Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
649947 | 6nm3 RC | 30558 | cing | 2-parsed | STAR | entry | full | 145 |
data_6nm3_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6nm3
_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_6nm3 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6nm3
_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 6nm3 "Master copy" parsed_6nm3
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6nm3
_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 6nm3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6nm3 1
1 6nm3.mr . . XPLOR/CNS 2 distance NOE simple 135 parsed_6nm3 1
1 6nm3.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 10 parsed_6nm3 1
1 6nm3.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6nm3 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_6nm3
_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 ANTIMICROBIAL PROTEIN 10-JAN-19 6NM3
*TITLE NMR STRUCTURE OF WW295
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: WW295 PEPTIDE;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;
*SOURCE 4 ORGANISM_TAXID: 32630
*KEYWDS ANTIMICROBIAL PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 5
*AUTHOR G.WANG,D.ZARENA
*REVDAT 1 15-JUL-20 6NM3 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6nm3
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_6nm3 1
2 1 . . . parsed_6nm3 1
3 1 . . . parsed_6nm3 1
4 1 . . . parsed_6nm3 1
5 1 . . . parsed_6nm3 1
6 1 . . . parsed_6nm3 1
7 1 . . . parsed_6nm3 1
8 1 . . . parsed_6nm3 1
9 1 . . . parsed_6nm3 1
10 1 . . . parsed_6nm3 1
11 1 . . . parsed_6nm3 1
12 1 . . . parsed_6nm3 1
13 1 . . . parsed_6nm3 1
14 1 . . . parsed_6nm3 1
15 1 . . . parsed_6nm3 1
16 1 . . . parsed_6nm3 1
17 1 . . . parsed_6nm3 1
18 1 . . . parsed_6nm3 1
19 1 . . . parsed_6nm3 1
20 1 . . . parsed_6nm3 1
21 1 . . . parsed_6nm3 1
22 1 . . . parsed_6nm3 1
23 1 . . . parsed_6nm3 1
24 1 . . . parsed_6nm3 1
25 1 . . . parsed_6nm3 1
26 1 . . . parsed_6nm3 1
27 1 . . . parsed_6nm3 1
28 1 . . . parsed_6nm3 1
29 1 . . . parsed_6nm3 1
30 1 . . . parsed_6nm3 1
31 1 . . . parsed_6nm3 1
32 1 . . . parsed_6nm3 1
33 1 . . . parsed_6nm3 1
34 1 . . . parsed_6nm3 1
35 1 . . . parsed_6nm3 1
36 1 . . . parsed_6nm3 1
37 1 . . . parsed_6nm3 1
38 1 . . . parsed_6nm3 1
39 1 . . . parsed_6nm3 1
40 1 . . . parsed_6nm3 1
41 1 . . . parsed_6nm3 1
42 1 . . . parsed_6nm3 1
43 1 . . . parsed_6nm3 1
44 1 . . . parsed_6nm3 1
45 1 . . . parsed_6nm3 1
46 1 . . . parsed_6nm3 1
47 1 . . . parsed_6nm3 1
48 1 . . . parsed_6nm3 1
49 1 . . . parsed_6nm3 1
50 1 . . . parsed_6nm3 1
51 1 . . . parsed_6nm3 1
52 1 . . . parsed_6nm3 1
53 1 . . . parsed_6nm3 1
54 1 . . . parsed_6nm3 1
55 1 . . . parsed_6nm3 1
56 1 . . . parsed_6nm3 1
57 1 . . . parsed_6nm3 1
58 1 . . . parsed_6nm3 1
59 1 . . . parsed_6nm3 1
60 1 . . . parsed_6nm3 1
61 1 . . . parsed_6nm3 1
62 1 . . . parsed_6nm3 1
63 1 . . . parsed_6nm3 1
64 1 . . . parsed_6nm3 1
65 1 . . . parsed_6nm3 1
66 1 . . . parsed_6nm3 1
67 1 . . . parsed_6nm3 1
68 1 . . . parsed_6nm3 1
69 1 . . . parsed_6nm3 1
70 1 . . . parsed_6nm3 1
71 1 . . . parsed_6nm3 1
72 1 . . . parsed_6nm3 1
73 1 . . . parsed_6nm3 1
74 1 . . . parsed_6nm3 1
75 1 . . . parsed_6nm3 1
76 1 . . . parsed_6nm3 1
77 1 . . . parsed_6nm3 1
78 1 . . . parsed_6nm3 1
79 1 . . . parsed_6nm3 1
80 1 . . . parsed_6nm3 1
81 1 . . . parsed_6nm3 1
82 1 . . . parsed_6nm3 1
83 1 . . . parsed_6nm3 1
84 1 . . . parsed_6nm3 1
85 1 . . . parsed_6nm3 1
86 1 . . . parsed_6nm3 1
87 1 . . . parsed_6nm3 1
88 1 . . . parsed_6nm3 1
89 1 . . . parsed_6nm3 1
90 1 . . . parsed_6nm3 1
91 1 . . . parsed_6nm3 1
92 1 . . . parsed_6nm3 1
93 1 . . . parsed_6nm3 1
94 1 . . . parsed_6nm3 1
95 1 . . . parsed_6nm3 1
96 1 . . . parsed_6nm3 1
97 1 . . . parsed_6nm3 1
98 1 . . . parsed_6nm3 1
99 1 . . . parsed_6nm3 1
100 1 . . . parsed_6nm3 1
101 1 . . . parsed_6nm3 1
102 1 . . . parsed_6nm3 1
103 1 . . . parsed_6nm3 1
104 1 . . . parsed_6nm3 1
105 1 . . . parsed_6nm3 1
106 1 . . . parsed_6nm3 1
107 1 . . . parsed_6nm3 1
108 1 . . . parsed_6nm3 1
109 1 . . . parsed_6nm3 1
110 1 . . . parsed_6nm3 1
111 1 . . . parsed_6nm3 1
112 1 . . . parsed_6nm3 1
113 1 . . . parsed_6nm3 1
114 1 . . . parsed_6nm3 1
115 1 . . . parsed_6nm3 1
116 1 . . . parsed_6nm3 1
117 1 . . . parsed_6nm3 1
118 1 . . . parsed_6nm3 1
