NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
578697 |
2mm9   |
19849 | cing | 2-parsed | STAR | entry | full | 235 |
data_2mm9_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mm9
_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_2mm9 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mm9
_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 2mm9 "Master copy" parsed_2mm9
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mm9
_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 2mm9.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mm9 1
1 2mm9.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 150 parsed_2mm9 1
1 2mm9.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 85 parsed_2mm9 1
1 2mm9.mr . . unknown 4 distance NOE simple 0 parsed_2mm9 1
1 2mm9.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mm9 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2mm9
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER TRANSCRIPTION 13-MAR-14 2MM9
*TITLE SOLUTION STRUCTURE OF REDUCED BOLA2 FROM ARABIDOPSIS THALIANA
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: BOLA2;
*COMPND 3 CHAIN: A;
*COMPND 4 SYNONYM: BOLA-LIKE FAMILY PROTEIN;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA;
*SOURCE 3 ORGANISM_COMMON: MOUSE-EAR CRESS;
*SOURCE 4 ORGANISM_TAXID: 3702;
*SOURCE 5 GENE: AT5G09830, AT5G09830;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET3D
*KEYWDS STRESS-RESPONSIVE PROTEIN, TRANSCRIPTIONAL REGULATOR, MORPHOGEN,
*KEYWDS 2 TRANSCRIPTION
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR T.RORET, P.TSAN, J.COUTURIER, N.ROUHIER, C.DIDIERJEAN
*REVDAT 1 23-JUL-14 2MM9 0
;
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2mm9
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -60.00 . " A" 2 . C " A" 3 . N " A" 3 . CA " A" 3 . C parsed_2mm9 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.00 180.12 . " A" 3 . N " A" 3 . CA " A" 3 . C " A" 4 . N parsed_2mm9 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -29.46 . " A" 3 . C " A" 4 . N " A" 4 . CA " A" 4 . C parsed_2mm9 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -11.70 . " A" 4 . N " A" 4 . CA " A" 4 . C " A" 5 . N parsed_2mm9 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.66 . " A" 4 . C " A" 5 . N " A" 5 . CA " A" 5 . C parsed_2mm9 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.20 . " A" 5 . N " A" 5 . CA " A" 5 . C " A" 6 . N parsed_2mm9 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.18 . " A" 5 . C " A" 6 . N " A" 6 . CA " A" 6 . C parsed_2mm9 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.70 . " A" 6 . N " A" 6 . CA " A" 6 . C " A" 7 . N parsed_2mm9 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -31.52 . " A" 6 . C " A" 7 . N " A" 7 . CA " A" 7 . C parsed_2mm9 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.72 . " A" 7 . N " A" 7 . CA " A" 7 . C " A" 8 . N parsed_2mm9 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -31.20 . " A" 7 . C " A" 8 . N " A" 8 . CA " A" 8 . C parsed_2mm9 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.08 . " A" 8 . N " A" 8 . CA " A" 8 . C " A" 9 . N parsed_2mm9 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -35.74 . " A" 8 . C " A" 9 . N " A" 9 . CA " A" 9 . C parsed_2mm9 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -15.54 . " A" 9 . N " A" 9 . CA " A" 9 . C " A" 10 . N parsed_2mm9 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.88 . " A" 9 . C " A" 10 . N " A" 10 . CA " A" 10 . C parsed_2mm9 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.82 . " A" 10 . N " A" 10 . CA " A" 10 . C " A" 11 . N parsed_2mm9 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.40 . " A" 10 . C " A" 11 . N " A" 11 . CA " A" 11 . C parsed_2mm9 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -17.32 . " A" 11 . N " A" 11 . CA " A" 11 . C " A" 12 . N parsed_2mm9 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -37.88 . " A" 11 . C " A" 12 . N " A" 12 . CA " A" 12 . C parsed_2mm9 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -16.40 . " A" 12 . N " A" 12 . CA " A" 12 . C " A" 13 . N parsed_2mm9 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.42 . " A" 12 . C " A" 13 . N " A" 13 . CA " A" 13 . C parsed_2mm9 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -13.28 . " A" 13 . N " A" 13 . CA " A" 13 . C " A" 14 . N parsed_2mm9 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -41.04 . " A" 13 . C " A" 14 . N " A" 14 . CA " A" 14 . C parsed_2mm9 