Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
41951 | 1xoy RC | 6341 | cing | 2-parsed | STAR | dihedral angle | 174 |
data_1xoy_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1xoy
_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_1xoy 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1xoy
_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 1xoy "Master copy" parsed_1xoy
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1xoy
_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 1xoy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1xoy 1
1 1xoy.mr . . XPLOR/CNS 2 distance NOE simple 2876 parsed_1xoy 1
1 1xoy.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 174 parsed_1xoy 1
1 1xoy.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1xoy 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1xoy
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.000 -55.890 . " " 8 . c " " 9 . n " " 9 . ca " " 9 . c parsed_1xoy 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.020 157.430 . " " 9 . n " " 9 . ca " " 9 . c " " 10 . n parsed_1xoy 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.10 -79.16 . " " 12 . c " " 13 . n " " 13 . ca " " 13 . c parsed_1xoy 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.7 -107.3 . " " 13 . c " " 14 . n " " 14 . ca " " 14 . c parsed_1xoy 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.560 169.370 . " " 14 . n " " 14 . ca " " 14 . c " " 15 . n parsed_1xoy 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.00 -59.72 . " " 14 . c " " 15 . n " " 15 . ca " " 15 . c parsed_1xoy 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.63 -51.77 . " " 16 . c " " 17 . n " " 17 . ca " " 17 . c parsed_1xoy 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.890 -15.840 . " " 17 . n " " 17 . ca " " 17 . c " " 18 . n parsed_1xoy 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.81 -51.49 . " " 17 . c " " 18 . n " " 18 . ca " " 18 . c parsed_1xoy 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.95 8.79 . " " 18 . n " " 18 . ca " " 18 . c " " 19 . n parsed_1xoy 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.90 -54.20 . " " 22 . c " " 23 . n " " 23 . ca " " 23 . c parsed_1xoy 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.67 10.31 . " " 23 . n " " 23 . ca " " 23 . c " " 24 . n parsed_1xoy 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.2 -113.2 . " " 25 . c " " 26 . n " " 26 . ca " " 26 . c parsed_1xoy 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.820 165.810 . " " 26 . n " " 26 . ca " " 26 . c " " 27 . n parsed_1xoy 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.400 -80.150 . " " 26 . c " " 27 . n " " 27 . ca " " 27 . c parsed_1xoy 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.66 139.86 . " " 27 . n " " 27 . ca " " 27 . c " " 28 . n parsed_1xoy 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91 -51 . " " 31 . c " " 32 . n " " 32 . ca " " 32 . c parsed_1xoy 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.67 15.31 . " " 32 . n " " 32 . ca " " 32 . c " " 33 . n parsed_1xoy 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.10 -63.76 . " " 33 . c " " 34 . n " " 34 . ca " " 34 . c parsed_1xoy 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.430 162.820 . " " 34 . n " " 34 . ca " " 34 . c " " 35 . n parsed_1xoy 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.000 -57.610 . " " 34 . c " " 35 . n " " 35 . ca " " 35 . c parsed_1xoy 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.270 191.240 . " " 35 . n " " 35 . ca " " 35 . c " " 36 . n parsed_1xoy 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.510 -3.280 . " " 37 . n " " 37 . ca " " 37 . c " " 38 . n parsed_1xoy 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48 12 . " " 38 . n " " 38 . ca " " 38 . c " " 39 . n parsed_1xoy 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.2 -105.4 . " " 39 . c " " 40 . n " " 40 . ca " " 40 . c parsed_1xoy 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.60 -80.28 . " " 40 . c " " 41 . n " " 41 . ca " " 41 . c parsed_1xoy 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.75 158.69 . " " 41 . n " " 41 . ca " " 41 . c " " 42 . n parsed_1xoy 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.000 -35.690 . " " 41 . c " " 42 . n " " 42 . ca " " 42 . c parsed_1xoy 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.11 160.01 . " " 42 . n " " 42 . ca " " 42 . c " " 43 . n parsed_1xoy 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -18.0 . " " 43 . n " " 43 . ca " " 43 . c " " 44 . n parsed_1xoy 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.35 -49.21 . " " 