119 1 . . . parsed_6nm3 1
120 1 . . . parsed_6nm3 1
121 1 . . . parsed_6nm3 1
122 1 . . . parsed_6nm3 1
123 1 . . . parsed_6nm3 1
124 1 . . . parsed_6nm3 1
125 1 . . . parsed_6nm3 1
126 1 . . . parsed_6nm3 1
127 1 . . . parsed_6nm3 1
128 1 . . . parsed_6nm3 1
129 1 . . . parsed_6nm3 1
130 1 . . . parsed_6nm3 1
131 1 . . . parsed_6nm3 1
132 1 . . . parsed_6nm3 1
133 1 . . . parsed_6nm3 1
134 1 . . . parsed_6nm3 1
135 1 . . . parsed_6nm3 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 . . . . . . . . . 1 . HB# parsed_6nm3 1
1 1 2 . . . . . . . . . 1 . HD# parsed_6nm3 1
2 1 1 . . . . . . . . . 1 . HB# parsed_6nm3 1
2 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
3 1 1 . . . . . . . . . 1 . HB# parsed_6nm3 1
3 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
4 1 1 . . . . . . . . . 1 . HB# parsed_6nm3 1
4 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
5 1 1 . . . . . . . . . 2 . HG# parsed_6nm3 1
5 1 2 . . . . . . . . . 2 . HA parsed_6nm3 1
6 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
6 1 2 . . . . . . . . . 2 . HA parsed_6nm3 1
7 1 1 . . . . . . . . . 2 . HA parsed_6nm3 1
7 1 2 . . . . . . . . . 3 . HB parsed_6nm3 1
8 1 1 . . . . . . . . . 2 . HA parsed_6nm3 1
8 1 2 . . . . . . . . . 3 . HN parsed_6nm3 1
9 1 1 . . . . . . . . . 2 . HE# parsed_6nm3 1
9 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
10 1 1 . . . . . . . . . 2 . HG# parsed_6nm3 1
10 1 2 . . . . . . . . . 4 . HZ2 parsed_6nm3 1
11 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
11 1 2 . . . . . . . . . 4 . HZ2 parsed_6nm3 1
12 1 1 . . . . . . . . . 2 . HG# parsed_6nm3 1
12 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
13 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
13 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
14 1 1 . . . . . . . . . 2 . HG# parsed_6nm3 1
14 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
15 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
15 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
16 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
16 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
17 1 1 . . . . . . . . . 2 . HG# parsed_6nm3 1
17 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
18 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
18 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
19 1 1 . . . . . . . . . 2 . HD# parsed_6nm3 1
19 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
20 1 1 . . . . . . . . . 3 . HD1# parsed_6nm3 1
20 1 2 . . . . . . . . . 3 . HN parsed_6nm3 1
21 1 1 . . . . . . . . . 3 . HG12 parsed_6nm3 1
21 1 2 . . . . . . . . . 3 . HA parsed_6nm3 1
22 1 1 . . . . . . . . . 3 . HG11 parsed_6nm3 1
22 1 2 . . . . . . . . . 3 . HA parsed_6nm3 1
23 1 1 . . . . . . . . . 3 . HN parsed_6nm3 1
23 1 2 . . . . . . . . . 3 . HG12 parsed_6nm3 1
24 1 1 . . . . . . . . . 3 . HN parsed_6nm3 1
24 1 2 . . . . . . . . . 3 . HG11 parsed_6nm3 1
25 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
25 1 2 . . . . . . . . . 3 . HN parsed_6nm3 1
26 1 1 . . . . . . . . . 3 . HN parsed_6nm3 1
26 1 2 . . . . . . . . . 3 . HB parsed_6nm3 1
27 1 1 . . . . . . . . . 3 . HG12 parsed_6nm3 1
27 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
28 1 1 . . . . . . . . . 3 . HG12 parsed_6nm3 1
28 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
29 1 1 . . . . . . . . . 3 . HG11 parsed_6nm3 1
29 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
30 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
30 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
31 1 1 . . . . . . . . . 3 . HB parsed_6nm3 1
31 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
32 1 1 . . . . . . . . . 3 . HN parsed_6nm3 1
32 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
33 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
33 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
34 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
34 1 2 . . . . . . . . . 4 . HD1 parsed_6nm3 1
35 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
35 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
36 1 1 . . . . . . . . . 3 . HA parsed_6nm3 1
36 1 2 . . . . . . . . . 4 . HN parsed_6nm3 1
37 1 1 . . . . . . . . . 3 . HG1# parsed_6nm3 1
37 1 2 . . . . . . . . . 5 . HZ2 parsed_6nm3 1
38 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
