NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
634972 |
6c8u   |
30398 | cing | 2-parsed | STAR | dihedral angle | 148 |
data_6c8u_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6c8u
_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_6c8u 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6c8u
_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 6c8u "Master copy" parsed_6c8u
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6c8u
_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 6c8u.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6c8u 1
1 6c8u.mr . . unknown 2 distance NOE simple 0 parsed_6c8u 1
1 6c8u.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6c8u 1
1 6c8u.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 38 parsed_6c8u 1
1 6c8u.mr . . XPLOR/CNS 5 distance NOE simple 793 parsed_6c8u 1
1 6c8u.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 148 parsed_6c8u 1
1 6c8u.mr . . XPLOR/CNS 7 distance NOE ambi 0 parsed_6c8u 1
1 6c8u.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6c8u 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6c8u
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79 -55 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_6c8u 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92 -48 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_6c8u 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99 -43 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_6c8u 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120 -60 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_6c8u 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167 -79 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_6c8u 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 -92 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_6c8u 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135 -91 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_6c8u 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -166 -78 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_6c8u 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50 100 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_6c8u 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118 -46 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_6c8u 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157 -13 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_6c8u 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74 -50 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_6c8u 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126 -66 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_6c8u 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111 -39 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_6c8u 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -125 -31 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_6c8u 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64 -40 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_6c8u 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79 -55 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_6c8u 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70 -54 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_6c8u 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72 -54 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_6c8u 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78 -50 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_6c8u 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74 -56 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_6c8u 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71 -57 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_6c8u 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70 -52 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_6c8u 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77 -53 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_6c8u 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -55 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_6c8u 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133 -53 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_6c8u 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138 -50 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_6c8u 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142 -26 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_6c8u 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126 -70 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_6c8u 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -115 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_6c8u 