43 . c " " 44 . n " " 44 . ca " " 44 . c parsed_1xoy 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.610 -11.200 . " " 44 . n " " 44 . ca " " 44 . c " " 45 . n parsed_1xoy 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.820 -58.930 . " " 46 . c " " 47 . n " " 47 . ca " " 47 . c parsed_1xoy 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 86.05 162.57 . " " 47 . n " " 47 . ca " " 47 . c " " 48 . n parsed_1xoy 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.300 -72.710 . " " 49 . c " " 50 . n " " 50 . ca " " 50 . c parsed_1xoy 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.08 185.16 . " " 50 . n " " 50 . ca " " 50 . c " " 51 . n parsed_1xoy 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.30 -76.28 . " " 50 . c " " 51 . n " " 51 . ca " " 51 . c parsed_1xoy 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.82 165.44 . " " 51 . n " " 51 . ca " " 51 . c " " 52 . n parsed_1xoy 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.10 -78.62 . " " 51 . c " " 52 . n " " 52 . ca " " 52 . c parsed_1xoy 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.960 141.070 . " " 52 . n " " 52 . ca " " 52 . c " " 53 . n parsed_1xoy 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.60 -99.06 . " " 52 . c " " 53 . n " " 53 . ca " " 53 . c parsed_1xoy 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.880 168.950 . " " 53 . n " " 53 . ca " " 53 . c " " 54 . n parsed_1xoy 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.00 -116.70 . " " 59 . c " " 60 . n " " 60 . ca " " 60 . c parsed_1xoy 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.83 170.17 . " " 60 . n " " 60 . ca " " 60 . c " " 61 . n parsed_1xoy 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.80 -85.42 . " " 60 . c " " 61 . n " " 61 . ca " " 61 . c parsed_1xoy 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.580 151.550 . " " 61 . n " " 61 . ca " " 61 . c " " 62 . n parsed_1xoy 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.7 -102.1 . " " 61 . c " " 62 . n " " 62 . ca " " 62 . c parsed_1xoy 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.890 155.360 . " " 62 . n " " 62 . ca " " 62 . c " " 63 . n parsed_1xoy 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.5 -80.3 . " " 62 . c " " 63 . n " " 63 . ca " " 63 . c parsed_1xoy 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.57 141.99 . " " 63 . n " " 63 . ca " " 63 . c " " 64 . n parsed_1xoy 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.70 -103.00 . " " 63 . c " " 64 . n " " 64 . ca " " 64 . c parsed_1xoy 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.990 150.060 . " " 64 . n " " 64 . ca " " 64 . c " " 65 . n parsed_1xoy 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.600 -64.350 . " " 65 . c " " 66 . n " " 66 . ca " " 66 . c parsed_1xoy 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.950 161.820 . " " 66 . n " " 66 . ca " " 66 . c " " 67 . n parsed_1xoy 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.7 -124.3 . " " 67 . c " " 68 . n " " 68 . ca " " 68 . c parsed_1xoy 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139.340 177.530 . " " 68 . n " " 68 . ca " " 68 . c " " 69 . n parsed_1xoy 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.20 -61.78 . " " 68 . c " " 69 . n " " 69 . ca " " 69 . c parsed_1xoy 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.28 143.18 . " " 69 . n " " 69 . ca " " 69 . c " " 70 . n parsed_1xoy 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.40 -98.38 . " " 69 . c " " 70 . n " " 70 . ca " " 70 . c parsed_1xoy 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128.92 171.70 . " " 70 . n " " 70 . ca " " 70 . c " " 71 . n parsed_1xoy 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.40 -78.34 . " " 70 . c " " 71 . n " " 71 . ca " " 71 . c parsed_1xoy 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.790 150.840 . " " 71 . n " " 71 . ca " " 71 . c " " 72 . n parsed_1xoy 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.600 -58.270 . " " 71 . c " " 72 . n " " 72 . ca " " 72 . c parsed_1xoy 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.740 157.510 . " " 72 . n " " 72 . ca " " 72 . c " " 73 . n parsed_1xoy 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.3 -117.9 . " " 74 . c " " 75 . n " " 75 . ca " " 75 . c parsed_1xoy 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.080 158.890 . " " 75 . n " " 75 . ca " " 75 . c " " 76 . n parsed_1xoy 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.500 -90.190 . " " 75 . c " " 76 . n " " 76 . ca " " 76 . c parsed_1xoy 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.530 172.100 . " " 76 . n " " 76 . ca " " 76 . c " " 77 . n parsed_1xoy 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.30 -101.20 . " " 76 . c " " 77 . n " " 77 . ca " " 77 . c parsed_1xoy 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.550 167.260 . " " 77 . n " " 77 . ca " " 77 . c " " 78 . n parsed_1xoy 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.000 -88.910 . " " 77 . c " " 78 . n " " 78 . ca " " 78 . c parsed_1xoy 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.130 170.340 . " " 78 . n " " 78 . ca " " 78 . c " " 79 . n parsed_1xoy 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.870 -40.900 . " " 80 . c " " 81 . n " " 81 . ca " " 81 . c parsed_1xoy 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.640 -27.350 . " " 81 . n " " 81 . ca " " 81 . c " " 82 . n parsed_1xoy 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.00 -48.22 . " " 81 . c " " 82 . n " " 82 . ca " " 82 . c parsed_1xoy 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.00 -7.78 . " " 82 . n " " 82 . ca " " 82 . c " " 83 . n parsed_1xoy 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.10 -61.36 . " " 82 . c " " 83 . n " " 83 . ca " " 83 . c parsed_1xoy 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.69 37.55 . " " 83 . n " " 83 . ca " " 83 . c " " 84 . n parsed_1xoy 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 27.890 299.660 . " " 83 . c " " 84 . n " " 84 . ca " " 84 . c parsed_1xoy 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -313.900 -19.510 . " " 84 . n " " 84 . ca " " 84 . c " " 85 . n parsed_1xoy 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.470 178.820 . " " 85 . n " " 85 . ca " " 85 . c " " 86 . n parsed_1xoy 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.20 -91.76 . " " 87 . c " " 88 . n " " 88 . ca " " 88 . c parsed_1xoy 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.72 145.22 . " " 88 . n " " 88 . ca " " 88 . c " " 89 . n parsed_1xoy 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.4 -94.0 . " " 88 . c " " 89 . n " " 89 . ca " " 89 . c parsed_1xoy 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.300 170.750 . " " 89 . n " " 89 . ca " " 89 . c " " 90 . n parsed_1xoy 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.000 -92.590 . " " 90 . c " " 91 . n " " 91 . ca " " 91 . c parsed_1xoy 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.96 160.16 . " " 91 . n " " 91 . ca " " 91 . c " " 92 . n parsed_1xoy 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101.40 -55.56 . " " 94 . c " " 95 . n " " 95 . ca " " 95 . c parsed_1xoy 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.840 174.850 . " " 95 . n " " 95 . ca " " 95 . c " " 96 . n parsed_1xoy 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.82 -47.56 . " " 98 . c " " 99 . n " " 99 . ca " " 99 . c parsed_1xoy 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.620 -17.250 . " " 99 . n " " 99 . ca " " 99 . c " " 100 . n parsed_1xoy 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.330 -59.600 . " " 101 . c " " 102 . n " " 102 . ca " " 102 . c parsed_1xoy 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.48 2.48 . " " 102 . n " " 102 . ca " " 102 . c " " 103 . n parsed_1xoy 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.50 -97.34 . " " 104 . c " " 105 . n " " 105 . ca " " 105 . c parsed_1xoy 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.20 169.10 . " " 105 . n " " 105 . ca " " 105 . c " " 106 . n parsed_1xoy 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.30 162.56 . " " 106 . n " " 106 . ca " " 106 . c " " 107 . n parsed_1xoy 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.90 -52.84 . " " 107 . c " " 108 . n " " 108 . ca " " 108 . c parsed_1xoy 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.630 -20.840 . " " 108 . n " " 108 . ca " " 108 . c " " 109 . n parsed_1xoy 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.10 -83.88 . " " 109 . c " " 110 . n " " 110 . ca " " 110 . c parsed_1xoy 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.33 157.99 . " " 110 . n " " 110 . ca " " 110 . c " " 111 . n parsed_1xoy 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.70 -109.40 . " " 110 . c " " 111 . n " " 111 . ca " " 111 . c parsed_1xoy 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.300 171.570 . " " 111 . n " " 111 . ca " " 111 . c " " 112 . n parsed_1xoy 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125.00 -81.02 . " " 111 . c " " 112 . n " " 112 . ca " " 112 . c parsed_1xoy 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.820 137.630 . " " 112 . n " " 112 . ca " " 112 . c " " 113 . n parsed_1xoy 