38 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
39 1 1 . . . . . . . . . 3 . HG12 parsed_6nm3 1
39 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
40 1 1 . . . . . . . . . 3 . HD1# parsed_6nm3 1
40 1 2 . . . . . . . . . 5 . HZ2 parsed_6nm3 1
41 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
41 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
42 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
42 1 2 . . . . . . . . . 5 . HZ2 parsed_6nm3 1
43 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
43 1 2 . . . . . . . . . 5 . HN parsed_6nm3 1
44 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
44 1 2 . . . . . . . . . 5 . HE1 parsed_6nm3 1
45 1 1 . . . . . . . . . 3 . HG1# parsed_6nm3 1
45 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
46 1 1 . . . . . . . . . 3 . HD1# parsed_6nm3 1
46 1 2 . . . . . . . . . 6 . HZ2 parsed_6nm3 1
47 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
47 1 2 . . . . . . . . . 6 . HZ2 parsed_6nm3 1
48 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
48 1 2 . . . . . . . . . 6 . HD1 parsed_6nm3 1
49 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
49 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
50 1 1 . . . . . . . . . 3 . HG1# parsed_6nm3 1
50 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
51 1 1 . . . . . . . . . 3 . HG2# parsed_6nm3 1
51 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
52 1 1 . . . . . . . . . 4 . HB1 parsed_6nm3 1
52 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
53 1 1 . . . . . . . . . 4 . HN parsed_6nm3 1
53 1 2 . . . . . . . . . 4 . HE3 parsed_6nm3 1
54 1 1 . . . . . . . . . 4 . HB2 parsed_6nm3 1
54 1 2 . . . . . . . . . 4 . HE1 parsed_6nm3 1
55 1 1 . . . . . . . . . 4 . HN parsed_6nm3 1
55 1 2 . . . . . . . . . 4 . HB1 parsed_6nm3 1
56 1 1 . . . . . . . . . 4 . HN parsed_6nm3 1
56 1 2 . . . . . . . . . 4 . HB2 parsed_6nm3 1
57 1 1 . . . . . . . . . 4 . HZ3 parsed_6nm3 1
57 1 2 . . . . . . . . . 4 . HA parsed_6nm3 1
58 1 1 . . . . . . . . . 4 . HB1 parsed_6nm3 1
58 1 2 . . . . . . . . . 4 . HD1 parsed_6nm3 1
59 1 1 . . . . . . . . . 4 . HE1 parsed_6nm3 1
59 1 2 . . . . . . . . . 4 . HB# parsed_6nm3 1
60 1 1 . . . . . . . . . 4 . HB2 parsed_6nm3 1
60 1 2 . . . . . . . . . 4 . HD1 parsed_6nm3 1
61 1 1 . . . . . . . . . 4 . HE1 parsed_6nm3 1
61 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
62 1 1 . . . . . . . . . 4 . HB2 parsed_6nm3 1
62 1 2 . . . . . . . . . 5 . HE3 parsed_6nm3 1
63 1 1 . . . . . . . . . 4 . HB1 parsed_6nm3 1
63 1 2 . . . . . . . . . 5 . HN parsed_6nm3 1
64 1 1 . . . . . . . . . 4 . HN parsed_6nm3 1
64 1 2 . . . . . . . . . 5 . HN parsed_6nm3 1
65 1 1 . . . . . . . . . 4 . HB2 parsed_6nm3 1
65 1 2 . . . . . . . . . 5 . HN parsed_6nm3 1
66 1 1 . . . . . . . . . 4 . HA parsed_6nm3 1
66 1 2 . . . . . . . . . 5 . HN parsed_6nm3 1
67 1 1 . . . . . . . . . 4 . HA parsed_6nm3 1
67 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
68 1 1 . . . . . . . . . 4 . HE3 parsed_6nm3 1
68 1 2 . . . . . . . . . 8 . HD1# parsed_6nm3 1
69 1 1 . . . . . . . . . 4 . HZ3 parsed_6nm3 1
69 1 2 . . . . . . . . . 8 . HD1# parsed_6nm3 1
70 1 1 . . . . . . . . . 4 . HZ2 parsed_6nm3 1
70 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
71 1 1 . . . . . . . . . 4 . HN parsed_6nm3 1
71 1 2 . . . . . . . . . 4 . HD1 parsed_6nm3 1
72 1 1 . . . . . . . . . 5 . HB2 parsed_6nm3 1
72 1 2 . . . . . . . . . 5 . HE3 parsed_6nm3 1
73 1 1 . . . . . . . . . 5 . HB1 parsed_6nm3 1
73 1 2 . . . . . . . . . 5 . HE3 parsed_6nm3 1
74 1 1 . . . . . . . . . 5 . HA parsed_6nm3 1
74 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
75 1 1 . . . . . . . . . 5 . HN parsed_6nm3 1
75 1 2 . . . . . . . . . 5 . HB1 parsed_6nm3 1
76 1 1 . . . . . . . . . 5 . HB1 parsed_6nm3 1
76 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
77 1 1 . . . . . . . . . 5 . HE parsed_6nm3 1
77 1 2 . . . . . . . . . 5 . HB1 parsed_6nm3 1
78 1 1 . . . . . . . . . 5 . HB2 parsed_6nm3 1
78 1 2 . . . . . . . . . 5 . HD1 parsed_6nm3 1
79 1 1 . . . . . . . . . 5 . HE3 parsed_6nm3 1
79 1 2 . . . . . . . . . 5 . HA parsed_6nm3 1
80 1 1 . . . . . . . . . 5 . HE1 parsed_6nm3 1
80 1 2 . . . . . . . . . 6 . HB# parsed_6nm3 1
81 1 1 . . . . . . . . . 5 . HB2 parsed_6nm3 1
81 1 2 . . . . . . . . . 6 . HN parsed_6nm3 1
