Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | item_count |
|
|
46532 | 2ezh RC | 4090 | cing | recoord | 2-parsed | STAR | dihedral angle | 108 |
data_2ezh_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ezh
_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_2ezh 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ezh
_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 2ezh "Master copy" parsed_2ezh
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ezh
_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 2ezh.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . XPLOR/CNS 3 distance NOE simple 969 parsed_2ezh 1
1 2ezh.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 40 parsed_2ezh 1
1 2ezh.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 108 parsed_2ezh 1
1 2ezh.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . XPLOR/CNS 8 "coupling constant" "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . XPLOR/CNS 10 "chemical shift" "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . PIPP 12 "chemical shift" "Not applicable" "Not applicable" 0 parsed_2ezh 1
1 2ezh.mr . . "MR format" 13 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ezh 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ezh
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 176 . c . 177 . n . 177 . ca . 177 . c parsed_2ezh 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 177 . c . 178 . n . 178 . ca . 178 . c parsed_2ezh 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 178 . c . 179 . n . 179 . ca . 179 . c parsed_2ezh 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 179 . c . 180 . n . 180 . ca . 180 . c parsed_2ezh 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -48.0 . . 180 . c . 181 . n . 181 . ca . 181 . c parsed_2ezh 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.0 -34.0 . . 181 . c . 182 . n . 182 . ca . 182 . c parsed_2ezh 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.0 -43.0 . . 182 . c . 183 . n . 183 . ca . 183 . c parsed_2ezh 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -55.0 . . 183 . c . 184 . n . 184 . ca . 184 . c parsed_2ezh 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -38.0 . . 184 . c . 185 . n . 185 . ca . 185 . c parsed_2ezh 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -39.0 . . 185 . c . 186 . n . 186 . ca . 186 . c parsed_2ezh 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -42.0 . . 186 . c . 187 . n . 187 . ca . 187 . c parsed_2ezh 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -42.0 . . 187 . c . 188 . n . 188 . ca . 188 . c parsed_2ezh 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -50.0 . . 188 . c . 189 . n . 189 . ca . 189 . c parsed_2ezh 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 189 . c . 190 . n . 190 . ca . 190 . c parsed_2ezh 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.0 -32.0 . . 190 . c . 191 . n . 191 . ca . 191 . c parsed_2ezh 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -39.0 . . 191 . c . 192 . n . 192 . ca . 192 . c parsed_2ezh 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.0 -64.0 . . 192 . c . 193 . n . 193 . ca . 193 . c parsed_2ezh 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -45.0 . . 193 . c . 194 . n . 194 . ca . 194 . c parsed_2ezh 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 194 . c . 195 . n . 195 . ca . 195 . c parsed_2ezh 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 195 . c . 196 . n . 196 . ca . 196 . c parsed_2ezh 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 196 . c . 197 . n . 197 . ca . 197 . c parsed_2ezh 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 197 . c . 198 . n . 198 . ca . 198 . c parsed_2ezh 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 198 . c . 199 . n . 199 . ca . 199 . c parsed_2ezh 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 199 . c . 200 . n . 200 . ca . 200 . c parsed_2ezh 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 200 . c . 201 . n . 201 . ca . 201 . c parsed_2ezh 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 201 . c . 202 . n . 202 . ca . 202 . c parsed_2ezh 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 202 . c . 203 . n . 203 . ca . 