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.700 -61.930 . " " 112 . c " " 113 . n " " 113 . ca " " 113 . c parsed_1xoy 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.570 157.340 . " " 113 . n " " 113 . ca " " 113 . c " " 114 . n parsed_1xoy 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.10 -62.24 . " " 113 . c " " 114 . n " " 114 . ca " " 114 . c parsed_1xoy 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 158.360 183.230 . " " 114 . n " " 114 . ca " " 114 . c " " 115 . n parsed_1xoy 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.680 -52.270 . " " 114 . c " " 115 . n " " 115 . ca " " 115 . c parsed_1xoy 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.440 -23.450 . " " 115 . n " " 115 . ca " " 115 . c " " 116 . n parsed_1xoy 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.850 -56.420 . " " 115 . c " " 116 . n " " 116 . ca " " 116 . c parsed_1xoy 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.010 -32.720 . " " 116 . n " " 116 . ca " " 116 . c " " 117 . n parsed_1xoy 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.830 -60.420 . " " 116 . c " " 117 . n " " 117 . ca " " 117 . c parsed_1xoy 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.050 -26.200 . " " 117 . n " " 117 . ca " " 117 . c " " 118 . n parsed_1xoy 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.290 -58.060 . " " 117 . c " " 118 . n " " 118 . ca " " 118 . c parsed_1xoy 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.36 2.02 . " " 118 . n " " 118 . ca " " 118 . c " " 119 . n parsed_1xoy 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.400 -79.470 . " " 118 . c " " 119 . n " " 119 . ca " " 119 . c parsed_1xoy 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -13.690 31.040 . " " 119 . n " " 119 . ca " " 119 . c " " 120 . n parsed_1xoy 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.9 -75.5 . " " 120 . c " " 121 . n " " 121 . ca " " 121 . c parsed_1xoy 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.95 155.09 . " " 121 . n " " 121 . ca " " 121 . c " " 122 . n parsed_1xoy 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.340 155.010 . " " 122 . n " " 122 . ca " " 122 . c " " 123 . n parsed_1xoy 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.90 -71.38 . " " 122 . c " " 123 . n " " 123 . ca " " 123 . c parsed_1xoy 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.14 150.40 . " " 123 . n " " 123 . ca " " 123 . c " " 124 . n parsed_1xoy 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.00 -62.12 . " " 123 . c " " 124 . n " " 124 . ca " " 124 . c parsed_1xoy 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.960 148.130 . " " 124 . n " " 124 . ca " " 124 . c " " 125 . n parsed_1xoy 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.87 -48.99 . " " 127 . c " " 128 . n " " 128 . ca " " 128 . c parsed_1xoy 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.37 4.69 . " " 128 . n " " 128 . ca " " 128 . c " " 129 . n parsed_1xoy 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.90 -64.18 . " " 128 . c " " 129 . n " " 129 . ca " " 129 . c parsed_1xoy 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.02 25.10 . " " 129 . n " " 129 . ca " " 129 . c " " 130 . n parsed_1xoy 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.600 -63.230 . " " 130 . c " " 131 . n " " 131 . ca " " 131 . c parsed_1xoy 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.340 156.450 . " " 132 . n " " 132 . ca " " 132 . c " " 133 . n parsed_1xoy 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.50 -59.24 . " " 132 . c " " 133 . n " " 133 . ca " " 133 . c parsed_1xoy 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.65 137.29 . " " 133 . n " " 133 . ca " " 133 . c " " 134 . n parsed_1xoy 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -187.20 -93.64 . " " 134 . c " " 135 . n " " 135 . ca " " 135 . c parsed_1xoy 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.770 171.480 . " " 135 . n " " 135 . ca " " 135 . c " " 136 . n parsed_1xoy 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.4 -120.0 . " " 135 . c " " 136 . n " " 136 . ca " " 136 . c parsed_1xoy 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.670 168.140 . " " 136 . n " " 136 . ca " " 136 . c " " 137 . n parsed_1xoy 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.500 -81.430 . " " 136 . c " " 137 . n " " 137 . ca " " 137 . c parsed_1xoy 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.680 151.210 . " " 137 . n " " 137 . ca " " 137 . c " " 138 . n parsed_1xoy 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.50 -105.00 . " " 137 . c " " 138 . n " " 138 . ca " " 138 . c parsed_1xoy 