NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
572493 |
2mgr   |
19234 | cing | 2-parsed | STAR | dihedral angle | 106 |
data_2mgr_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mgr
_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_2mgr 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mgr
_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 2mgr "Master copy" parsed_2mgr
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mgr
_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 2mgr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mgr 1
1 2mgr.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 12 parsed_2mgr 1
1 2mgr.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 106 parsed_2mgr 1
1 2mgr.mr . . XPLOR/CNS 4 distance NOE ambi 0 parsed_2mgr 1
1 2mgr.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mgr 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2mgr
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.24 -56.20 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_2mgr 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.26 -40.82 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_2mgr 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.75 -46.35 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2mgr 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.30 -64.78 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2mgr 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.21 -104.37 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2mgr 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.90 -44.58 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2mgr 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.21 -74.17 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2mgr 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.48 -49.72 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2mgr 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.25 -71.21 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2mgr 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.21 -99.77 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2mgr 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.30 -95.46 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2mgr 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.91 -95.99 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2mgr 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.58 -66.14 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2mgr 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.74 -47.34 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2mgr 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.53 -66.81 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2mgr 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.27 -74.99 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2mgr 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.85 -88.01 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2mgr 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.36 -89.12 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2mgr 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.19 -104.67 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2mgr 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.77 -119.89 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2mgr 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -171.61 -93.37 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2mgr 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -187.21 -116.05 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2mgr 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.38 -51.42 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_2mgr 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.32 -113.28 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2mgr 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.63 -106.63 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2mgr 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.99 -107.51 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2mgr 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.87 -45.15 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2mgr 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.67 -75.67 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2mgr 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.00 -86.20 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2mgr 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.60 -114.36 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2mgr 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -171.79 -106.11 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2mgr 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.61 -47.69 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2mgr 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.49 -63.37 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2mgr 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.37 -52.05 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2mgr 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.68 -76.60 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2mgr 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.68 -83.92 . . 65 . C . 66 . N . 66 . CA . 66 . C parsed_2mgr 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.50 -75.02 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2mgr 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -174.95 -79.83 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_2mgr 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -176.81 -55.17 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2mgr 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.31 -46.95 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_2mgr 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -107.10 -47.02 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2mgr 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.93 -79.33 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_2mgr 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.99 -70.99 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_2mgr 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.86 -92.02 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2mgr 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.26 -67.02 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_2mgr 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.02 -90.70 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2mgr 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -178.75 -69.47 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_2mgr 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -184.93 -71.97 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2mgr 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.86 -57.66 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_2mgr 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.13 -46.25 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_2mgr 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -182.57 -70.13 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2mgr 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.05 -102.57 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_2mgr 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.16 -101.56 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_2mgr 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.16 170.76 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_2mgr 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.33 -5.97 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_2mgr 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.19 0.97 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2mgr 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27.87 26.25 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2mgr 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.73 184.09 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2mgr 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.98 -7.42 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2mgr 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -18.06 17.50 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2mgr 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 83.67 163.27 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2mgr 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.06 155.58 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2mgr 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.65 141.49 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2mgr 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.74 150.38 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2mgr 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.69 143.33 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2mgr 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.42 208.50 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2mgr 