203 . c parsed_2ezh 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -37.0 . . 203 . c . 204 . n . 204 . ca . 204 . c parsed_2ezh 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -37.0 . . 204 . c . 205 . n . 205 . ca . 205 . c parsed_2ezh 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 205 . c . 206 . n . 206 . ca . 206 . c parsed_2ezh 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.0 -42.0 . . 206 . c . 207 . n . 207 . ca . 207 . c parsed_2ezh 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.0 -36.0 . . 207 . c . 208 . n . 208 . ca . 208 . c parsed_2ezh 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 208 . c . 209 . n . 209 . ca . 209 . c parsed_2ezh 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -44.0 . . 209 . c . 210 . n . 210 . ca . 210 . c parsed_2ezh 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.0 -32.0 . . 210 . c . 211 . n . 211 . ca . 211 . c parsed_2ezh 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.0 -46.0 . . 211 . c . 212 . n . 212 . ca . 212 . c parsed_2ezh 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -48.0 . . 212 . c . 213 . n . 213 . ca . 213 . c parsed_2ezh 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 213 . c . 214 . n . 214 . ca . 214 . c parsed_2ezh 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 95.0 . . 214 . c . 215 . n . 215 . ca . 215 . c parsed_2ezh 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -105.0 -55.0 . . 215 . c . 216 . n . 216 . ca . 216 . c parsed_2ezh 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.0 -75.0 . . 216 . c . 217 . n . 217 . ca . 217 . c parsed_2ezh 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -70.0 . . 217 . c . 218 . n . 218 . ca . 218 . c parsed_2ezh 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 218 . c . 219 . n . 219 . ca . 219 . c parsed_2ezh 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 219 . c . 220 . n . 220 . ca . 220 . c parsed_2ezh 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -30.0 . . 220 . c . 221 . n . 221 . ca . 221 . c parsed_2ezh 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -38.0 . . 221 . c . 222 . n . 222 . ca . 222 . c parsed_2ezh 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -48.0 . . 222 . c . 223 . n . 223 . ca . 223 . c parsed_2ezh 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.0 -47.0 . . 223 . c . 224 . n . 224 . ca . 224 . c parsed_2ezh 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 224 . c . 225 . n . 225 . ca . 225 . c parsed_2ezh 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 225 . c . 226 . n . 226 . ca . 226 . c parsed_2ezh 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.0 -48.0 . . 226 . c . 227 . n . 227 . ca . 227 . c parsed_2ezh 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.0 -47.0 . . 227 . c . 228 . n . 228 . ca . 228 . c parsed_2ezh 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 228 . c . 229 . n . 229 . ca . 229 . c parsed_2ezh 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 229 . c . 230 . n . 230 . ca . 230 . c parsed_2ezh 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -50.0 . . 230 . c . 231 . n . 231 . ca . 231 . c parsed_2ezh 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 232 . c . 233 . n . 233 . ca . 233 . c parsed_2ezh 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 233 . c . 234 . n . 234 . ca . 234 . c parsed_2ezh 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 234 . c . 235 . n . 235 . ca . 235 . c parsed_2ezh 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 235 . c . 236 . n . 236 . ca . 236 . c parsed_2ezh 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 236 . c . 237 . n . 237 . ca . 237 . c parsed_2ezh 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 237 . c . 238 . n . 238 . ca . 238 . c parsed_2ezh 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 238 . c . 239 . n . 239 . ca . 239 . c parsed_2ezh 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 239 . c . 240 . n . 240 . ca . 240 . c parsed_2ezh 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 240 . c . 241 . n . 241 . ca . 241 . c parsed_2ezh 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 241 . c . 242 . n . 242 . ca . 