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 9.84 . " A" 14 . N " A" 14 . CA " A" 14 . C " A" 15 . N parsed_2mm9 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -53.50 . " A" 14 . C " A" 15 . N " A" 15 . CA " A" 15 . C parsed_2mm9 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 29.98 . " A" 15 . N " A" 15 . CA " A" 15 . C " A" 16 . N parsed_2mm9 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -95.56 . " A" 18 . C " A" 19 . N " A" 19 . CA " A" 19 . C parsed_2mm9 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 186.42 . " A" 19 . N " A" 19 . CA " A" 19 . C " A" 20 . N parsed_2mm9 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -104.68 . " A" 19 . C " A" 20 . N " A" 20 . CA " A" 20 . C parsed_2mm9 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 170.08 . " A" 20 . N " A" 20 . CA " A" 20 . C " A" 21 . N parsed_2mm9 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -99.52 . " A" 20 . C " A" 21 . N " A" 21 . CA " A" 21 . C parsed_2mm9 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 158.50 . " A" 21 . N " A" 21 . CA " A" 21 . C " A" 22 . N parsed_2mm9 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -80.62 . " A" 21 . C " A" 22 . N " A" 22 . CA " A" 22 . C parsed_2mm9 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 150.60 . " A" 22 . N " A" 22 . CA " A" 22 . C " A" 23 . N parsed_2mm9 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -69.14 . " A" 22 . C " A" 23 . N " A" 23 . CA " A" 23 . C parsed_2mm9 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 168.94 . " A" 23 . N " A" 23 . CA " A" 23 . C " A" 24 . N parsed_2mm9 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -40.54 . " A" 23 . C " A" 24 . N " A" 24 . CA " A" 24 . C parsed_2mm9 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 184.54 . " A" 24 . N " A" 24 . CA " A" 24 . C " A" 25 . N parsed_2mm9 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -30.28 . " A" 27 . C " A" 28 . N " A" 28 . CA " A" 28 . C parsed_2mm9 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 30.10 . " A" 28 . N " A" 28 . CA " A" 28 . C " A" 29 . N parsed_2mm9 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -37.96 . " A" 28 . C " A" 29 . N " A" 29 . CA " A" 29 . C parsed_2mm9 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 17.00 . " A" 29 . N " A" 29 . CA " A" 29 . C " A" 30 . N parsed_2mm9 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.34 . " A" 29 . C " A" 30 . N " A" 30 . CA " A" 30 . C parsed_2mm9 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -23.80 . " A" 30 . N " A" 30 . CA " A" 30 . C " A" 31 . N parsed_2mm9 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -30.14 . " A" 30 . C " A" 31 . N " A" 31 . CA " A" 31 . C parsed_2mm9 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 170.10 . " A" 31 . N " A" 31 . CA " A" 31 . C " A" 32 . N parsed_2mm9 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -35.50 . " A" 31 . C " A" 32 . N " A" 32 . CA " A" 32 . C parsed_2mm9 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 170.82 . " A" 32 . N " A" 32 . CA " A" 32 . C " A" 33 . N parsed_2mm9 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -99.58 . " A" 32 . C " A" 33 . N " A" 33 . CA " A" 33 . C parsed_2mm9 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 180.94 . " A" 33 . N " A" 33 . CA " A" 33 . C " A" 34 . N parsed_2mm9 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -89.60 . " A" 33 . C " A" 34 . N " A" 34 . CA " A" 34 . C parsed_2mm9 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 175.26 . " A" 34 . N " A" 34 . CA " A" 34 . C " A" 35 . N parsed_2mm9 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -87.96 . " A" 34 . C " A" 35 . N " A" 35 . CA " A" 35 . C parsed_2mm9 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 184.00 . " A" 35 . N " A" 35 . CA " A" 35 . C " A" 36 . N parsed_2mm9 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -83.54 . " A" 35 . C " A" 36 . N " A" 36 . CA " A" 36 . C parsed_2mm9 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 163.20 . " A" 36 . N " A" 36 . CA " A" 36 . C " A" 37 . N parsed_2mm9 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -80.36 . " A" 36 . C " A" 37 . N " A" 37 . CA " A" 37 . C parsed_2mm9 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 153.70 . " A" 37 . N " A" 37 . CA " A" 37 . C " A" 38 . N parsed_2mm9 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -97.82 . " A" 37 . C " A" 38 . N " A" 38 . CA " A" 38 . C parsed_2mm9 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 