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156 -96 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_6c8u 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -174 -86 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_6c8u 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156 -62 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_6c8u 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113 -69 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_6c8u 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137 -77 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_6c8u 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117 -43 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_6c8u 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -81 -49 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_6c8u 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -48 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_6c8u 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129 -69 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_6c8u 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 45 77 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_6c8u 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124 -52 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_6c8u 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -198 42 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_6c8u 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137 -65 . . 65 . C . 66 . N . 66 . CA . 66 . C parsed_6c8u 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 44 92 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_6c8u 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -181 -87 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_6c8u 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -115 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_6c8u 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -174 -98 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_6c8u 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121 -81 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_6c8u 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131 -39 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_6c8u 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105 -53 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_6c8u 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173 -49 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_6c8u 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73 -41 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_6c8u 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77 -53 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_6c8u 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68 -56 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_6c8u 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70 -56 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_6c8u 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72 -52 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_6c8u 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71 -57 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_6c8u 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -46 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_6c8u 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -101 -49 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_6c8u 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133 -49 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_6c8u 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85 -45 . . 85 . C . 86 . N . 86 . CA . 86 . C parsed_6c8u 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -178 -82 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_6c8u 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159 -99 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_6c8u 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175 -103 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_6c8u 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167 -115 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_6c8u 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 44 60 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_6c8u 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 45 89 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_6c8u 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151 -71 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_6c8u 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87 -55 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_6c8u 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131 -91 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_6c8u 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -164 -96 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_6c8u 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82 -54 . . 