242 . c parsed_2ezh 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 242 . c . 243 . n . 243 . ca . 243 . c parsed_2ezh 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 243 . c . 244 . n . 244 . ca . 244 . c parsed_2ezh 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -5.0 . . 244 . c . 245 . n . 245 . ca . 245 . c parsed_2ezh 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 180 . ca . 180 . cb . 180 . cg . 180 . cd1 parsed_2ezh 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 187 . ca . 187 . cb . 187 . cg . 187 . cd1 parsed_2ezh 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 200 . ca . 200 . cb . 200 . cg . 200 . cd1 parsed_2ezh 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 225 . ca . 225 . cb . 225 . cg . 225 . cd1 parsed_2ezh 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 192 . ca . 192 . cb . 192 . cg . 192 . cd1 parsed_2ezh 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 65 115 . . 204 . ca . 204 . cb . 204 . cg . 204 . cd1 parsed_2ezh 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 236 . n . 236 . ca . 236 . cb . 236 . cg1 parsed_2ezh 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 237 . n . 237 . ca . 237 . cb . 237 . cg1 parsed_2ezh 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 189 . n . 189 . ca . 189 . cb . 189 . cg1 parsed_2ezh 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 218 . n . 218 . ca . 218 . cb . 218 . cg1 parsed_2ezh 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 228 . n . 228 . ca . 228 . cb . 228 . cg1 parsed_2ezh 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 223 . n . 223 . ca . 223 . cb . 223 . og1 parsed_2ezh 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 180 . n . 180 . ca . 180 . cb . 180 . cg parsed_2ezh 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 181 . n . 181 . ca . 181 . cb . 181 . cg parsed_2ezh 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 183 . n . 183 . ca . 183 . cb . 183 . cg parsed_2ezh 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 185 . n . 185 . ca . 185 . cb . 185 . cg parsed_2ezh 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 186 . n . 186 . ca . 186 . cb . 186 . cg parsed_2ezh 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 187 . n . 187 . ca . 187 . cb . 187 . cg parsed_2ezh 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 188 . n . 188 . ca . 188 . cb . 188 . cg parsed_2ezh 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 193 . n . 193 . ca . 193 . cb . 193 . cg parsed_2ezh 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 194 . n . 194 . ca . 194 . cb . 194 . cg parsed_2ezh 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 200 . n . 200 . ca . 200 . cb . 200 . cg parsed_2ezh 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 205 . n . 205 . ca . 205 . cb . 205 . cg parsed_2ezh 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 207 . n . 207 . ca . 207 . cb . 207 . cg parsed_2ezh 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 208 . n . 208 . ca . 208 . cb . 208 . cg parsed_2ezh 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 214 . n . 214 . ca . 214 . cb . 214 . cg parsed_2ezh 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 216 . n . 216 . ca . 216 . cb . 216 . cg parsed_2ezh 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 221 . n . 221 . ca . 221 . cb . 221 . cg parsed_2ezh 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 225 . n . 225 . ca . 225 . cb . 225 . cg parsed_2ezh 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 231 . n . 231 . ca . 231 . cb . 231 . cg parsed_2ezh 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 235 . n . 235 . ca . 235 . cb . 235 . cg parsed_2ezh 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 240 . n . 240 . ca . 240 . cb . 240 . cg parsed_2ezh 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -40.0 . . 246 . n . 246 . ca . 246 . cb . 246 . cg parsed_2ezh 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 193 . ca . 193 . cb . 193 . cg . 193 . cd1 parsed_2ezh 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 231 . ca . 231 . cb . 231 . cg . 231 . cd1 parsed_2ezh 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 188 . ca . 188 . cb . 188 . cg . 188 . cd1 parsed_2ezh 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 207 . ca . 207 . cb . 207 . cg . 207 . cd1 parsed_2ezh 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 218 . ca . 218 . cb . 218 . cg1 . 218 . cd1 parsed_2ezh 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -30.0 . . 189 . ca . 189 . cb . 189 . cg1 . 189 . cd1 parsed_2ezh 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.0 -30.0 . . 228 . ca . 228 . cb . 228 . cg1 . 228 . cd1 parsed_2ezh 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 "! D181" 10 1 10 14 parsed_2ezh 1