169.36 . " A" 38 . N " A" 38 . CA " A" 38 . C " A" 39 . N parsed_2mm9 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -71.66 . " A" 38 . C " A" 39 . N " A" 39 . CA " A" 39 . C parsed_2mm9 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 167.30 . " A" 39 . N " A" 39 . CA " A" 39 . C " A" 40 . N parsed_2mm9 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -37.00 . " A" 39 . C " A" 40 . N " A" 40 . CA " A" 40 . C parsed_2mm9 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 13.52 . " A" 40 . N " A" 40 . CA " A" 40 . C " A" 41 . N parsed_2mm9 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -57.04 . " A" 40 . C " A" 41 . N " A" 41 . CA " A" 41 . C parsed_2mm9 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 7.40 . " A" 41 . N " A" 41 . CA " A" 41 . C " A" 42 . N parsed_2mm9 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -41.20 . " A" 41 . C " A" 42 . N " A" 42 . CA " A" 42 . C parsed_2mm9 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 20.44 . " A" 42 . N " A" 42 . CA " A" 42 . C " A" 43 . N parsed_2mm9 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -29.20 . " A" 42 . C " A" 43 . N " A" 43 . CA " A" 43 . C parsed_2mm9 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 152.80 . " A" 43 . N " A" 43 . CA " A" 43 . C " A" 44 . N parsed_2mm9 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 50.00 105.10 . " A" 43 . C " A" 44 . N " A" 44 . CA " A" 44 . C parsed_2mm9 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.00 44.90 . " A" 44 . N " A" 44 . CA " A" 44 . C " A" 45 . N parsed_2mm9 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -31.02 . " A" 44 . C " A" 45 . N " A" 45 . CA " A" 45 . C parsed_2mm9 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 191.70 . " A" 45 . N " A" 45 . CA " A" 45 . C " A" 46 . N parsed_2mm9 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -39.18 . " A" 45 . C " A" 46 . N " A" 46 . CA " A" 46 . C parsed_2mm9 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 200.78 . " A" 46 . N " A" 46 . CA " A" 46 . C " A" 47 . N parsed_2mm9 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -31.92 . " A" 46 . C " A" 47 . N " A" 47 . CA " A" 47 . C parsed_2mm9 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.16 . " A" 47 . N " A" 47 . CA " A" 47 . C " A" 48 . N parsed_2mm9 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -35.14 . " A" 47 . C " A" 48 . N " A" 48 . CA " A" 48 . C parsed_2mm9 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -17.90 . " A" 48 . N " A" 48 . CA " A" 48 . C " A" 49 . N parsed_2mm9 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.96 . " A" 48 . C " A" 49 . N " A" 49 . CA " A" 49 . C parsed_2mm9 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -29.72 . " A" 49 . N " A" 49 . CA " A" 49 . C " A" 50 . N parsed_2mm9 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -32.82 . " A" 49 . C " A" 50 . N " A" 50 . CA " A" 50 . C parsed_2mm9 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.32 . " A" 50 . N " A" 50 . CA " A" 50 . C " A" 51 . N parsed_2mm9 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.96 . " A" 50 . C " A" 51 . N " A" 51 . CA " A" 51 . C parsed_2mm9 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.54 . " A" 51 . N " A" 51 . CA " A" 51 . C " A" 52 . N parsed_2mm9 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -38.00 . " A" 51 . C " A" 52 . N " A" 52 . CA " A" 52 . C parsed_2mm9 1
88 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.02 . " A" 52 . N " A" 52 . CA " A" 52 . C " A" 53 . N parsed_2mm9 1
89 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.68 . " A" 52 . C " A" 53 . N " A" 53 . CA " A" 53 . C parsed_2mm9 1
90 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.32 . " A" 53 . N " A" 53 . CA " A" 53 . C " A" 54 . N parsed_2mm9 1
91 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.90 . " A" 53 . C " A" 54 . N " A" 54 . CA " A" 54 . C parsed_2mm9 1
92 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -18.72 . " A" 54 . N " A" 54 . CA " A" 54 . C " A" 55 . N parsed_2mm9 1
93 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -48.66 . " A" 54 . C " A" 55 . N " A" 55 . CA " A" 55 . C parsed_2mm9 1
94 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -13.42 . " A" 55 . N " A" 55 . CA " A" 55 . C " A" 56 . N parsed_2mm9 1
95 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.90 . " A" 55 . C " A" 56 . N " A" 56 . CA " A" 56 . C parsed_2mm9 1
96 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -11.12 . " A" 56 . N " A" 56 . CA " A" 56 . C " A" 57 . N parsed_2mm9 1