82 1 1 . . . . . . . . . 5 . HB1 parsed_6nm3 1
82 1 2 . . . . . . . . . 6 . HN parsed_6nm3 1
83 1 1 . . . . . . . . . 5 . HA parsed_6nm3 1
83 1 2 . . . . . . . . . 6 . HN parsed_6nm3 1
84 1 1 . . . . . . . . . 5 . HB2 parsed_6nm3 1
84 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
85 1 1 . . . . . . . . . 5 . HA parsed_6nm3 1
85 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
86 1 1 . . . . . . . . . 5 . HD1 parsed_6nm3 1
86 1 2 . . . . . . . . . 8 . HD1# parsed_6nm3 1
87 1 1 . . . . . . . . . 5 . HE3 parsed_6nm3 1
87 1 2 . . . . . . . . . 8 . HD1# parsed_6nm3 1
88 1 1 . . . . . . . . . 6 . HA parsed_6nm3 1
88 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
89 1 1 . . . . . . . . . 6 . HB2 parsed_6nm3 1
89 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
90 1 1 . . . . . . . . . 6 . HB1 parsed_6nm3 1
90 1 2 . . . . . . . . . 6 . HE1 parsed_6nm3 1
91 1 1 . . . . . . . . . 6 . HA parsed_6nm3 1
91 1 2 . . . . . . . . . 6 . HD1 parsed_6nm3 1
92 1 1 . . . . . . . . . 6 . HB2 parsed_6nm3 1
92 1 2 . . . . . . . . . 6 . HD1 parsed_6nm3 1
93 1 1 . . . . . . . . . 6 . HE1 parsed_6nm3 1
93 1 2 . . . . . . . . . 6 . HB2 parsed_6nm3 1
94 1 1 . . . . . . . . . 6 . HB1 parsed_6nm3 1
94 1 2 . . . . . . . . . 6 . HD1 parsed_6nm3 1
95 1 1 . . . . . . . . . 6 . HE1 parsed_6nm3 1
95 1 2 . . . . . . . . . 6 . HA parsed_6nm3 1
96 1 1 . . . . . . . . . 6 . HE1 parsed_6nm3 1
96 1 2 . . . . . . . . . 6 . HB1 parsed_6nm3 1
97 1 1 . . . . . . . . . 6 . HE1 parsed_6nm3 1
97 1 2 . . . . . . . . . 7 . HD1 parsed_6nm3 1
98 1 1 . . . . . . . . . 6 . HB2 parsed_6nm3 1
98 1 2 . . . . . . . . . 7 . HN parsed_6nm3 1
99 1 1 . . . . . . . . . 6 . HA parsed_6nm3 1
99 1 2 . . . . . . . . . 7 . HN parsed_6nm3 1
100 1 1 . . . . . . . . . 6 . HE3 parsed_6nm3 1
100 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
101 1 1 . . . . . . . . . 7 . HB2 parsed_6nm3 1
101 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
102 1 1 . . . . . . . . . 7 . HB1 parsed_6nm3 1
102 1 2 . . . . . . . . . 7 . HE1 parsed_6nm3 1
103 1 1 . . . . . . . . . 7 . HN parsed_6nm3 1
103 1 2 . . . . . . . . . 7 . HB2 parsed_6nm3 1
104 1 1 . . . . . . . . . 7 . HN parsed_6nm3 1
104 1 2 . . . . . . . . . 7 . HB1 parsed_6nm3 1
105 1 1 . . . . . . . . . 7 . HA parsed_6nm3 1
105 1 2 . . . . . . . . . 7 . HD1 parsed_6nm3 1
106 1 1 . . . . . . . . . 7 . HE3 parsed_6nm3 1
106 1 2 . . . . . . . . . 7 . HB2 parsed_6nm3 1
107 1 1 . . . . . . . . . 7 . HE3 parsed_6nm3 1
107 1 2 . . . . . . . . . 7 . HA parsed_6nm3 1
108 1 1 . . . . . . . . . 7 . HB1 parsed_6nm3 1
108 1 2 . . . . . . . . . 7 . HD1 parsed_6nm3 1
109 1 1 . . . . . . . . . 7 . HE parsed_6nm3 1
109 1 2 . . . . . . . . . 7 . HB1 parsed_6nm3 1
110 1 1 . . . . . . . . . 7 . HB2 parsed_6nm3 1
110 1 2 . . . . . . . . . 7 . HD1 parsed_6nm3 1
111 1 1 . . . . . . . . . 7 . HA parsed_6nm3 1
111 1 2 . . . . . . . . . 8 . H2 parsed_6nm3 1
112 1 1 . . . . . . . . . 7 . HD1 parsed_6nm3 1
112 1 2 . . . . . . . . . 8 . HG parsed_6nm3 1
113 1 1 . . . . . . . . . 7 . HE3 parsed_6nm3 1
113 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
114 1 1 . . . . . . . . . 7 . HE3 parsed_6nm3 1
114 1 2 . . . . . . . . . 8 . HG parsed_6nm3 1
115 1 1 . . . . . . . . . 7 . HE1 parsed_6nm3 1
115 1 2 . . . . . . . . . 8 . HG parsed_6nm3 1
116 1 1 . . . . . . . . . 7 . HE3 parsed_6nm3 1
116 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
117 1 1 . . . . . . . . . 7 . HE1 parsed_6nm3 1
117 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
118 1 1 . . . . . . . . . 7 . HH2 parsed_6nm3 1
118 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
119 1 1 . . . . . . . . . 7 . HD1 parsed_6nm3 1
119 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
120 1 1 . . . . . . . . . 7 . HZ3 parsed_6nm3 1
120 1 2 . . . . . . . . . 8 . HD2# parsed_6nm3 1
121 1 1 . . . . . . . . . 7 . HH2 parsed_6nm3 1
121 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
122 1 1 . . . . . . . . . 7 . HA parsed_6nm3 1
122 1 2 . . . . . . . . . 8 . HN parsed_6nm3 1
123 1 1 . . . . . . . . . 8 . HD2# parsed_6nm3 1
123 1 2 . . . . . . . . . 8 . H2 parsed_6nm3 1
124 1 1 . . . . . . . . . 8 . H1 parsed_6nm3 1
124 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
125 1 1 . . . . . . . . . 8 . H1 parsed_6nm3 1
125 1 2 . . . . . . . . . 8 . HB2 parsed_6nm3 1