96 . C . 97 . N . 97 . CA . 97 . C parsed_6c8u 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169 -89 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_6c8u 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124 -36 . . 98 . C . 99 . N . 99 . CA . 99 . C parsed_6c8u 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141 -69 . . 100 . C . 101 . N . 101 . CA . 101 . C parsed_6c8u 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84 -56 . . 101 . C . 102 . N . 102 . CA . 102 . C parsed_6c8u 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 71 203 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_6c8u 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109 151 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_6c8u 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101 143 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_6c8u 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106 150 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_6c8u 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110 222 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_6c8u 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 21 65 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_6c8u 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131 171 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_6c8u 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 88 174 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_6c8u 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42 -2 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_6c8u 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30 44 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_6c8u 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115 149 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_6c8u 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111 181 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_6c8u 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48 -26 . . 38 . N . 38 . CA . 38 . C . 39 . N parsed_6c8u 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55 -15 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_6c8u 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50 -36 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_6c8u 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56 -32 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_6c8u 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49 -29 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_6c8u 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47 -37 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_6c8u 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56 -32 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_6c8u 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57 -27 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_6c8u 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55 -15 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_6c8u 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49 -1 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_6c8u 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44 26 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_6c8u 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111 163 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_6c8u 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95 163 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_6c8u 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56 -12 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_6c8u 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135 157 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_6c8u 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101 157 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_6c8u 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116 172 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_6c8u 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107 159 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_6c8u 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89 169 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_6c8u 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114 162 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_6c8u 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 92 180 . . 59 . N . 59 . CA . 59 . C . 