2 "! E182" 13 1 13 13 parsed_2ezh 1
3 "! D183" 16 1 16 13 parsed_2ezh 1
4 "! A184" 19 1 19 13 parsed_2ezh 1
5 "! W185" 22 1 22 13 parsed_2ezh 1
6 "! Q186" 25 1 25 13 parsed_2ezh 1
7 "! F187" 28 1 28 13 parsed_2ezh 1
8 "! L188" 31 1 31 13 parsed_2ezh 1
9 "! I189" 34 1 34 13 parsed_2ezh 1
10 "! A190" 37 1 37 13 parsed_2ezh 1
11 "! D191 Needs to be refined" 40 1 40 34 parsed_2ezh 1
12 "! Y192" 43 1 43 13 parsed_2ezh 1
13 "! L193" 46 1 46 13 parsed_2ezh 1
14 "!! 194" 49 1 49 12 parsed_2ezh 1
15 "!! 195" 52 1 52 12 parsed_2ezh 1
16 "!! 196" 55 1 55 12 parsed_2ezh 1
17 "!! 197" 58 1 58 12 parsed_2ezh 1
18 "!! 198" 61 1 61 12 parsed_2ezh 1
19 "!! 199" 64 1 64 12 parsed_2ezh 1
20 "!! F200" 67 1 67 13 parsed_2ezh 1
21 "!! R201" 70 1 70 13 parsed_2ezh 1
22 "!! 202" 73 1 73 12 parsed_2ezh 1
23 "!! 203" 76 1 76 12 parsed_2ezh 1
24 "! 204" 80 1 80 12 parsed_2ezh 1
25 "!! 205" 83 1 83 12 parsed_2ezh 1
26 "!! 206" 86 1 86 12 parsed_2ezh 1
27 "! 207" 89 1 89 12 parsed_2ezh 1
28 "! 208" 92 1 92 12 parsed_2ezh 1
29 "! 209" 95 1 95 12 parsed_2ezh 1
30 "! A210" 98 1 98 13 parsed_2ezh 1
31 "! A211" 101 1 101 13 parsed_2ezh 1
32 "! R212" 104 1 104 13 parsed_2ezh 1
33 "! E213" 107 1 107 13 parsed_2ezh 1
34 "! 214" 112 1 112 12 parsed_2ezh 1
35 "! 215 (GLYCINE)" 115 1 115 22 parsed_2ezh 1
36 "! 216" 118 1 118 12 parsed_2ezh 1
37 "!! 217" 121 1 121 12 parsed_2ezh 1
38 "!! 218" 124 1 124 11 parsed_2ezh 1
39 "! 219" 127 1 127 12 parsed_2ezh 1
40 "!! 220" 130 1 130 17 parsed_2ezh 1
41 "!! 221" 133 1 134 12 parsed_2ezh 1
42 "!! 222" 137 1 137 17 parsed_2ezh 1
43 "! T223" 140 1 141 13 parsed_2ezh 1
44 "! A224" 144 1 144 13 parsed_2ezh 1
45 "! F225" 147 1 147 13 parsed_2ezh 1
46 "! R226" 150 1 150 13 parsed_2ezh 1
47 "! R227" 153 1 153 13 parsed_2ezh 1
48 "! I228" 156 1 156 13 parsed_2ezh 1
49 "! Q229" 159 1 159 13 parsed_2ezh 1
50 "! 230" 162 1 162 12 parsed_2ezh 1
51 "!! 231" 165 1 165 12 parsed_2ezh 1
52 "!! 233" 168 1 169 12 parsed_2ezh 1
53 "!! 234" 172 1 173 12 parsed_2ezh 1
54 "!! 235" 176 1 177 12 parsed_2ezh 1
55 "!! 236" 180 1 180 12 parsed_2ezh 1
56 "!! 237" 183 1 183 12 parsed_2ezh 1
57 "!! 238" 188 1 188 12 parsed_2ezh 1
58 "!! 239" 191 1 191 12 parsed_2ezh 1
59 "!! 240" 194 1 194 12 parsed_2ezh 1
60 "!! 241" 197 1 197 12 parsed_2ezh 1
61 "!! 242 (GLYCINE)" 200 1 200 22 parsed_2ezh 1
62 "!! 243" 203 1 203 12 parsed_2ezh 1
63 "!! 244" 206 1 206 12 parsed_2ezh 1
64 "!! 245" 209 1 209 12 parsed_2ezh 1
65
;
CHI2 AROMATICS
PHENYLALANINE
;
213 1 215 15 parsed_2ezh 1
66 TYROSINE 229 1 229 10 parsed_2ezh 1
67
;
CHI1 CONSTRAINTS
VALINE RESIDUES
V175 Rotomer averaging
V236
;
236 1 244 6 parsed_2ezh 1
68 V237 247 1 247 6 parsed_2ezh 1
69
;
ISOLEUCINE RESIDUES
I189
;
252 1 254 6 parsed_2ezh 1
70 I218 257 1 257 6 parsed_2ezh 1
71 I228 260 1 260 6 parsed_2ezh 1
72
;
THREONINE RESIDUES
T223
;
264 1 265 6 parsed_2ezh 1
73
;
AMX TYPE SYSTEMS
F180
;
268 1 271 7 parsed_2ezh 1
74 D181 275 1 275 7 parsed_2ezh 1
75 D183 278 1 278 6 parsed_2ezh 1
76 W185 282 1 282 7 parsed_2ezh 1
77 Q186 286 1 286 6 parsed_2ezh 1
78 F187 289 1 290 6 parsed_2ezh 1
79 L188 294 1 294 6 parsed_2ezh 1
80 L193 298 1 298 6 parsed_2ezh 1
81 R194 302 1 302 7 parsed_2ezh 1
82 F200 306 1 306 6 parsed_2ezh 1
83 E205 310 1 310 7 parsed_2ezh 1
84 L207 314 1 314 6 parsed_2ezh 1
85 E208 318 1 318 6 parsed_2ezh 1
86 H214 322 1 322 6 parsed_2ezh 1
87 W216 326 1 326 6 parsed_2ezh 1
88 R221 330 1 330 6 parsed_2ezh 1
89 F225 334 1 334 6 parsed_2ezh 1
90 L231 338 1 338 6 parsed_2ezh 1
91 M235 342 1 342 6 parsed_2ezh 1
92 R240 347 1 347 6 parsed_2ezh 1
93 L246 351 1 351 6 parsed_2ezh 1
94 "Leu chi2" 355 1 355 10 parsed_2ezh 1
95 "Ile chi2" 365 1 365 10 parsed_2ezh 1
stop_
save_