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.18 -6.82 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2mgr 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27.93 23.07 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2mgr 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.30 154.94 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2mgr 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.29 166.53 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2mgr 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.63 165.99 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2mgr 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.33 162.45 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2mgr 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.50 175.58 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2mgr 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.40 182.60 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2mgr 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.98 180.62 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2mgr 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.94 128.18 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_2mgr 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.46 188.46 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2mgr 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.87 179.15 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2mgr 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 132.66 178.42 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2mgr 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.14 160.94 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2mgr 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.56 147.88 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2mgr 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.08 194.76 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2mgr 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.51 173.35 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_2mgr 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.16 176.84 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2mgr 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.37 -13.53 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2mgr 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.48 17.00 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2mgr 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.52 146.32 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2mgr 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.06 155.26 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2mgr 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.34 151.46 . . 66 . N . 66 . CA . 66 . C . 67 . N parsed_2mgr 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.36 141.60 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_2mgr 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.11 163.71 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_2mgr 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 62.58 152.86 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_2mgr 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.83 -3.55 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_2mgr 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.69 10.63 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_2mgr 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.33 162.61 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2mgr 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.66 148.74 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_2mgr 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.74 170.58 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_2mgr 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 92.88 152.80 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_2mgr 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.44 180.16 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_2mgr 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.60 183.72 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_2mgr 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.78 172.30 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_2mgr 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.16 180.08 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_2mgr 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.89 -17.77 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_2mgr 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.34 190.50 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_2mgr 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.06 165.98 . . 95 . N . 95 . CA . 95 . C . 96 . N parsed_2mgr 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.80 173.16 . . 96 . N . 96 . CA . 96 . C . 97 . N parsed_2mgr 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 "1. D 3 Phi -85.72 +/- 29.52 (-115.24 to -56.20)" 1 1 1 50 parsed_2mgr 1