60 . N parsed_6c8u 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39 -9 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_6c8u 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43 -7 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_6c8u 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -27 17 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_6c8u 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 13 53 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_6c8u 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123 171 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_6c8u 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93 161 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_6c8u 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96 64 . . 66 . N . 66 . CA . 66 . C . 67 . N parsed_6c8u 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7 67 . . 67 . N . 67 . CA . 67 . C . 68 . N parsed_6c8u 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135 175 . . 68 . N . 68 . CA . 68 . C . 69 . N parsed_6c8u 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129 209 . . 69 . N . 69 . CA . 69 . C . 70 . N parsed_6c8u 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136 168 . . 70 . N . 70 . CA . 70 . C . 71 . N parsed_6c8u 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100 168 . . 71 . N . 71 . CA . 71 . C . 72 . N parsed_6c8u 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99 139 . . 72 . N . 72 . CA . 72 . C . 73 . N parsed_6c8u 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114 174 . . 73 . N . 73 . CA . 73 . C . 74 . N parsed_6c8u 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 16 . . 74 . N . 74 . CA . 74 . C . 75 . N parsed_6c8u 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 62 166 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_6c8u 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47 -17 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_6c8u 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53 -13 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_6c8u 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56 -32 . . 78 . N . 78 . CA . 78 . C . 79 . N parsed_6c8u 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60 -20 . . 79 . N . 79 . CA . 79 . C . 80 . N parsed_6c8u 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53 -27 . . 80 . N . 80 . CA . 80 . C . 81 . N parsed_6c8u 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52 -30 . . 81 . N . 81 . CA . 81 . C . 82 . N parsed_6c8u 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59 -33 . . 82 . N . 82 . CA . 82 . C . 83 . N parsed_6c8u 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48 22 . . 83 . N . 83 . CA . 83 . C . 84 . N parsed_6c8u 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70 170 . . 85 . N . 85 . CA . 85 . C . 86 . N parsed_6c8u 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35 -7 . . 86 . N . 86 . CA . 86 . C . 87 . N parsed_6c8u 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 76 172 . . 87 . N . 87 . CA . 87 . C . 88 . N parsed_6c8u 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105 161 . . 88 . N . 88 . CA . 88 . C . 89 . N parsed_6c8u 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136 176 . . 89 . N . 89 . CA . 89 . C . 90 . N parsed_6c8u 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108 148 . . 90 . N . 90 . CA . 90 . C . 91 . N parsed_6c8u 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 38 52 . . 91 . N . 91 . CA . 91 . C . 92 . N parsed_6c8u 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -14 46 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_6c8u 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116 152 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_6c8u 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108 156 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_6c8u 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 18 198 . . 96 . N . 96 . CA . 96 . C . 97 . N parsed_6c8u 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125 169 . . 97 . N . 97 . CA . 97 . C . 98 . N parsed_6c8u 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133 185 . . 98 . N . 98 . CA . 98 . C . 99 . N parsed_6c8u 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107 165 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_6c8u 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 75 171 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_6c8u 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 and psi dihedral restraint file generated by Talos
with select corrections suggested by TALOS+
TALOS filename:
pred.tab
Talos derived phi restraint d:
assign (resid 8 and name C)
(resid 9 and name N)