97 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -40.10 . " A" 56 . C " A" 57 . N " A" 57 . CA " A" 57 . C parsed_2mm9 1
98 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 2.14 . " A" 57 . N " A" 57 . CA " A" 57 . C " A" 58 . N parsed_2mm9 1
99 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -30.38 . " A" 58 . C " A" 59 . N " A" 59 . CA " A" 59 . C parsed_2mm9 1
100 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -38.24 . " A" 59 . N " A" 59 . CA " A" 59 . C " A" 60 . N parsed_2mm9 1
101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.70 . " A" 59 . C " A" 60 . N " A" 60 . CA " A" 60 . C parsed_2mm9 1
102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -20.06 . " A" 60 . N " A" 60 . CA " A" 60 . C " A" 61 . N parsed_2mm9 1
103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -47.02 . " A" 60 . C " A" 61 . N " A" 61 . CA " A" 61 . C parsed_2mm9 1
104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -19.22 . " A" 61 . N " A" 61 . CA " A" 61 . C " A" 62 . N parsed_2mm9 1
105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 -38.24 . " A" 61 . C " A" 62 . N " A" 62 . CA " A" 62 . C parsed_2mm9 1
106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -1.68 . " A" 62 . N " A" 62 . CA " A" 62 . C " A" 63 . N parsed_2mm9 1
107 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -50.44 . " A" 62 . C " A" 63 . N " A" 63 . CA " A" 63 . C parsed_2mm9 1
108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -9.36 . " A" 63 . N " A" 63 . CA " A" 63 . C " A" 64 . N parsed_2mm9 1
109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -33.02 . " A" 63 . C " A" 64 . N " A" 64 . CA " A" 64 . C parsed_2mm9 1
110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 17.24 . " A" 64 . N " A" 64 . CA " A" 64 . C " A" 65 . N parsed_2mm9 1
111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -16.60 . " A" 64 . C " A" 65 . N " A" 65 . CA " A" 65 . C parsed_2mm9 1
112 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 189.80 . " A" 65 . N " A" 65 . CA " A" 65 . C " A" 66 . N parsed_2mm9 1
113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.00 -50.50 . " A" 65 . C " A" 66 . N " A" 66 . CA " A" 66 . C parsed_2mm9 1
114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -17.54 . " A" 66 . N " A" 66 . CA " A" 66 . C " A" 67 . N parsed_2mm9 1
115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -106.76 . " A" 66 . C " A" 67 . N " A" 67 . CA " A" 67 . C parsed_2mm9 1
116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 179.46 . " A" 67 . N " A" 67 . CA " A" 67 . C " A" 68 . N parsed_2mm9 1
117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -82.04 . " A" 67 . C " A" 68 . N " A" 68 . CA " A" 68 . C parsed_2mm9 1
118 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 148.62 . " A" 68 . N " A" 68 . CA " A" 68 . C " A" 69 . N parsed_2mm9 1
119 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -77.48 . " A" 68 . C " A" 69 . N " A" 69 . CA " A" 69 . C parsed_2mm9 1
120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 157.24 . " A" 69 . N " A" 69 . CA " A" 69 . C " A" 70 . N parsed_2mm9 1
121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.00 -30.12 . " A" 69 . C " A" 70 . N " A" 70 . CA " A" 70 . C parsed_2mm9 1
122 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.00 138.94 . " A" 70 . N " A" 70 . CA " A" 70 . C " A" 71 . N parsed_2mm9 1
123 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -59.92 . " A" 70 . C " A" 71 . N " A" 71 . CA " A" 71 . C parsed_2mm9 1
124 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -14.20 . " A" 71 . N " A" 71 . CA " A" 71 . C " A" 72 . N parsed_2mm9 1
125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 170.00 -464.74 . " A" 71 . C " A" 72 . N " A" 72 . CA " A" 72 . C parsed_2mm9 1
126 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 174.22 . " A" 72 . N " A" 72 . CA " A" 72 . C " A" 73 . N parsed_2mm9 1
127 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -101.58 . " A" 72 . C " A" 73 . N " A" 73 . CA " A" 73 . C parsed_2mm9 1
128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 100.00 168.26 . " A" 73 . N " A" 73 . CA " A" 73 . C " A" 74 . N parsed_2mm9 1
129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -109.64 . " A" 73 . C " A" 74 . N " A" 74 . CA " A" 74 . C parsed_2mm9 1
130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 190.02 . " A" 74 . N " A" 74 . CA " A" 74 . C " A" 75 . N parsed_2mm9 1
