 33 . CA " A" 33 . C " A" 34 . N parsed_6e98 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -68.40 . " A" 33 . C " A" 34 . N " A" 34 . CA " A" 34 . C parsed_6e98 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 169.12 . " A" 34 . N " A" 34 . CA " A" 34 . C " A" 35 . N parsed_6e98 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -36.94 . " A" 34 . C " A" 35 . N " A" 35 . CA " A" 35 . C parsed_6e98 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 164.36 . " A" 35 . N " A" 35 . CA " A" 35 . C " A" 36 . N parsed_6e98 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -56.28 . " A" 35 . C " A" 36 . N " A" 36 . CA " A" 36 . C parsed_6e98 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 197.80 . " A" 36 . N " A" 36 . CA " A" 36 . C " A" 37 . N parsed_6e98 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.14 . " A" 36 . C " A" 37 . N " A" 37 . CA " A" 37 . C parsed_6e98 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 9.46 . " A" 37 . N " A" 37 . CA " A" 37 . C " A" 38 . N parsed_6e98 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -43.66 . " A" 37 . C " A" 38 . N " A" 38 . CA " A" 38 . C parsed_6e98 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 204.84 . " A" 38 . N " A" 38 . CA " A" 38 . C " A" 39 . N parsed_6e98 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -50.00 . " A" 38 . C " A" 39 . N " A" 39 . CA " A" 39 . C parsed_6e98 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 40.00 . " A" 39 . N " A" 39 . CA " A" 39 . C " A" 40 . N parsed_6e98 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -50.24 . " A" 39 . C " A" 40 . N " A" 40 . CA " A" 40 . C parsed_6e98 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 19.92 . " A" 40 . N " A" 40 . CA " A" 40 . C " A" 41 . N parsed_6e98 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -50.00 . " A" 40 . C " A" 41 . N " A" 41 . CA " A" 41 . C parsed_6e98 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.00 180.00 . " A" 41 . N " A" 41 . CA " A" 41 . C " A" 42 . N parsed_6e98 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -70.00 . " A" 41 . C " A" 42 . N " A" 42 . CA " A" 42 . C parsed_6e98 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 140.00 . " A" 42 . N " A" 42 . CA " A" 42 . C " A" 43 . N parsed_6e98 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -100.00 . " A" 42 . C " A" 43 . N " A" 43 . CA " A" 43 . C parsed_6e98 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 180.00 . " A" 43 . N " A" 43 . CA " A" 43 . C " A" 44 . N parsed_6e98 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -60.66 . " A" 43 . C " A" 44 . N " A" 44 . CA " A" 44 . C parsed_6e98 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 180.62 . " A" 44 . N " A" 44 . CA " A" 44 . C " A" 45 . N parsed_6e98 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 20.00 . " A" 44 . C " A" 45 . N " A" 45 . CA " A" 45 . C parsed_6e98 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 203.68 . " A" 45 . N " A" 45 . CA " A" 45 . C " A" 46 . N parsed_6e98 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.00 100.00 . " A" 45 . C " A" 46 . N " A" 46 . CA " A" 46 . C parsed_6e98 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.00 90.00 . " A" 46 . N " A" 46 . CA " A" 46 . C " A" 47 . N parsed_6e98 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -100.00 . " A" 46 . C " A" 47 . N " A" 47 . CA " A" 47 . C parsed_6e98 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.00 . " A" 47 . N " A" 47 . CA " A" 47 . C " A" 48 . N parsed_6e98 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -50.12 . " A" 47 . C " A" 48 . N " A" 48 . CA " A" 48 . C parsed_6e98 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 190.00 . " A" 48 . N " A" 48 . CA " A" 48 . C " A" 49 . N parsed_6e98 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -24.02 . " A" 48 . C " A" 49 . N " A" 49 . CA " A" 49 . C parsed_6e98 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 162.28 . " A" 49 . N " A" 49 . CA " A" 49 . C " A" 50 . N parsed_6e98 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -5.00 . " A" 49 . C " A" 50 . N " A" 50 . CA " A" 50 . C parsed_6e98 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 169.44 . " A" 50 . N " A" 50 . CA " A" 50 . C " A" 51 . N parsed_6e98 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -13.64 . " A" 51 . C " A" 52 . N " A" 52 . CA " A" 52 . C parsed_6e98 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 175.98 . " A" 52 . N " A" 52 . CA " A" 52 . C " A" 53 . N parsed_6e98 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -27.00 . " A" 55 . C " A" 56 . N " A" 56 . CA " A" 56 . C parsed_6e98 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 22.16 . " A" 56 . N " A" 56 . CA " A" 56 . C " A" 57 . N parsed_6e98 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -49.18 . " A" 57 . C " A" 58 . N " A" 58 . CA " A" 58 . C parsed_6e98 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 17.64 . " A" 58 . N " A" 58 . CA " A" 58 . C " A" 59 . N parsed_6e98 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -79.48 . " A" 58 . C " A" 59 . N " A" 59 . CA " A" 59 . C parsed_6e98 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 207.04 . " A" 59 . N " A" 59 . CA " A" 59 . C " A" 60 . N parsed_6e98 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -88.12 . " A" 61 . C " A" 62 . N " A" 62 . CA " A" 62 . C parsed_6e98 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 157.34 . " A" 62 . N " A" 62 . CA " A" 62 . C " A" 63 . N parsed_6e98 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -87.32 . " A" 62 . C " A" 63 . N " A" 63 . CA " A" 63 . C parsed_6e98 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 151.02 . " A" 63 . N " A" 63 . CA " A" 63 . C " A" 64 . N parsed_6e98 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -98.58 . " A" 63 . C " A" 64 . N " A" 64 . CA " A" 64 . C parsed_6e98 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 187.26 . " A" 64 . N " A" 64 . CA " A" 64 . C " A" 65 . N parsed_6e98 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -81.04 . " A" 64 . C " A" 65 . N " A" 65 . CA " A" 65 . C parsed_6e98 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.00 . " A" 65 . N " A" 65 . CA " A" 65 . C " A" 66 . N parsed_6e98 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -72.34 . " A" 65 . C " A" 66 . N " A" 66 . CA " A" 66 . C parsed_6e98 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 186.74 . " A" 66 . N " A" 66 . CA " A" 66 . C " A" 67 . N parsed_6e98 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -40.00 . " A" 66 . C " A" 67 . N " A" 67 . CA " A" 67 . C parsed_6e98 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 20.00 . " A" 67 . N " A" 67 . CA " A" 67 . C " A" 68 . N parsed_6e98 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -39.52 . " A" 67 . C " A" 68 . N " A" 68 . CA " A" 68 . C parsed_6e98 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 180.60 . " A" 68 . N " A" 68 . CA " A" 68 . C " A" 69 . N parsed_6e98 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -29.68 . " A" 68 . C " A" 69 . N " A" 69 . CA " A" 69 . C parsed_6e98 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 24.86 . " A" 69 . N " A" 69 . CA " A" 69 . C " A" 70 . N parsed_6e98 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -40.00 . " A" 69 . C " A" 70 . N " A" 70 . CA " A" 70 . C parsed_6e98 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.00 110.00 . " A" 70 . N " A" 70 . CA " A" 70 . C " A" 71 . N parsed_6e98 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -27.40 . " A" 70 . C " A" 71 . N " A" 71 . CA " A" 71 . C parsed_6e98 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 174.50 . " A" 71 . N " A" 71 . CA " A" 71 . C " A" 72 . N parsed_6e98 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.00 -55.00 . " A" 71 . C " A" 72 . N " A" 72 . CA " A" 72 . C parsed_6e98 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 10.00 . " A" 72 . N " A" 72 . CA " A" 72 . C " A" 73 . N parsed_6e98 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.00 126.36 . " A" 72 . C " A" 73 . N " A" 73 . CA " A" 73 . C parsed_6e98 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 55.92 . " A" 73 . N " A" 73 . CA " A" 73 . C " A" 74 . N parsed_6e98 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -100.00 . " A" 73 . C " A" 74 . N " A" 74 . CA " A" 74 . C parsed_6e98 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 30.00 . " A" 74 . N " A" 74 . CA " A" 74 . C " A" 75 . N parsed_6e98 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -80.32 . " A" 75 . C " A" 76 . N " A" 76 . CA " A" 76 . C parsed_6e98 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.54 . " A" 76 . N " A" 76 . CA " A" 76 . C " A" 77 . N parsed_6e98 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -98.02 . " A" 76 . C " A" 77 . N " A" 77 . CA " A" 77 . C parsed_6e98 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 164.52 . " A" 77 . N " A" 77 . CA " A" 77 . C " A" 78 . N parsed_6e98 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.00 100.00 . " A" 77 . C " A" 78 . N " A" 78 . CA " A" 78 . C parsed_6e98 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 10.00 90.00 . " A" 78 . N " A" 78 . CA " A" 78 . C " A" 79 . N parsed_6e98 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -99.94 . " A" 78 . C " A" 79 . N " A" 79 . CA " A" 79 . C parsed_6e98 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.00 179.90 . " A" 79 . N " A" 79 . CA " A" 79 . C " A" 80 . N parsed_6e98 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -61.28 . " A" 79 . C " A" 80 . N " A" 80 . CA " A" 80 . C parsed_6e98 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 211.34 . " A" 80 . N " A" 80 . CA " A" 80 . C " A" 81 . N parsed_6e98 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -17.92 . " A" 80 . C " A" 81 . N " A" 81 . CA " A" 81 . C parsed_6e98 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 189.04 . " A" 81 . N " A" 81 . CA " A" 81 . C " A" 82 . N parsed_6e98 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -66.00 . " A" 81 . C " A" 82 . N " A" 82 . CA " A" 82 . C parsed_6e98 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 159.24 . " A" 82 . N " A" 82 . CA " A" 82 . C " A" 83 . N parsed_6e98 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 "# Restraints file 3: dihedrals.tbl" 1 1 1 34 parsed_6e98 1
stop_
save_
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