(resid 9 and name CA)
(resid 9 and name C)
1.0 -98 42 2
Talos derived phi restraint d:
assign (resid 9 and name C)
(resid 10 and name N)
(resid 10 and name CA)
(resid 10 and name C)
1.0 -92 128 2
Talos derived phi restraint d:
assign (resid 10 and name C)
(resid 11 and name N)
(resid 11 and name CA)
(resid 11 and name C)
1.0 -94 132 2
Talos derived phi restraint w:
assign (resid 11 and name C)
(resid 12 and name N)
(resid 12 and name CA)
(resid 12 and name C)
1.0 -107 121 2
Talos derived phi restraint d:
assign (resid 12 and name C)
(resid 13 and name N)
(resid 13 and name CA)
(resid 13 and name C)
1.0 -82 49 2
Talos derived phi restraint d:
assign (resid 13 and name C)
(resid 14 and name N)
(resid 14 and name CA)
(resid 14 and name C)
1.0 -118 80 2
Talos derived phi restraint d:
assign (resid 14 and name C)
(resid 15 and name N)
(resid 15 and name CA)
(resid 15 and name C)
1.0 -70 14 2
Talos derived phi restraint d:
assign (resid 15 and name C)
(resid 16 and name N)
(resid 16 and name CA)
(resid 16 and name C)
1.0 -61 16 2
Talos derived phi restraint d:
;
2 1 64 33 parsed_6c8u 1
2 "Talos derived phi restraint d:" 71 1 71 33 parsed_6c8u 1
3 "Talos derived phi restraint d:" 78 1 78 33 parsed_6c8u 1
4
;
Talos derived phi restraint d:
assign (resid 19 and name C)
(resid 20 and name N)
(resid 20 and name CA)
(resid 20 and name C)
1.0 -89 44 2
Talos derived phi restraint d:
assign (resid 20 and name C)
(resid 21 and name N)
(resid 21 and name CA)
(resid 21 and name C)
1.0 -74 26 2
Talos derived phi restraint d:
assign (resid 21 and name C)
(resid 22 and name N)
(resid 22 and name CA)
(resid 22 and name C)
1.0 -71 24 2
Talos derived phi restraint d:
assign (resid 22 and name C)
(resid 23 and name N)
(resid 23 and name CA)
(resid 23 and name C)
1.0 -85 46 2
Talos derived phi restraint d:
assign (resid 23 and name C)
(resid 24 and name N)
(resid 24 and name CA)
(resid 24 and name C)
1.0 -92 56 2
Talos derived phi restraint d:
assign (resid 24 and name C)
(resid 25 and name N)
(resid 25 and name CA)
(resid 25 and name C)
1.0 94 30 2
Talos derived phi restraint :
;
85 1 127 32 parsed_6c8u 1
5 "Talos derived phi restraint:" 134 1 134 31 parsed_6c8u 1
6 "Talos derived phi restraint:" 141 1 141 31 parsed_6c8u 1
7 "Talos derived phi restraint:" 148 1 148 31 parsed_6c8u 1
8 "Talos derived phi restraint:" 155 1 155 31 parsed_6c8u 1
9 "Talos derived phi restraint w:" 162 1 162 33 parsed_6c8u 1
10
;
change center from 55 to 75
Talos derived phi restraint :
;
168 1 170 32 parsed_6c8u 1
11 "Talos derived phi restraint w:" 177 1 177 33 parsed_6c8u 1
12 "Talos derived phi restraint :" 184 1 184 32 parsed_6c8u 1
13 "Talos derived phi restraint:" 191 1 191 31 parsed_6c8u 1
14 "Talos derived phi restraint :" 198 1 198 32 parsed_6c8u 1
15 "Talos derived phi restraint:" 205 1 205 31 parsed_6c8u 1
16 "Talos derived phi restraint:" 212 1 212 31 parsed_6c8u 1
17 "Talos derived phi restraint :" 219 1 219 32 parsed_6c8u 1
18 "Talos derived phi restraint:" 226 1 226 31 parsed_6c8u 1
19 "Talos derived phi restraint:" 233 1 233 31 parsed_6c8u 1
20 "Talos derived phi restraint:" 241 1 241 31 parsed_6c8u 1
21 "Talos derived phi restraint :" 248 1 248 32 parsed_6c8u 1
22 "Talos derived phi restraint :" 255 1 255 32 parsed_6c8u 1
23 "Talos derived phi restraint:" 262 1 262 31 parsed_6c8u 1
24 "Talos derived phi restraint:" 269 1 269 31 parsed_6c8u 1
25 "Talos derived phi restraint:" 276 1 276 31 parsed_6c8u 1
26 "Talos derived phi restraint:" 283 1 283 31 parsed_6c8u 1
27
;
Talos derived phi restraint w:
assign (resid 48 and name C)
(resid 49 and name N)
(resid 49 and name CA)
(resid 49 and name C)
1.0 -140 140 2
Talos derived phi restraint:
;
291 1 298 31 parsed_6c8u 1
28 "Talos derived phi restraint:" 305 1 305 31 parsed_6c8u 1
29 "Talos derived phi restraint:" 312 1 312 31 parsed_6c8u 1
30 "Talos derived phi restraint:" 319 1 319 31 parsed_6c8u 1
31 "Talos derived phi restraint:" 326 1 326 31 parsed_6c8u 1
32 "Talos derived phi restraint:" 333 1 333 31 parsed_6c8u 1
33 "Talos derived phi restraint:" 341 1 341 31 parsed_6c8u 1
34 "Talos derived phi restraint:" 349 1 349 31 parsed_6c8u 1
35 "Talos derived phi restraint:" 356 1 356 31 parsed_6c8u 1
36 "Talos derived phi restraint:" 363 1 363 31 parsed_6c8u 1
37 "Talos derived phi restraint :" 370 1 370 32 parsed_6c8u 1
38
;
change center from -55 to -65
Talos derived phi restraint :
;
377 1 379 32 parsed_6c8u 1
39 "Talos derived phi restraint :" 387 1 387 32 parsed_6c8u 1
40 "Talos derived phi restraint:" 394 1 394 31 parsed_6c8u 1
41 "Talos derived phi restraint :" 401 1 401 32 parsed_6c8u 1
42 "Talos derived phi restraint w:" 409 1 409 33 parsed_6c8u 1
43 "Talos derived phi restraint w:" 417 1 417 33 parsed_6c8u 1