131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -40.98 . " A" 74 . C " A" 75 . N " A" 75 . CA " A" 75 . C parsed_2mm9 1
132 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.00 181.24 . " A" 75 . N " A" 75 . CA " A" 75 . C " A" 76 . N parsed_2mm9 1
133 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -39.82 . " A" 75 . C " A" 76 . N " A" 76 . CA " A" 76 . C parsed_2mm9 1
134 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -10.10 . " A" 76 . N " A" 76 . CA " A" 76 . C " A" 77 . N parsed_2mm9 1
135 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -42.82 . " A" 76 . C " A" 77 . N " A" 77 . CA " A" 77 . C parsed_2mm9 1
136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.00 1.64 . " A" 77 . N " A" 77 . CA " A" 77 . C " A" 78 . N parsed_2mm9 1
137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -47.96 . " A" 77 . C " A" 78 . N " A" 78 . CA " A" 78 . C parsed_2mm9 1
138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 -7.30 . " A" 78 . N " A" 78 . CA " A" 78 . C " A" 79 . N parsed_2mm9 1
139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -58.88 . " A" 78 . C " A" 79 . N " A" 79 . CA " A" 79 . C parsed_2mm9 1
140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.00 9.12 . " A" 79 . N " A" 79 . CA " A" 79 . C " A" 80 . N parsed_2mm9 1
141 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -44.58 . " A" 80 . C " A" 81 . N " A" 81 . CA " A" 81 . C parsed_2mm9 1
142 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.00 191.30 . " A" 81 . N " A" 81 . CA " A" 81 . C " A" 82 . N parsed_2mm9 1
143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -39.52 . " A" 81 . C " A" 82 . N " A" 82 . CA " A" 82 . C parsed_2mm9 1
144 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 171.12 . " A" 82 . N " A" 82 . CA " A" 82 . C " A" 83 . N parsed_2mm9 1
145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -40.02 . " A" 84 . C " A" 85 . N " A" 85 . CA " A" 85 . C parsed_2mm9 1
146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -13.14 . " A" 85 . N " A" 85 . CA " A" 85 . C " A" 86 . N parsed_2mm9 1
147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -28.30 . " A" 85 . C " A" 86 . N " A" 86 . CA " A" 86 . C parsed_2mm9 1
148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 13.64 . " A" 86 . N " A" 86 . CA " A" 86 . C " A" 87 . N parsed_2mm9 1
149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.00 -40.42 . " A" 86 . C " A" 87 . N " A" 87 . CA " A" 87 . C parsed_2mm9 1
150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 19.50 . " A" 87 . N " A" 87 . CA " A" 87 . C " A" 88 . N parsed_2mm9 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mm9
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2mm9 1
2 1 . . . parsed_2mm9 1
3 1 . . . parsed_2mm9 1
4 1 . . . parsed_2mm9 1
5 1 . . . parsed_2mm9 1
6 1 . . . parsed_2mm9 1
7 1 . . . parsed_2mm9 1
8 1 . . . parsed_2mm9 1
9 1 . . . parsed_2mm9 1
10 1 . . . parsed_2mm9 1
11 1 . . . parsed_2mm9 1
12 1 . . . parsed_2mm9 1
13 1 . . . parsed_2mm9 1
14 1 . . . parsed_2mm9 1
15 1 . . . parsed_2mm9 1
16 1 . . . parsed_2mm9 1
17 1 . . . parsed_2mm9 1
18 1 . . . parsed_2mm9 1
19 1 . . . parsed_2mm9 1
20 1 . . . parsed_2mm9 1
21 1 . . . parsed_2mm9 1
22 1 . . . parsed_2mm9 1
23 1 . . . parsed_2mm9 1
24 1 . . . parsed_2mm9 1
25 1 . . . parsed_2mm9 1
26 1 . . . parsed_2mm9 1
27 1 . . . parsed_2mm9 1
28 1 . . . parsed_2mm9 1
29 1 . . . parsed_2mm9 1
30 1 . . . parsed_2mm9 1
31 1 . . . parsed_2mm9 1
32 1 . . . parsed_2mm9 1
33 1 . . . parsed_2mm9 1
34 1 . . . parsed_2mm9 1
35 1 . . . parsed_2mm9 1
36 1 . . . parsed_2mm9 1
37 1 . . . parsed_2mm9 1
38 1 . . . parsed_2mm9 1
39 1 . . . parsed_2mm9 1
40 1 . . . parsed_2mm9 1
41 1 . . . parsed_2mm9 1
42 1 . . . parsed_2mm9 1
43 1 . . . parsed_2mm9 1
44 1 . . . parsed_2mm9 1
45 1 . . . parsed_2mm9 1
46 1 . . . parsed_2mm9 1
47 1 . . . parsed_2mm9 1
48 1 . . . parsed_2mm9 1
49 1 . . . parsed_2mm9 1
50 1 . . . parsed_2mm9 1
51 1 . . . parsed_2mm9 1
52 1 . . . parsed_2mm9 1
53 1 . . . parsed_2mm9 1
54 1 . . . parsed_2mm9 1
55 1 . . . parsed_2mm9 1
56 1 . . . parsed_2mm9 1
57 1 . . . parsed_2mm9 1
58 1 . . . parsed_2mm9 1
59 1 . . . parsed_2mm9 1
60 1 . . . parsed_2mm9 1
61 1 . . . parsed_2mm9 1
62 1 . . . parsed_2mm9 1
63 1 . . . parsed_2mm9 1
64 1 . . . parsed_2mm9 1
65 1 . . . parsed_2mm9 1
66 1 . . . parsed_2mm9 1
67 1 . . . parsed_2mm9 1
68 1 . . . parsed_2mm9 1
69 1 . . . parsed_2mm9 1
70 1 . . . parsed_2mm9 1
71 1 . . . parsed_2mm9 1
72 1 . . . parsed_2mm9 1
73 1 . . . parsed_2mm9 1