126 1 1 . . . . . . . . . 8 . H1 parsed_6nm3 1
126 1 2 . . . . . . . . . 8 . HB1 parsed_6nm3 1
127 1 1 . . . . . . . . . 8 . H2 parsed_6nm3 1
127 1 2 . . . . . . . . . 8 . HB2 parsed_6nm3 1
128 1 1 . . . . . . . . . 8 . H2 parsed_6nm3 1
128 1 2 . . . . . . . . . 8 . HB1 parsed_6nm3 1
129 1 1 . . . . . . . . . 8 . HG parsed_6nm3 1
129 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
130 1 1 . . . . . . . . . 8 . H2 parsed_6nm3 1
130 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
131 1 1 . . . . . . . . . 8 . H2 parsed_6nm3 1
131 1 2 . . . . . . . . . 8 . HN parsed_6nm3 1
132 1 1 . . . . . . . . . 8 . HD1# parsed_6nm3 1
132 1 2 . . . . . . . . . 8 . HN parsed_6nm3 1
133 1 1 . . . . . . . . . 8 . HD2# parsed_6nm3 1
133 1 2 . . . . . . . . . 8 . HA parsed_6nm3 1
134 1 1 . . . . . . . . . 8 . HN parsed_6nm3 1
134 1 2 . . . . . . . . . 8 . HG parsed_6nm3 1
135 1 1 . . . . . . . . . 8 . HN parsed_6nm3 1
135 1 2 . . . . . . . . . 8 . HB# parsed_6nm3 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 . . . . . 3.0 1.8 4.3 parsed_6nm3 1
2 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
3 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
4 1 . . . . . 4.0 1.8 7.5 parsed_6nm3 1
5 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
6 1 . . . . . 3.0 1.8 4.8 parsed_6nm3 1
7 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
8 1 . . . . . 3.0 2.0 3.8 parsed_6nm3 1
9 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
10 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
11 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
12 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
13 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
14 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
15 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
16 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
17 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
18 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
19 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
20 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
21 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
22 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
23 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
24 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
25 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
26 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
27 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
28 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
29 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
30 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
31 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
32 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
33 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
34 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
35 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
36 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
37 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
38 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
39 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
40 1 . . . . . 4.0 1.8 8.0 parsed_6nm3 1
41 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
42 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
43 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
44 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
45 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
46 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
47 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
48 1 . . . . . 4.0 1.8 7.5 parsed_6nm3 1
49 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
50 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
51 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
52 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
53 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
54 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
55 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
56 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
57 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
58 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
59 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
60 1 . . . . . 2.5 1.8 2.8 parsed_6nm3 1