44 "Talos derived phi restraint :" 424 1 424 32 parsed_6c8u 1
45 "Talos derived phi restraint :" 431 1 431 32 parsed_6c8u 1
46
;
Talos derived phi restraint w:
assign (resid 68 and name C)
(resid 69 and name N)
(resid 69 and name CA)
(resid 69 and name C)
1.0 -152 106 2
Talos derived phi restraint:
;
438 1 445 31 parsed_6c8u 1
47 "Talos derived phi restraint:" 452 1 452 31 parsed_6c8u 1
48 "Talos derived phi restraint:" 460 1 460 31 parsed_6c8u 1
49 "Talos derived phi restraint :" 467 1 467 32 parsed_6c8u 1
50 "Talos derived phi restraint w:" 474 1 474 33 parsed_6c8u 1
51 "Talos derived phi restraint w:" 481 1 481 33 parsed_6c8u 1
52 "Talos derived phi restraint:" 488 1 488 31 parsed_6c8u 1
53 "Talos derived phi restraint:" 495 1 495 31 parsed_6c8u 1
54 "Talos derived phi restraint:" 502 1 502 31 parsed_6c8u 1
55 "Talos derived phi restraint :" 509 1 509 32 parsed_6c8u 1
56 "Talos derived phi restraint:" 516 1 516 31 parsed_6c8u 1
57 "Talos derived phi restraint:" 523 1 523 31 parsed_6c8u 1
58 "Talos derived phi restraint:" 530 1 530 31 parsed_6c8u 1
59 "Talos derived phi restraint :" 537 1 537 32 parsed_6c8u 1
60
;
Talos derived phi restraint w:
assign (resid 83 and name C)
(resid 84 and name N)
(resid 84 and name CA)
(resid 84 and name C)
1.0 83 12 2
Talos derived phi restraint:
;
545 1 552 31 parsed_6c8u 1
61 "Talos derived phi restraint :" 559 1 559 32 parsed_6c8u 1
62 "Talos derived phi restraint:" 566 1 566 31 parsed_6c8u 1
63 "Talos derived phi restraint:" 573 1 573 31 parsed_6c8u 1
64 "Talos derived phi restraint:" 580 1 580 31 parsed_6c8u 1
65 "Talos derived phi restraint:" 587 1 587 31 parsed_6c8u 1
66 "Talos derived phi restraint:" 594 1 594 31 parsed_6c8u 1
67 "Talos derived phi restraint:" 602 1 602 31 parsed_6c8u 1
68 "Talos derived phi restraint:" 609 1 609 31 parsed_6c8u 1
69 "Talos derived phi restraint :" 616 1 616 32 parsed_6c8u 1
70 "Talos derived phi restraint:" 623 1 623 31 parsed_6c8u 1
71 "Talos derived phi restraint w:" 630 1 630 33 parsed_6c8u 1
72 "Talos derived phi restraint:" 637 1 637 31 parsed_6c8u 1
73 "Talos derived phi restraint:" 644 1 644 31 parsed_6c8u 1
74 "Talos derived phi restraint :" 653 1 653 32 parsed_6c8u 1
75
;
Talos derived phi restraint w:
assign (resid 99 and name C)
(resid 100 and name N)
(resid 100 and name CA)
(resid 100 and name C)
1.0 -96 24 2
Talos derived phi restraint:
;
660 1 668 31 parsed_6c8u 1
76 "Talos derived phi restraint:" 675 1 675 31 parsed_6c8u 1
77
;
Talos derived phi restraint d:
assign (resid 102 and name C)
(resid 103 and name N)
(resid 103 and name CA)
(resid 103 and name C)
1.0 -100 46 2
Talos derived phi restraint d:
assign (resid 103 and name C)
(resid 104 and name N)
(resid 104 and name CA)
(resid 104 and name C)
1.0 -87 120 2
Talos derived phi restraint d:
assign (resid 104 and name C)
(resid 105 and name N)
(resid 105 and name CA)
(resid 105 and name C)
1.0 -98 130 2
Talos derived phi restraint d:
assign (resid 105 and name C)
(resid 106 and name N)
(resid 106 and name CA)
(resid 106 and name C)
1.0 -98 34 2
Talos derived phi restraint d:
assign (resid 106 and name C)
(resid 107 and name N)
(resid 107 and name CA)
(resid 107 and name C)
1.0 -70 14 2
Talos derived phi restraint d:
assign (resid 107 and name C)
(resid 108 and name N)
(resid 108 and name CA)
(resid 108 and name C)
1.0 -103 38 2
Talos derived phi restraint d:
assign (resid 108 and name C)
(resid 109 and name N)
(resid 109 and name CA)
(resid 109 and name C)
1.0 -80 120 2
Talos derived phi restraint d:
assign (resid 109 and name C)
(resid 110 and name N)
(resid 110 and name CA)
(resid 110 and name C)
1.0 -82 120 2
Talos derived phi restraint d:
assign (resid 110 and name C)
(resid 111 and name N)
(resid 111 and name CA)
(resid 111 and name C)
1.0 -96 120 2
Talos derived phi restraint d:
assign (resid 111 and name C)
(resid 112 and name N)
(resid 112 and name CA)
(resid 112 and name C)
1.0 -77 120 2
Talos derived phi restraint d:
assign (resid 112 and name C)
(resid 113 and name N)
(resid 113 and name CA)
(resid 113 and name C)
1.0 -88 120 2
Talos derived phi restraint d:
assign (resid 113 and name C)
(resid 114 and name N)
(resid 114 and name CA)
(resid 114 and name C)
1.0 -84 34 2
Talos derived phi restraint d :
assign (resid 114 and name C)
(resid 115 and name N)
(resid 115 and name CA)
(resid 115 and name C)
1.0 -93 58 2
Talos derived psi restraint d:
assign (resid 9 and name N)
(resid 9 and name CA)
(resid 9 and name C)
(resid 10 and name N)
1.0 -10 46 2
Talos derived psi restraint d:
assign (resid 10 and name N)
(resid 10 and name CA)
(resid 10 and name C)
(resid 11 and name N)
1.0 138 40 2
Talos derived psi restraint d:
assign (resid 11 and name N)