2 "2. P 4 Phi -57.04 +/- 16.22 (-73.26 to -40.82)" 6 1 6 49 parsed_2mgr 1
3 "3. K 5 Phi -60.05 +/- 13.70 (-73.75 to -46.35)" 11 1 11 49 parsed_2mgr 1
4 "4. H 6 Phi -89.04 +/- 24.26 (-113.30 to -64.78)" 16 1 16 50 parsed_2mgr 1
5 "5. C 8 Phi -128.79 +/- 24.42 (-153.21 to -104.37)" 21 1 21 52 parsed_2mgr 1
6 "6. R 12 Phi -65.24 +/- 20.66 (-85.90 to -44.58)" 26 1 26 50 parsed_2mgr 1
7 "7. D 13 Phi -94.69 +/- 20.52 (-115.21 to -74.17)" 31 1 31 51 parsed_2mgr 1
8 "8. I 14 Phi -91.10 +/- 41.38 (-132.48 to -49.72)" 36 1 36 51 parsed_2mgr 1
9 "9. G 19 Phi -108.23 +/- 37.02 (-145.25 to -71.21)" 41 1 41 52 parsed_2mgr 1
10 "10. C 20 Phi -130.49 +/- 30.72 (-161.21 to -99.77)" 46 1 46 53 parsed_2mgr 1
11 "11. F 21 Phi -127.88 +/- 32.42 (-160.30 to -95.46)" 51 1 51 53 parsed_2mgr 1
12 "12. R 22 Phi -117.95 +/- 21.96 (-139.91 to -95.99)" 56 1 56 53 parsed_2mgr 1
13 "13. D 23 Phi -96.36 +/- 30.22 (-126.58 to -66.14)" 61 1 61 52 parsed_2mgr 1
14 "14. D 24 Phi -70.04 +/- 22.70 (-92.74 to -47.34)" 66 1 66 51 parsed_2mgr 1
15 "15. D 25 Phi -84.67 +/- 17.86 (-102.53 to -66.81)" 71 1 71 52 parsed_2mgr 1
16 "16. K 28 Phi -113.63 +/- 38.64 (-152.27 to -74.99)" 76 1 76 53 parsed_2mgr 1
17 "17. E 29 Phi -127.93 +/- 39.92 (-167.85 to -88.01)" 81 1 81 53 parsed_2mgr 1
18 "18. W 30 Phi -125.74 +/- 36.62 (-162.36 to -89.12)" 86 1 86 53 parsed_2mgr 1
19 "19. R 31 Phi -133.43 +/- 28.76 (-162.19 to -104.67)" 91 1 91 54 parsed_2mgr 1
20 "20. C 32 Phi -132.33 +/- 12.44 (-144.77 to -119.89)" 96 1 96 54 parsed_2mgr 1
21 "21. Y 36 Phi -132.49 +/- 39.12 (-171.61 to -93.37)" 101 1 101 53 parsed_2mgr 1
22 "22. K 37 Phi -151.63 +/- 35.58 (-187.21 to -116.05)" 106 1 106 54 parsed_2mgr 1
23 "23. K 38 Phi -103.90 +/- 52.48 (-156.38 to -51.42)" 111 1 111 53 parsed_2mgr 1
24 "24. T 43 Phi -141.80 +/- 28.52 (-170.32 to -113.28)" 116 1 116 54 parsed_2mgr 1
25 "25. C 44 Phi -132.13 +/- 25.50 (-157.63 to -106.63)" 121 1 121 54 parsed_2mgr 1
26 "26. V 45 Phi -135.75 +/- 28.24 (-163.99 to -107.51)" 126 1 126 54 parsed_2mgr 1
27 "27. P 50 Phi -71.01 +/- 25.86 (-96.87 to -45.15)" 131 1 131 51 parsed_2mgr 1
28 "28. T 51 Phi -97.17 +/- 21.50 (-118.67 to -75.67)" 136 1 136 52 parsed_2mgr 1
29 "29. C 52 Phi -127.60 +/- 41.40 (-169.00 to -86.20)" 141 1 141 53 parsed_2mgr 1
30 "30. C 59 Phi -131.98 +/- 17.62 (-149.60 to -114.36)" 146 1 146 54 parsed_2mgr 1
31 "31. D 60 Phi -138.95 +/- 32.84 (-171.79 to -106.11)" 151 1 151 54 parsed_2mgr 1
32 "32. P 61 Phi -60.15 +/- 12.46 (-72.61 to -47.69)" 156 1 156 51 parsed_2mgr 1
33 "33. T 62 Phi -96.93 +/- 33.56 (-130.49 to -63.37)" 161 1 161 52 parsed_2mgr 1
34 "34. S 64 Phi -91.71 +/- 39.66 (-131.37 to -52.05)" 166 1 166 52 parsed_2mgr 1
35 "35. C 65 Phi -117.64 +/- 41.04 (-158.68 to -76.60)" 171 1 171 53 parsed_2mgr 1
36 "36. Q 66 Phi -121.30 +/- 37.38 (-158.68 to -83.92)" 176 1 176 53 parsed_2mgr 1
37 "37. N 67 Phi -112.76 +/- 37.74 (-150.50 to -75.02)" 181 1 181 53 parsed_2mgr 1
38 "38. A 68 Phi -127.39 +/- 47.56 (-174.95 to -79.83)" 186 1 186 53 parsed_2mgr 1
39 "39. E 72 Phi -115.99 +/- 60.82 (-176.81 to -55.17)" 191 1 191 53 parsed_2mgr 1
40 "40. N 73 Phi -57.13 +/- 10.18 (-67.31 to -46.95)" 196 1 196 51 parsed_2mgr 1
41 "41. S 74 Phi -77.06 +/- 30.04 (-107.10 to -47.02)" 201 1 201 52 parsed_2mgr 1
42 "42. I 77 Phi -115.63 +/- 36.30 (-151.93 to -79.33)" 206 1 206 53 parsed_2mgr 1
43 "43. I 78 Phi -105.99 +/- 35.00 (-140.99 to -70.99)" 211 1 211 53 parsed_2mgr 1
44 "44. C 79 Phi -114.44 +/- 22.42 (-136.86 to -92.02)" 216 1 216 53 parsed_2mgr 1
45 "45. T 80 Phi -101.14 +/- 34.12 (-135.26 to -67.02)" 221 1 221 53 parsed_2mgr 1
46 "46. C 81 Phi -118.86 +/- 28.16 (-147.02 to -90.70)" 226 1 226 53 parsed_2mgr 1
47 "47. K 82 Phi -124.11 +/- 54.64 (-178.75 to -69.47)" 231 1 231 53 parsed_2mgr 1
48 "48. A 88 Phi -128.45 +/- 56.48 (-184.93 to -71.97)" 236 1 236 53 parsed_2mgr 1
49 "49. Y 89 Phi -95.26 +/- 37.60 (-132.86 to -57.66)" 241 1 241 52 parsed_2mgr 1
50 "50. V 93 Phi -66.19 +/- 19.94 (-86.13 to -46.25)" 246 1 246 51 parsed_2mgr 1
51 "51. F 94 Phi -126.35 +/- 56.22 (-182.57 to -70.13)" 251 1 251 53 parsed_2mgr 1