74 1 . . . parsed_2mm9 1
75 1 . . . parsed_2mm9 1
76 1 . . . parsed_2mm9 1
77 1 . . . parsed_2mm9 1
78 1 . . . parsed_2mm9 1
79 1 . . . parsed_2mm9 1
80 1 . . . parsed_2mm9 1
81 1 . . . parsed_2mm9 1
82 1 . . . parsed_2mm9 1
83 1 . . . parsed_2mm9 1
84 1 . . . parsed_2mm9 1
85 1 . . . parsed_2mm9 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . " A" 8 . HN parsed_2mm9 1
1 1 2 . . . . . . . . " A" 4 . O parsed_2mm9 1
2 1 1 . . . . . . . . " A" 14 . HN parsed_2mm9 1
2 1 2 . . . . . . . . " A" 10 . O parsed_2mm9 1
3 1 1 . . . . . . . . " A" 12 . HN parsed_2mm9 1
3 1 2 . . . . . . . . " A" 8 . O parsed_2mm9 1
4 1 1 . . . . . . . . " A" 15 . HN parsed_2mm9 1
4 1 2 . . . . . . . . " A" 11 . O parsed_2mm9 1
5 1 1 . . . . . . . . " A" 16 . HN parsed_2mm9 1
5 1 2 . . . . . . . . " A" 12 . O parsed_2mm9 1
6 1 1 . . . . . . . . " A" 11 . HN parsed_2mm9 1
6 1 2 . . . . . . . . " A" 7 . O parsed_2mm9 1
7 1 1 . . . . . . . . " A" 45 . HN parsed_2mm9 1
7 1 2 . . . . . . . . " A" 42 . O parsed_2mm9 1
8 1 1 . . . . . . . . " A" 50 . HN parsed_2mm9 1
8 1 2 . . . . . . . . " A" 46 . O parsed_2mm9 1
9 1 1 . . . . . . . . " A" 51 . HN parsed_2mm9 1
9 1 2 . . . . . . . . " A" 47 . O parsed_2mm9 1
10 1 1 . . . . . . . . " A" 62 . HN parsed_2mm9 1
10 1 2 . . . . . . . . " A" 58 . O parsed_2mm9 1
11 1 1 . . . . . . . . " A" 58 . HN parsed_2mm9 1
11 1 2 . . . . . . . . " A" 54 . O parsed_2mm9 1
12 1 1 . . . . . . . . " A" 54 . HN parsed_2mm9 1
12 1 2 . . . . . . . . " A" 50 . O parsed_2mm9 1
13 1 1 . . . . . . . . " A" 52 . HN parsed_2mm9 1
13 1 2 . . . . . . . . " A" 48 . O parsed_2mm9 1
14 1 1 . . . . . . . . " A" 55 . HN parsed_2mm9 1
14 1 2 . . . . . . . . " A" 51 . O parsed_2mm9 1
15 1 1 . . . . . . . . " A" 56 . HN parsed_2mm9 1
15 1 2 . . . . . . . . " A" 52 . O parsed_2mm9 1
16 1 1 . . . . . . . . " A" 57 . HN parsed_2mm9 1
16 1 2 . . . . . . . . " A" 53 . O parsed_2mm9 1
17 1 1 . . . . . . . . " A" 59 . HN parsed_2mm9 1
17 1 2 . . . . . . . . " A" 56 . O parsed_2mm9 1
18 1 1 . . . . . . . . " A" 61 . HN parsed_2mm9 1
18 1 2 . . . . . . . . " A" 58 . O parsed_2mm9 1
19 1 1 . . . . . . . . " A" 65 . HN parsed_2mm9 1
19 1 2 . . . . . . . . " A" 61 . O parsed_2mm9 1
20 1 1 . . . . . . . . " A" 80 . HN parsed_2mm9 1
20 1 2 . . . . . . . . " A" 76 . O parsed_2mm9 1
21 1 1 . . . . . . . . " A" 38 . O parsed_2mm9 1
21 1 2 . . . . . . . . " A" 19 . HN parsed_2mm9 1
22 1 1 . . . . . . . . " A" 38 . HN parsed_2mm9 1
22 1 2 . . . . . . . . " A" 19 . O parsed_2mm9 1
23 1 1 . . . . . . . . " A" 21 . HN parsed_2mm9 1
23 1 2 . . . . . . . . " A" 36 . O parsed_2mm9 1
24 1 1 . . . . . . . . " A" 36 . HN parsed_2mm9 1
24 1 2 . . . . . . . . " A" 21 . O parsed_2mm9 1
25 1 1 . . . . . . . . " A" 23 . HN parsed_2mm9 1
25 1 2 . . . . . . . . " A" 34 . O parsed_2mm9 1
26 1 1 . . . . . . . . " A" 34 . HN parsed_2mm9 1
26 1 2 . . . . . . . . " A" 23 . O parsed_2mm9 1
27 1 1 . . . . . . . . " A" 33 . HN parsed_2mm9 1
27 1 2 . . . . . . . . " A" 67 . O parsed_2mm9 1
28 1 1 . . . . . . . . " A" 35 . HN parsed_2mm9 1
28 1 2 . . . . . . . . " A" 69 . O parsed_2mm9 1
29 1 1 . . . . . . . . " A" 37 . HN parsed_2mm9 1
29 1 2 . . . . . . . . " A" 72 . O parsed_2mm9 1
30 1 1 . . . . . . . . " A" 69 . HN parsed_2mm9 1
30 1 2 . . . . . . . . " A" 33 . O parsed_2mm9 1
31 1 1 . . . . . . . . " A" 71 . HN parsed_2mm9 1
31 1 2 . . . . . . . . " A" 35 . O parsed_2mm9 1
32 1 1 . . . . . . . . " A" 74 . HN parsed_2mm9 1
32 1 2 . . . . . . . . " A" 37 . O parsed_2mm9 1
33 1 1 . . . . . . . . " A" 39 . HN parsed_2mm9 1
33 1 2 . . . . . . . . " A" 74 . O parsed_2mm9 1
34 1 1 . . . . . . . . " A" 42 . HN parsed_2mm9 1
34 1 2 . . . . . . . . " A" 39 . O parsed_2mm9 1
35 1 1 . . . . . . . . " A" 43 . HN parsed_2mm9 1
35 1 2 . . . . . . . . " A" 40 . O parsed_2mm9 1
36 1 1 . . . . . . . . " A" 6 . HN parsed_2mm9 1
36 1 2 . . . . . . . . " A" 3 . O parsed_2mm9 1
37 1 1 . . . . . . . . " A" 3 . O parsed_2mm9 1
37 1 2 . . . . . . . . " A" 7 . HN parsed_2mm9 1
38 1 1 . . . . . . . . " A" 4 . O parsed_2mm9 1
38 1 2 . . . . . . . . " A" 7 . HN parsed_2mm9 1
39 1 1 . . . . . . . . " A" 9 . HN parsed_2mm9 1
39 1 2 . . . . . . . . " A" 5 . O parsed_2mm9 1
40 1 1 . . . . . . . . " A" 9 . HN parsed_2mm9 1
40 1 2 . . . . . . . . " A" 6 . O parsed_2mm9 1
41 1 1 . . . . . . . . " A" 6 . O parsed_2mm9 1
41 1 2 . . . . . . . . " A" 10 . HN parsed_2mm9 1
42 1 1 . . . . . . . . " A" 13 . HN parsed_2mm9 1
42 1 2 . . . . . . . . " A" 9 . O parsed_2mm9 1
43 1 1 . . . . . . . . " A" 10 . O parsed_2mm9 1