61 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
62 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
63 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
64 1 . . . . . 3.0 1.8 4.3 parsed_6nm3 1
65 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
66 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
67 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
68 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
69 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
70 1 . . . . . 4.0 1.8 7.5 parsed_6nm3 1
71 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
72 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
73 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
74 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
75 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
76 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
77 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
78 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
79 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
80 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
81 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
82 1 . . . . . 3.0 1.8 3.5 parsed_6nm3 1
83 1 . . . . . 3.0 1.8 3.5 parsed_6nm3 1
84 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
85 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
86 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
87 1 . . . . . 4.0 1.8 7.5 parsed_6nm3 1
88 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
89 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
90 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
91 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
92 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
93 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
94 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
95 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
96 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
97 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
98 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
99 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
100 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
101 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
102 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
103 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
104 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
105 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
106 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
107 1 . . . . . 4.0 1.8 7.0 parsed_6nm3 1
108 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
109 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
110 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
111 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
112 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
113 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
114 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
115 1 . . . . . 4.0 1.8 6.0 parsed_6nm3 1
116 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
117 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
118 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
119 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
120 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
121 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
122 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
123 1 . . . . . 4.0 1.8 6.5 parsed_6nm3 1
124 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
125 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
126 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
127 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
128 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
129 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
130 1 . . . . . 4.0 1.8 5.0 parsed_6nm3 1
131 1 . . . . . 3.0 1.8 3.8 parsed_6nm3 1
132 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
133 1 . . . . . 4.0 1.8 5.5 parsed_6nm3 1
134 1 . . . . . 3.0 1.8 3.5 parsed_6nm3 1
135 1 . . . . . 3.0 1.8 4.8 parsed_6nm3 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1
;
pck2xplr.nawk Table; Input File: noe_f_11102017.sort
Date: Fri Nov 10 16:59:12 EST 2017
Path: /hbar1/gswang/D295/D295_noeZ
@ BEGIN_XPLR_PCK_SUM