(resid 11 and name CA)
(resid 11 and name C)
(resid 12 and name N)
1.0 136 44 2
Talos derived psi restraint w:
assign (resid 12 and name N)
(resid 12 and name CA)
(resid 12 and name C)
(resid 13 and name N)
1.0 158 90 2
Talos derived psi restraint d:
assign (resid 13 and name N)
(resid 13 and name CA)
(resid 13 and name C)
(resid 14 and name N)
1.0 -27 58 2
Talos derived psi restraint d:
;
682 1 809 33 parsed_6c8u 1
78
;
Talos derived psi restraint d:
assign (resid 15 and name N)
(resid 15 and name CA)
(resid 15 and name C)
(resid 16 and name N)
1.0 -31 20 2
change center from 157 to 150
Talos derived psi restraint d:
assign (resid 16 and name N)
(resid 16 and name CA)
(resid 16 and name C)
(resid 17 and name N)
1.0 -34 22 2
Talos derived psi restraint d:
assign (resid 17 and name N)
(resid 17 and name CA)
(resid 17 and name C)
(resid 18 and name N)
1.0 -35 22 2
Talos derived psi restraint d:
assign (resid 18 and name N)
(resid 18 and name CA)
(resid 18 and name C)
(resid 19 and name N)
1.0 -34 22 2
Talos derived psi restraint d:
assign (resid 19 and name N)
(resid 19 and name CA)
(resid 19 and name C)
(resid 20 and name N)
1.0 -29 32 2
Talos derived psi restraint d:
assign (resid 20 and name N)
(resid 20 and name CA)
(resid 20 and name C)
(resid 21 and name N)
1.0 -13 40 2
Talos derived psi restraint d:
assign (resid 21 and name N)
(resid 21 and name CA)
(resid 21 and name C)
(resid 22 and name N)
1.0 -32 22 2
Talos derived psi restraint d:
assign (resid 22 and name N)
(resid 22 and name CA)
(resid 22 and name C)
(resid 23 and name N)
1.0 -27 28 2
change center from 163 to 153
Talos derived psi restraint d:
assign (resid 23 and name N)
(resid 23 and name CA)
(resid 23 and name C)
(resid 24 and name N)
1.0 -15 50 2
Talos derived psi restraint d:
assign (resid 24 and name N)
(resid 24 and name CA)
(resid 24 and name C)
(resid 25 and name N)
1.0 0 56 2
Talos derived psi restraint d:
assign (resid 25 and name N)
(resid 25 and name CA)
(resid 25 and name C)
(resid 26 and name N)
1.0 -11 17 2
Talos derived psi restraint :
assign (resid 26 and name N)
(resid 26 and name CA)
(resid 26 and name C)
(resid 27 and name N)
1.0 147 52 2
Talos derived psi restraint:
;
816 1 908 31 parsed_6c8u 1
79 "Talos derived psi restraint:" 915 1 915 31 parsed_6c8u 1
80 "Talos derived psi restraint:" 923 1 923 31 parsed_6c8u 1
81 "Talos derived psi restraint:" 931 1 931 31 parsed_6c8u 1
82 "Talos derived psi restraint w:" 939 1 939 33 parsed_6c8u 1
83 "Talos derived psi restraint :" 947 1 947 32 parsed_6c8u 1
84 "Talos derived psi restraint w:" 954 1 954 33 parsed_6c8u 1
85 "Talos derived psi restraint :" 961 1 961 32 parsed_6c8u 1
86 "Talos derived psi restraint:" 968 1 968 31 parsed_6c8u 1
87 "Talos derived psi restraint :" 975 1 975 32 parsed_6c8u 1
88 "Talos derived psi restraint:" 982 1 982 31 parsed_6c8u 1
89 "Talos derived psi restraint:" 989 1 989 31 parsed_6c8u 1
90 "Talos derived psi restraint :" 996 1 996 32 parsed_6c8u 1
91 "Talos derived psi restraint:" 1003 1 1003 31 parsed_6c8u 1
92 "Talos derived psi restraint:" 1010 1 1010 31 parsed_6c8u 1
93 "Talos derived psi restraint:" 1017 1 1017 31 parsed_6c8u 1
94 "Talos derived psi restraint :" 1024 1 1024 32 parsed_6c8u 1
95 "Talos derived psi restraint :" 1031 1 1031 32 parsed_6c8u 1
96 "Talos derived psi restraint:" 1039 1 1039 31 parsed_6c8u 1
97 "Talos derived psi restraint:" 1046 1 1046 31 parsed_6c8u 1
98 "Talos derived psi restraint:" 1053 1 1053 31 parsed_6c8u 1
99 "Talos derived psi restraint:" 1060 1 1060 31 parsed_6c8u 1
100
;
Talos derived psi restraint w:
assign (resid 49 and name N)
(resid 49 and name CA)
(resid 49 and name C)
(resid 50 and name N)
1.0 176 31 2
Talos derived psi restraint:
;
1067 1 1074 30 parsed_6c8u 1
101 "Talos derived psi restraint:" 1081 1 1081 30 parsed_6c8u 1
102 "Talos derived psi restraint:" 1088 1 1088 30 parsed_6c8u 1
103 "Talos derived psi restraint:" 1095 1 1095 30 parsed_6c8u 1
104 "Talos derived psi restraint:" 1102 1 1102 30 parsed_6c8u 1
105 "Talos derived psi restraint:" 1109 1 1109 30 parsed_6c8u 1
106 "Talos derived psi restraint:" 1116 1 1116 30 parsed_6c8u 1
107 "Talos derived psi restraint:" 1124 1 1124 30 parsed_6c8u 1
108 "Talos derived psi restraint:" 1131 1 1131 30 parsed_6c8u 1
109 "Talos derived psi restraint:" 1138 1 1138 30 parsed_6c8u 1
110 "Talos derived psi restraint :" 1145 1 1145 31 parsed_6c8u 1
111
;
change center from -34 to -24
Talos derived psi restraint w:
;
1151 1 1153 32 parsed_6c8u 1
112 "Talos derived psi restraint:" 1160 1 1160 30 parsed_6c8u 1
113 "Talos derived psi restraint:" 1167 1 1167 30 parsed_6c8u 1
114 "Talos derived psi restraint:" 1174 1 1174 30 parsed_6c8u 1