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.77 149.79 . " " 138 . n " " 138 . ca " " 138 . c " " 139 . n parsed_1xoy 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.400 -91.230 . " " 138 . c " " 139 . n " " 139 . ca " " 139 . c parsed_1xoy 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.000 145.370 . " " 139 . n " " 139 . ca " " 139 . c " " 140 . n parsed_1xoy 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.00 -89.56 . " " 139 . c " " 140 . n " " 140 . ca " " 140 . c parsed_1xoy 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.080 144.990 . " " 140 . n " " 140 . ca " " 140 . c " " 141 . n parsed_1xoy 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.100 -62.690 . " " 142 . c " " 143 . n " " 143 . ca " " 143 . c parsed_1xoy 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.52 184.98 . " " 143 . n " " 143 . ca " " 143 . c " " 144 . n parsed_1xoy 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.900 -76.490 . " " 144 . c " " 145 . n " " 145 . ca " " 145 . c parsed_1xoy 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.22 29.84 . " " 145 . n " " 145 . ca " " 145 . c " " 146 . n parsed_1xoy 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.600 -84.750 . " " 146 . c " " 147 . n " " 147 . ca " " 147 . c parsed_1xoy 1
151 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -6.30 15.24 . " " 147 . n " " 147 . ca " " 147 . c " " 148 . n parsed_1xoy 1
152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.8 -102.8 . " " 148 . c " " 149 . n " " 149 . ca " " 149 . c parsed_1xoy 1
153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.080 182.170 . " " 149 . n " " 149 . ca " " 149 . c " " 150 . n parsed_1xoy 1
154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.10 -82.76 . " " 149 . c " " 150 . n " " 150 . ca " " 150 . c parsed_1xoy 1
155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.840 137.850 . " " 150 . n " " 150 . ca " " 150 . c " " 151 . n parsed_1xoy 1
156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.50 -86.06 . " " 150 . c " " 151 . n " " 151 . ca " " 151 . c parsed_1xoy 1
157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.450 167.320 . " " 151 . n " " 151 . ca " " 151 . c " " 152 . n parsed_1xoy 1
158 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.00 -101.90 . " " 151 . c " " 152 . n " " 152 . ca " " 152 . c parsed_1xoy 1
159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.240 147.330 . " " 152 . n " " 152 . ca " " 152 . c " " 153 . n parsed_1xoy 1
160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.20 -127.10 . " " 153 . c " " 154 . n " " 154 . ca " " 154 . c parsed_1xoy 1
161 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.240 174.970 . " " 154 . n " " 154 . ca " " 154 . c " " 155 . n parsed_1xoy 1
162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.70 -97.38 . " " 154 . c " " 155 . n " " 155 . ca " " 155 . c parsed_1xoy 1
163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.36 153.88 . " " 155 . n " " 155 . ca " " 155 . c " " 156 . n parsed_1xoy 1
164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.3 -102.5 . " " 155 . c " " 156 . n " " 156 . ca " " 156 . c parsed_1xoy 1
165 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.560 160.770 . " " 156 . n " " 156 . ca " " 156 . c " " 157 . n parsed_1xoy 1
166 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.800 -80.650 . " " 156 . c " " 157 . n " " 157 . ca " " 157 . c parsed_1xoy 1
167 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.75 171.07 . " " 157 . n " " 157 . ca " " 157 . c " " 158 . n parsed_1xoy 1
168 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.100 -96.430 . " " 157 . c " " 158 . n " " 158 . ca " " 158 . c parsed_1xoy 1
169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.980 166.190 . " " 158 . n " " 158 . ca " " 158 . c " " 159 . n parsed_1xoy 1
170 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -214.60 -103.70 . " " 158 . c " " 159 . n " " 159 . ca " " 159 . c parsed_1xoy 1
171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.37 220.87 . " " 159 . n " " 159 . ca " " 159 . c " " 160 . n parsed_1xoy 1
172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -164.50 -87.76 . " " 159 . c " " 160 . n " " 160 . ca " " 160 . c parsed_1xoy 1
173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.50 -88.62 . " " 89 . c " " 90 . n " " 90 . ca " " 90 . c parsed_1xoy 1
174 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.06 166.36 . " " 90 . n " " 90 . ca " " 90 . c " " 91 . n parsed_1xoy 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 "following are the dihedral constraints" 2 1 2 41 parsed_1xoy 1
stop_
save_