LBL File-Name All Intra Seq. Short Long
A noe_f_11102017.sort 133 58 37 36 2
Total 133 58 37 36 2
@ END_XPLR_PCK_SUM
@ BEGIN_XPLR_NOE_FILE
1
;
2 1 14 4 parsed_6nm3 1
2 "A.278 at 2.66e+07" 15 77 15 97 parsed_6nm3 1
3 "A.34 at 3.26e+06" 16 77 16 97 parsed_6nm3 1
4 "A.44 at 2.43e+06" 17 77 17 97 parsed_6nm3 1
5
;
A.45 at 2.13e+06
2
;
18 77 20 4 parsed_6nm3 1
6 "A.274 at 7.25e+06" 21 77 21 97 parsed_6nm3 1
7 "A.269 at 3.38e+07" 22 77 22 97 parsed_6nm3 1
8 "A.277 at 2.44e+06" 23 77 23 97 parsed_6nm3 1
9 "A.69 at 7.11e+07" 24 77 24 97 parsed_6nm3 1
10 "A.24 at 2.30e+06" 25 77 25 97 parsed_6nm3 1
11 "A.337 at 2.95e+06" 26 77 26 97 parsed_6nm3 1
12 "A.336 at 5.87e+06" 27 77 27 97 parsed_6nm3 1
13 "A.318 at 6.05e+06" 28 77 28 97 parsed_6nm3 1
14 "A.314 at 1.00e+07" 29 77 29 97 parsed_6nm3 1
15 "A.319 at 5.07e+06" 30 77 30 97 parsed_6nm3 1
16 "A.315 at 6.74e+06" 31 77 31 97 parsed_6nm3 1
17 "A.228 at 7.57e+06" 32 77 32 97 parsed_6nm3 1
18 "A.320 at 3.84e+06" 33 77 33 97 parsed_6nm3 1
19 "A.317 at 4.52e+06" 34 77 34 97 parsed_6nm3 1
20
;
A.316 at 4.62e+06
3
;
35 77 37 4 parsed_6nm3 1
21 "A.144 at 4.96e+06" 38 77 38 97 parsed_6nm3 1
22 "A.272 at 5.18e+06" 39 77 39 97 parsed_6nm3 1
23 "A.271 at 6.33e+06" 40 77 40 97 parsed_6nm3 1
24 "A.142 at 1.45e+07" 41 77 41 97 parsed_6nm3 1
25 "A.141 at 1.70e+07" 42 77 42 97 parsed_6nm3 1
26 "A.145 at 1.70e+07" 43 77 43 97 parsed_6nm3 1
27 "A.140 at 3.66e+07" 44 77 44 97 parsed_6nm3 1
28 "A.332 at 2.08e+06" 45 77 45 97 parsed_6nm3 1
29 "A.38 at 3.25e+06" 46 77 46 97 parsed_6nm3 1
30 "A.331 at 3.30e+06" 47 77 47 97 parsed_6nm3 1
31 "A.308 at 5.04e+06" 48 77 48 97 parsed_6nm3 1
32 "A.146 at 7.07e+06" 49 77 49 97 parsed_6nm3 1
33 "A.50 at 7.34e+06" 50 77 50 97 parsed_6nm3 1
34 "A.156 at 1.01e+07" 51 78 51 98 parsed_6nm3 1
35 "A.199 at 1.03e+07" 52 77 52 97 parsed_6nm3 1
36 "A.149 at 1.05e+07" 53 77 53 97 parsed_6nm3 1
37 "2.5 0.7 0.4 ! A.72 at 4.14e+07" 54 77 54 112 parsed_6nm3 1
38 "A.232 at 2.29e+06" 55 78 55 98 parsed_6nm3 1
39 "A.175 at 2.82e+06" 56 78 56 98 parsed_6nm3 1
40 "A.46 at 3.57e+06" 57 77 57 97 parsed_6nm3 1
41 "A.160 at 5.78e+06" 58 77 58 97 parsed_6nm3 1
42 "A.215 at 7.81e+06" 59 77 59 97 parsed_6nm3 1
43 "A.161 at 9.01e+06" 60 77 60 97 parsed_6nm3 1
44 "A.242 at 1.03e+07" 61 77 61 97 parsed_6nm3 1
45 "A.306 at 1.23e+07" 62 77 62 97 parsed_6nm3 1
46 "A.47 at 2.72e+06" 63 77 63 97 parsed_6nm3 1
47 "A.344 at 3.49e+06" 64 77 64 97 parsed_6nm3 1
48 "A.307 at 4.48e+06" 65 77 65 97 parsed_6nm3 1
49 "A.214 at 4.94e+06" 66 77 66 97 parsed_6nm3 1
50 "A.322 at 5.70e+06" 67 78 67 98 parsed_6nm3 1
51 "A.48 at 2.67e+06" 68 77 68 97 parsed_6nm3 1
52
;
A.309 at 4.00e+06
4
;
69 77 71 4 parsed_6nm3 1
53 "A.22 at 2.61e+06" 72 77 72 97 parsed_6nm3 1
54 "A.301 at 4.44e+06" 73 78 73 98 parsed_6nm3 1
55 "A.23 at 4.91e+06" 74 77 74 97 parsed_6nm3 1
56 "A.94 at 1.32e+07" 75 77 75 97 parsed_6nm3 1
57 "A.95 at 1.43e+07" 76 77 76 97 parsed_6nm3 1
58 "A.81 at 2.06e+07" 77 78 77 98 parsed_6nm3 1
59 "A.117 at 2.49e+07" 78 77 78 97 parsed_6nm3 1
60 "A.96 at 2.84e+07" 79 78 79 98 parsed_6nm3 1
61 "A.118 at 3.82e+07" 80 77 80 97 parsed_6nm3 1
62 "A.338 at 3.74e+06" 81 77 81 97 parsed_6nm3 1
63 "A.184 at 5.79e+06" 82 78 82 98 parsed_6nm3 1
64 "A.125 at 6.77e+06" 83 77 83 97 parsed_6nm3 1
65 "A.57 at 9.93e+06" 84 77 84 97 parsed_6nm3 1
66 "A.127 at 1.56e+07" 85 77 85 97 parsed_6nm3 1
67 "A.87 at 1.93e+07" 86 77 86 97 parsed_6nm3 1
68 "A.19 at 2.52e+06" 87 77 87 97 parsed_6nm3 1
69 "A.169 at 4.38e+06" 88 78 88 98 parsed_6nm3 1
70 "A.327 at 6.98e+06" 89 78 89 98 parsed_6nm3 1
71 ADD 90 78 90 83 parsed_6nm3 1
72
;
A.54 at 1.03e+07
5
;
91 78 93 4 parsed_6nm3 1
73 "A.27 at 3.30e+06" 94 77 94 97 parsed_6nm3 1
74 "A.26 at 3.82e+06" 95 77 95 97 parsed_6nm3 1
75 "A.91 at 1.59e+07" 96 77 96 97 parsed_6nm3 1
76 "A.128 at 1.59e+07" 97 77 97 97 parsed_6nm3 1
77 "A.134 at 2.21e+07" 98 77 98 97 parsed_6nm3 1
78 "A.115 at 2.27e+07" 99 77 99 97 parsed_6nm3 1
79 "A.133 at 2.28e+07" 100 77 100 97 parsed_6nm3 1
80 "A.80 at 2.54e+07" 101 78 101 98 parsed_6nm3 1
81 "A.25 at 3.57e+06" 102 77 102 97 parsed_6nm3 1
82 "A.99 at 5.04e+06" 103 77 103 97 parsed_6nm3 1
83 "A.98 at 2.47e+07" 104 77 104 97 parsed_6nm3 1
84 "A.75 at 3.07e+07" 105 77 105 97 parsed_6nm3 1
85 "A.304 at 2.06e+06" 106 77 106 97 parsed_6nm3 1