115 "Talos derived psi restraint w:" 1181 1 1181 32 parsed_6c8u 1
116 "Talos derived psi restraint w :" 1188 1 1188 33 parsed_6c8u 1
117 "Talos derived psi restraint :" 1195 1 1195 31 parsed_6c8u 1
118 "Talos derived psi restraint w:" 1202 1 1202 32 parsed_6c8u 1
119 "Talos derived psi restraint w:" 1209 1 1209 32 parsed_6c8u 1
120 "Talos derived psi restraint :" 1216 1 1216 31 parsed_6c8u 1
121 "Talos derived psi restraint :" 1223 1 1223 31 parsed_6c8u 1
122 "Talos derived psi restraint :" 1231 1 1231 31 parsed_6c8u 1
123 "Talos derived psi restraint w:" 1238 1 1238 32 parsed_6c8u 1
124 "Talos derived psi restraint w:" 1245 1 1245 32 parsed_6c8u 1
125 "Talos derived psi restraint :" 1252 1 1252 31 parsed_6c8u 1
126 "Talos derived psi restraint :" 1259 1 1259 31 parsed_6c8u 1
127 "Talos derived psi restraint :" 1266 1 1266 31 parsed_6c8u 1
128 "Talos derived psi restraint :" 1274 1 1274 31 parsed_6c8u 1
129 "Talos derived psi restraint :" 1281 1 1281 31 parsed_6c8u 1
130 "Talos derived psi restraint :" 1288 1 1288 31 parsed_6c8u 1
131 "Talos derived psi restraint :" 1295 1 1295 31 parsed_6c8u 1
132 "Talos derived psi restraint :" 1302 1 1302 31 parsed_6c8u 1
133 "Talos derived psi restraint :" 1309 1 1309 31 parsed_6c8u 1
134
;
Talos derived psi restraint w:
assign (resid 84 and name N)
(resid 84 and name CA)
(resid 84 and name C)
(resid 85 and name N)
1.0 16 22 2
Talos derived psi restraint :
;
1316 1 1323 31 parsed_6c8u 1
135 "Talos derived psi restraint :" 1330 1 1330 31 parsed_6c8u 1
136 "Talos derived psi restraint :" 1337 1 1337 31 parsed_6c8u 1
137 "Talos derived psi restraint :" 1344 1 1344 31 parsed_6c8u 1
138 "Talos derived psi restraint :" 1351 1 1351 31 parsed_6c8u 1
139 "Talos derived psi restraint :" 1358 1 1358 31 parsed_6c8u 1
140 "Talos derived psi restraint :" 1366 1 1366 31 parsed_6c8u 1
141 "Talos derived psi restraint :" 1373 1 1373 31 parsed_6c8u 1
142 "Talos derived psi restraint :" 1380 1 1380 31 parsed_6c8u 1
143 "Talos derived psi restraint :" 1387 1 1387 31 parsed_6c8u 1
144
;
Talos derived psi restraint :
assign (resid 95 and name N)
(resid 95 and name CA)
(resid 95 and name C)
(resid 96 and name N)
1.0 -11 32 2
Talos derived psi restraint w :
;
1394 1 1401 33 parsed_6c8u 1
145 "Talos derived psi restraint :" 1408 1 1408 31 parsed_6c8u 1
146 "Talos derived psi restraint :" 1415 1 1415 31 parsed_6c8u 1
147 "Talos derived psi restraint :" 1422 1 1422 31 parsed_6c8u 1
148
;
Talos derived psi restraint w:
assign (resid 100 and name N)
(resid 100 and name CA)
(resid 100 and name C)
(resid 101 and name N)
1.0 -13 44 2
Talos derived psi restraint :
;
1429 1 1436 31 parsed_6c8u 1
149
;
Talos derived psi restraint d :
assign (resid 102 and name N)
(resid 102 and name CA)
(resid 102 and name C)
(resid 103 and name N)
1.0 150 20 2
Talos derived psi restraint d:
assign (resid 103 and name N)
(resid 103 and name CA)
(resid 103 and name C)
(resid 104 and name N)
1.0 126 30 2
Talos derived psi restraint d:
assign (resid 104 and name N)
(resid 104 and name CA)
(resid 104 and name C)
(resid 105 and name N)
1.0 131 38 2
Talos derived psi restraint d:
assign (resid 105 and name N)
(resid 105 and name CA)
(resid 105 and name C)
(resid 106 and name N)
1.0 139 44 2
Talos derived psi restraint d :
assign (resid 106 and name N)
(resid 106 and name CA)
(resid 106 and name C)
(resid 107 and name N)
1.0 122 37 2
Talos derived psi restraint d :
assign (resid 107 and name N)
(resid 107 and name CA)
(resid 107 and name C)
(resid 108 and name N)
1.0 150 22 2
Talos derived psi restraint d :
assign (resid 108 and name N)
(resid 108 and name CA)
(resid 108 and name C)
(resid 109 and name N)
1.0 125 30 2
Talos derived psi restraint d:
assign (resid 109 and name N)
(resid 109 and name CA)
(resid 109 and name C)
(resid 110 and name N)
1.0 132 30 2
Talos derived psi restraint d:
assign (resid 110 and name N)
(resid 110 and name CA)
(resid 110 and name C)
(resid 111 and name N)
1.0 130 30 2
Talos derived psi restraint d:
assign (resid 111 and name N)
(resid 111 and name CA)
(resid 111 and name C)
(resid 112 and name N)
1.0 119 24 2
Talos derived psi restraint d:
assign (resid 112 and name N)
(resid 112 and name CA)
(resid 112 and name C)
(resid 113 and name N)
1.0 128 24 2
Talos derived psi restraint d:
assign (resid 113 and name N)
(resid 113 and name CA)
(resid 113 and name C)
(resid 114 and name N)
1.0 124 30 2
Talos derived psi restraint d:
assign (resid 114 and name N)
(resid 114 and name CA)
(resid 114 and name C)
(resid 115 and name N)
1.0 128 44 2
;
1443 1 1533 22 parsed_6c8u 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 5: dihed.tbl" 1 1 1 30 parsed_6c8u 1
stop_
save_
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