52 "52. C 95 Phi -125.81 +/- 23.24 (-149.05 to -102.57)" 256 1 256 54 parsed_2mgr 1
53 "53. S 96 Phi -138.36 +/- 36.80 (-175.16 to -101.56)" 261 1 261 54 parsed_2mgr 1
54 "54. D 3 Psi 134.96 +/- 35.80 (99.16 to 170.76)" 267 1 267 49 parsed_2mgr 1
55 "55. P 4 Psi -31.15 +/- 25.18 (-56.33 to -5.97)" 272 1 272 49 parsed_2mgr 1
56 "56. K 5 Psi -26.11 +/- 27.08 (-53.19 to 0.97)" 277 1 277 48 parsed_2mgr 1
57 "57. H 6 Psi -0.81 +/- 27.06 (-27.87 to 26.25)" 282 1 282 48 parsed_2mgr 1
58 "58. C 8 Psi 156.41 +/- 27.68 (128.73 to 184.09)" 287 1 287 50 parsed_2mgr 1
59 "59. R 12 Psi -24.20 +/- 16.78 (-40.98 to -7.42)" 292 1 292 50 parsed_2mgr 1
60 "60. D 13 Psi -0.28 +/- 17.78 (-18.06 to 17.50)" 297 1 297 49 parsed_2mgr 1
61 "61. I 14 Psi 123.47 +/- 39.80 (83.67 to 163.27)" 302 1 302 50 parsed_2mgr 1
62 "62. G 19 Psi 135.32 +/- 20.26 (115.06 to 155.58)" 307 1 307 51 parsed_2mgr 1
63 "63. C 20 Psi 123.07 +/- 18.42 (104.65 to 141.49)" 312 1 312 51 parsed_2mgr 1
64 "64. F 21 Psi 128.56 +/- 21.82 (106.74 to 150.38)" 317 1 317 51 parsed_2mgr 1
65 "65. R 22 Psi 126.01 +/- 17.32 (108.69 to 143.33)" 322 1 322 51 parsed_2mgr 1
66 "66. D 23 Psi 146.96 +/- 61.54 (85.42 to 208.50)" 327 1 327 50 parsed_2mgr 1
67 "67. D 24 Psi -30.50 +/- 23.68 (-54.18 to -6.82)" 332 1 332 50 parsed_2mgr 1
68 "68. D 25 Psi -2.43 +/- 25.50 (-27.93 to 23.07)" 337 1 337 49 parsed_2mgr 1
69 "69. K 28 Psi 133.12 +/- 21.82 (111.30 to 154.94)" 342 1 342 51 parsed_2mgr 1
70 "70. E 29 Psi 153.41 +/- 13.12 (140.29 to 166.53)" 347 1 347 51 parsed_2mgr 1
71 "71. W 30 Psi 144.81 +/- 21.18 (123.63 to 165.99)" 352 1 352 51 parsed_2mgr 1
72 "72. R 31 Psi 139.39 +/- 23.06 (116.33 to 162.45)" 357 1 357 51 parsed_2mgr 1
73 "73. C 32 Psi 149.54 +/- 26.04 (123.50 to 175.58)" 362 1 362 51 parsed_2mgr 1
74 "74. Y 36 Psi 149.00 +/- 33.60 (115.40 to 182.60)" 367 1 367 51 parsed_2mgr 1
75 "75. K 37 Psi 144.80 +/- 35.82 (108.98 to 180.62)" 372 1 372 51 parsed_2mgr 1
76 "76. K 38 Psi 118.56 +/- 9.62 (108.94 to 128.18)" 377 1 377 50 parsed_2mgr 1
77 "77. T 43 Psi 157.46 +/- 31.00 (126.46 to 188.46)" 382 1 382 51 parsed_2mgr 1
78 "78. C 44 Psi 148.01 +/- 31.14 (116.87 to 179.15)" 387 1 387 51 parsed_2mgr 1
79 "79. V 45 Psi 155.54 +/- 22.88 (132.66 to 178.42)" 392 1 392 51 parsed_2mgr 1
80 "80. P 50 Psi 142.04 +/- 18.90 (123.14 to 160.94)" 397 1 397 51 parsed_2mgr 1
81 "81. T 51 Psi 125.22 +/- 22.66 (102.56 to 147.88)" 402 1 402 51 parsed_2mgr 1
82 "82. C 52 Psi 167.42 +/- 27.34 (140.08 to 194.76)" 407 1 407 51 parsed_2mgr 1
83 "83. C 59 Psi 152.43 +/- 20.92 (131.51 to 173.35)" 412 1 412 51 parsed_2mgr 1
84 "84. D 60 Psi 140.00 +/- 36.84 (103.16 to 176.84)" 417 1 417 51 parsed_2mgr 1
85 "85. P 61 Psi -32.45 +/- 18.92 (-51.37 to -13.53)" 422 1 422 51 parsed_2mgr 1
86 "86. T 62 Psi -17.74 +/- 34.74 (-52.48 to 17.00)" 427 1 427 50 parsed_2mgr 1
87 "87. S 64 Psi 123.92 +/- 22.40 (101.52 to 146.32)" 432 1 432 51 parsed_2mgr 1
88 "88. C 65 Psi 130.16 +/- 25.10 (105.06 to 155.26)" 437 1 437 51 parsed_2mgr 1
89 "89. Q 66 Psi 132.40 +/- 19.06 (113.34 to 151.46)" 442 1 442 51 parsed_2mgr 1
90 "90. N 67 Psi 129.48 +/- 12.12 (117.36 to 141.60)" 447 1 447 51 parsed_2mgr 1
91 "91. A 68 Psi 144.41 +/- 19.30 (125.11 to 163.71)" 452 1 452 51 parsed_2mgr 1
92 "92. E 72 Psi 107.72 +/- 45.14 (62.58 to 152.86)" 457 1 457 50 parsed_2mgr 1
93 "93. N 73 Psi -33.69 +/- 30.14 (-63.83 to -3.55)" 462 1 462 50 parsed_2mgr 1
94 "94. S 74 Psi -8.03 +/- 18.66 (-26.69 to 10.63)" 467 1 467 49 parsed_2mgr 1
95 "95. I 77 Psi 138.47 +/- 24.14 (114.33 to 162.61)" 472 1 472 51 parsed_2mgr 1
96 "96. I 78 Psi 122.70 +/- 26.04 (96.66 to 148.74)" 477 1 477 50 parsed_2mgr 1
97 "97. C 79 Psi 139.66 +/- 30.92 (108.74 to 170.58)" 482 1 482 51 parsed_2mgr 1
98 "98. T 80 Psi 122.84 +/- 29.96 (92.88 to 152.80)" 487 1 487 50 parsed_2mgr 1
99 "99. C 81 Psi 152.30 +/- 27.86 (124.44 to 180.16)" 492 1 492 51 parsed_2mgr 1
100 "100. K 82 Psi 157.66 +/- 26.06 (131.60 to 183.72)" 497 1 497 52 parsed_2mgr 1
101 "101. A 88 Psi 140.54 +/- 31.76 (108.78 to 172.30)" 502 1 502 52 parsed_2mgr 1
102 "102. Y 89 Psi 144.12 +/- 35.96 (108.16 to 180.08)" 507 1 507 52 parsed_2mgr 1
103 "103. V 93 Psi -30.83 +/- 13.06 (-43.89 to -17.77)" 512 1 512 52 parsed_2mgr 1
104 "104. F 94 Psi 152.42 +/- 38.08 (114.34 to 190.50)" 517 1 517 52 parsed_2mgr 1
105 "105. C 95 Psi 146.02 +/- 19.96 (126.06 to 165.98)" 522 1 522 52 parsed_2mgr 1
106 "106. S 96 Psi 144.48 +/- 28.68 (115.80 to 173.16)" 527 1 527 52 parsed_2mgr 1
stop_
save_
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