86 "A.21 at 6.44e+06" 107 77 107 97 parsed_6nm3 1
87 "A.342 at 4.84e+06" 108 77 108 97 parsed_6nm3 1
88
;
A.187 at 1.16e+07
6
;
109 78 111 4 parsed_6nm3 1
89 "A.340 at 2.19e+06" 112 77 112 97 parsed_6nm3 1
90 "A.29 at 3.49e+06" 113 77 113 97 parsed_6nm3 1
91 "A.28 at 5.65e+06" 114 77 114 97 parsed_6nm3 1
92 "A.89 at 2.04e+07" 115 77 115 97 parsed_6nm3 1
93 "A.131 at 2.14e+07" 116 77 116 97 parsed_6nm3 1
94 "A.109 at 2.39e+07" 117 78 117 98 parsed_6nm3 1
95 "A.130 at 2.53e+07" 118 77 118 97 parsed_6nm3 1
96 "A.78 at 3.05e+07" 119 78 119 98 parsed_6nm3 1
97 "A.108 at 3.33e+07" 120 78 120 98 parsed_6nm3 1
98 "A.339 at 2.68e+06" 121 77 121 97 parsed_6nm3 1
99 "A.121 at 5.77e+06" 122 77 122 97 parsed_6nm3 1
100 "A.103 at 1.76e+07" 123 77 123 97 parsed_6nm3 1
101
;
A.324 at 5.00e+06
7
;
124 78 126 4 parsed_6nm3 1
102 "A.303 at 3.16e+06" 127 77 127 97 parsed_6nm3 1
103 "A.31 at 4.27e+06" 128 77 128 97 parsed_6nm3 1
104 "A.123 at 1.17e+07" 129 77 129 97 parsed_6nm3 1
105 "A.122 at 1.86e+07" 130 77 130 97 parsed_6nm3 1
106 "A.93 at 2.06e+07" 131 77 131 97 parsed_6nm3 1
107 "A.114 at 2.09e+07" 132 77 132 97 parsed_6nm3 1
108 "A.77 at 2.21e+07" 133 78 133 98 parsed_6nm3 1
109 "A.135 at 2.69e+07" 134 77 134 97 parsed_6nm3 1
110 "A.113 at 2.75e+07" 135 77 135 97 parsed_6nm3 1
111 "A.136 at 2.75e+07" 136 77 136 97 parsed_6nm3 1
112 "A.104 at 2.76e+06" 137 77 137 97 parsed_6nm3 1
113 "A.234 at 3.58e+06" 138 77 138 97 parsed_6nm3 1
114 "A.79 at 3.84e+06" 139 78 139 98 parsed_6nm3 1
115 "A.166 at 4.10e+06" 140 78 140 98 parsed_6nm3 1
116 "A.321 at 5.05e+06" 141 77 141 97 parsed_6nm3 1
117 "A.167 at 8.80e+06" 142 77 142 97 parsed_6nm3 1
118 "A.311 at 9.16e+06" 143 77 143 97 parsed_6nm3 1
119 "A.326 at 1.05e+07" 144 77 144 97 parsed_6nm3 1
120 "A.230 at 1.10e+07" 145 77 145 97 parsed_6nm3 1
121 "A.325 at 1.17e+07" 146 78 146 98 parsed_6nm3 1
122 "A.84 at 1.74e+07" 147 77 147 97 parsed_6nm3 1
123
;
A.106 at 2.13e+07
8
;
148 77 150 4 parsed_6nm3 1
124 "A.343 at 3.54e+06" 151 77 151 97 parsed_6nm3 1
125 "A.100 at 3.83e+06" 152 77 152 97 parsed_6nm3 1
126 "A.237 at 4.70e+06" 153 77 153 97 parsed_6nm3 1
127 "A.240 at 4.70e+06" 154 77 154 97 parsed_6nm3 1
128 "A.221 at 7.31e+06" 155 77 155 97 parsed_6nm3 1
129 "A.227 at 7.31e+06" 156 77 156 97 parsed_6nm3 1
130 "A.270 at 8.35e+06" 157 77 157 97 parsed_6nm3 1
131 "A.90 at 1.15e+07" 158 77 158 97 parsed_6nm3 1
132 ADD 159 76 159 80 parsed_6nm3 1
133 "A.330 at 1.29e+07" 160 77 160 97 parsed_6nm3 1
134 "A.273 at 1.38e+07" 161 77 161 97 parsed_6nm3 1
135 "A.186 at 2.47e+07" 162 77 162 97 parsed_6nm3 1
136
;
A.193 at 3.05e+07
@ END_XPLR_NOE_FILE
;
163 77 165 21 parsed_6nm3 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 1: ww295_restraints_12202018comb.tbl" 1 1 1 54 parsed_6nm3 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6nm3
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.00 -19.00 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_6nm3 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.00 20.00 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_6nm3 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.00 -39.00 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_6nm3 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.00 28.00 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_6nm3 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.00 -58.00 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_6nm3 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.00 21.00 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_6nm3 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.00 -30.00 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_6nm3 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.00 13.00 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_6nm3 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.00 -37.00 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_6nm3 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.00 7.00 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_6nm3 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 phi angles for d219 March 23 2018
! 3
;
1 1 3 5 parsed_6nm3 1
2 "! 4" 7 72 9 5 parsed_6nm3 1
3 "! 5" 13 72 15 5 parsed_6nm3 1
4 "! 6" 19 72 21 11 parsed_6nm3 1
5 "! 7" 25 72 27 5 parsed_6nm3 1
6 END 31 72 33 5 parsed_6nm3 1
stop_
save_