43 1 2 . . . . . . . . " A" 13 . HN parsed_2mm9 1
44 1 1 . . . . . . . . " A" 46 . O parsed_2mm9 1
44 1 2 . . . . . . . . " A" 49 . HN parsed_2mm9 1
45 1 1 . . . . . . . . " A" 50 . HN parsed_2mm9 1
45 1 2 . . . . . . . . " A" 47 . O parsed_2mm9 1
46 1 1 . . . . . . . . " A" 51 . HN parsed_2mm9 1
46 1 2 . . . . . . . . " A" 48 . O parsed_2mm9 1
47 1 1 . . . . . . . . " A" 53 . HN parsed_2mm9 1
47 1 2 . . . . . . . . " A" 49 . O parsed_2mm9 1
48 1 1 . . . . . . . . " A" 50 . O parsed_2mm9 1
48 1 2 . . . . . . . . " A" 53 . HN parsed_2mm9 1
49 1 1 . . . . . . . . " A" 54 . HN parsed_2mm9 1
49 1 2 . . . . . . . . " A" 51 . O parsed_2mm9 1
50 1 1 . . . . . . . . " A" 57 . HN parsed_2mm9 1
50 1 2 . . . . . . . . " A" 54 . O parsed_2mm9 1
51 1 1 . . . . . . . . " A" 58 . HN parsed_2mm9 1
51 1 2 . . . . . . . . " A" 55 . O parsed_2mm9 1
52 1 1 . . . . . . . . " A" 62 . HN parsed_2mm9 1
52 1 2 . . . . . . . . " A" 59 . O parsed_2mm9 1
53 1 1 . . . . . . . . " A" 59 . O parsed_2mm9 1
53 1 2 . . . . . . . . " A" 63 . HN parsed_2mm9 1
54 1 1 . . . . . . . . " A" 63 . HN parsed_2mm9 1
54 1 2 . . . . . . . . " A" 60 . O parsed_2mm9 1
55 1 1 . . . . . . . . " A" 60 . O parsed_2mm9 1
55 1 2 . . . . . . . . " A" 64 . HN parsed_2mm9 1
56 1 1 . . . . . . . . " A" 61 . O parsed_2mm9 1
56 1 2 . . . . . . . . " A" 64 . HN parsed_2mm9 1
57 1 1 . . . . . . . . " A" 65 . HN parsed_2mm9 1
57 1 2 . . . . . . . . " A" 62 . O parsed_2mm9 1
58 1 1 . . . . . . . . " A" 78 . HN parsed_2mm9 1
58 1 2 . . . . . . . . " A" 75 . O parsed_2mm9 1
59 1 1 . . . . . . . . " A" 75 . O parsed_2mm9 1
59 1 2 . . . . . . . . " A" 79 . HN parsed_2mm9 1
60 1 1 . . . . . . . . " A" 4 . HZ# parsed_2mm9 1
60 1 2 . . . . . . . . " A" 8 . OE2 parsed_2mm9 1
61 1 1 . . . . . . . . " A" 4 . HZ# parsed_2mm9 1
61 1 2 . . . . . . . . " A" 22 . O parsed_2mm9 1
62 1 1 . . . . . . . . " A" 22 . HN parsed_2mm9 1
62 1 2 . . . . . . . . " A" 8 . OE2 parsed_2mm9 1
63 1 1 . . . . . . . . " A" 26 . HN parsed_2mm9 1
63 1 2 . . . . . . . . " A" 24 . OD1 parsed_2mm9 1
64 1 1 . . . . . . . . " A" 24 . OD1 parsed_2mm9 1
64 1 2 . . . . . . . . " A" 26 . HG parsed_2mm9 1
65 1 1 . . . . . . . . " A" 32 . HN parsed_2mm9 1
65 1 2 . . . . . . . . " A" 26 . OG parsed_2mm9 1
66 1 1 . . . . . . . . " A" 31 . HN parsed_2mm9 1
66 1 2 . . . . . . . . " A" 26 . OG parsed_2mm9 1
67 1 1 . . . . . . . . " A" 26 . HG parsed_2mm9 1
67 1 2 . . . . . . . . " A" 32 . O parsed_2mm9 1
68 1 1 . . . . . . . . " A" 26 . HG parsed_2mm9 1
68 1 2 . . . . . . . . " A" 32 . OG parsed_2mm9 1
69 1 1 . . . . . . . . " A" 34 . OE1 parsed_2mm9 1
69 1 2 . . . . . . . . " A" 69 . HG parsed_2mm9 1
70 1 1 . . . . . . . . " A" 34 . OE2 parsed_2mm9 1
70 1 2 . . . . . . . . " A" 71 . HZ# parsed_2mm9 1
71 1 1 . . . . . . . . " A" 41 . HN parsed_2mm9 1
71 1 2 . . . . . . . . " A" 39 . OG parsed_2mm9 1
72 1 1 . . . . . . . . " A" 39 . HG parsed_2mm9 1
72 1 2 . . . . . . . . " A" 15 . O parsed_2mm9 1
73 1 1 . . . . . . . . " A" 52 . HH21 parsed_2mm9 1
73 1 2 . . . . . . . . " A" 49 . OE2 parsed_2mm9 1
74 1 1 . . . . . . . . " A" 50 . HE parsed_2mm9 1
74 1 2 . . . . . . . . " A" 45 . O parsed_2mm9 1
75 1 1 . . . . . . . . " A" 50 . HE parsed_2mm9 1
75 1 2 . . . . . . . . " A" 42 . O parsed_2mm9 1
76 1 1 . . . . . . . . " A" 50 . HH11 parsed_2mm9 1
76 1 2 . . . . . . . . " A" 73 . O parsed_2mm9 1
77 1 1 . . . . . . . . " A" 50 . HH12 parsed_2mm9 1
77 1 2 . . . . . . . . " A" 78 . OE1 parsed_2mm9 1
78 1 1 . . . . . . . . " A" 50 . HH21 parsed_2mm9 1
78 1 2 . . . . . . . . " A" 42 . O parsed_2mm9 1
79 1 1 . . . . . . . . " A" 50 . HH22 parsed_2mm9 1
79 1 2 . . . . . . . . " A" 45 . O parsed_2mm9 1
80 1 1 . . . . . . . . " A" 55 . HD21 parsed_2mm9 1
80 1 2 . . . . . . . . " A" 51 . O parsed_2mm9 1
81 1 1 . . . . . . . . " A" 63 . HZ# parsed_2mm9 1
81 1 2 . . . . . . . . " A" 59 . OE1 parsed_2mm9 1
82 1 1 . . . . . . . . " A" 6 . HE21 parsed_2mm9 1
82 1 2 . . . . . . . . " A" 61 . OE1 parsed_2mm9 1
83 1 1 . . . . . . . . " A" 33 . O parsed_2mm9 1
83 1 2 . . . . . . . . " A" 69 . HG parsed_2mm9 1
84 1 1 . . . . . . . . " A" 78 . HN parsed_2mm9 1
84 1 2 . . . . . . . . " A" 75 . OG1 parsed_2mm9 1
85 1 1 . . . . . . . . " A" 75 . HN parsed_2mm9 1
85 1 2 . . . . . . . . " A" 78 . OE1 parsed_2mm9 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
2 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
3 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
4 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
5 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
6 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
7 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
8 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
9 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
10 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
11 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
12 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
13 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
14 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
15 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
16 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
17 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
18 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
19 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
20 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
21 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
22 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
23 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
24 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
25 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
26 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
27 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
28 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
29 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
30 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
31 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
32 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
33 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
34 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
35 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
36 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
37 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
38 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
39 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
40 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
41 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
42 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
43 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
44 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
45 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
46 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
47 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
48 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
49 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
50 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
51 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
52 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
53 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
54 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
55 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
56 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
57 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
58 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
59 1 . . . . . 2.200 1.730 2.700 parsed_2mm9 1
60 1 . . . . . 3.400 1.730 4.000 parsed_2mm9 1
61 1 . . . . . 2.400 1.730 4.000 parsed_2mm9 1
62 1 . . . . . 2.900 1.730 4.000 parsed_2mm9 1
63 1 . . . . . 2.900 1.730 4.000 parsed_2mm9 1
64 1 . . . . . 2.600 1.730 4.000 parsed_2mm9 1
65 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
66 1 . . . . . 2.800 1.730 4.000 parsed_2mm9 1
67 1 . . . . . 3.300 1.730 4.000 parsed_2mm9 1
68 1 . . . . . 3.400 1.730 4.000 parsed_2mm9 1
69 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
70 1 . . . . . 2.700 1.730 4.000 parsed_2mm9 1
71 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
72 1 . . . . . 2.600 1.730 4.000 parsed_2mm9 1
73 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
74 1 . . . . . 2.800 1.730 4.000 parsed_2mm9 1
75 1 . . . . . 3.200 1.730 4.000 parsed_2mm9 1
76 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
77 1 . . . . . 2.900 1.730 4.000 parsed_2mm9 1
78 1 . . . . . 3.200 1.730 4.000 parsed_2mm9 1
79 1 . . . . . 3.300 1.730 4.000 parsed_2mm9 1
80 1 . . . . . 3.300 1.730 4.000 parsed_2mm9 1
81 1 . . . . . 2.800 1.730 4.000 parsed_2mm9 1
82 1 . . . . . 2.800 1.730 4.000 parsed_2mm9 1
83 1 . . . . . 3.400 1.730 4.000 parsed_2mm9 1
84 1 . . . . . 3.300 1.730 4.000 parsed_2mm9 1
85 1 . . . . . 3.000 1.730 4.000 parsed_2mm9 1
stop_
save_
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