NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
606780 |
2ndm   |
26065 | cing | 2-parsed | STAR | entry | full | 116 |
data_2ndm_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ndm
_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_2ndm 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ndm
_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 2ndm "Master copy" parsed_2ndm
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ndm
_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 2ndm.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ndm 1
1 2ndm.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 23 parsed_2ndm 1
1 2ndm.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 2 parsed_2ndm 1
1 2ndm.mr . . DYANA/DIANA 4 distance NOE simple 91 parsed_2ndm 1
1 2ndm.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ndm 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_2ndm
_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 PLANT PROTEIN 17-JUL-16 2NDM
*TITLE NMR SOLUTION STRUCTURE OF PAWS DERIVED PEPTIDE 21 (PDP-21)
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: PAWS DERIVED PEPTIDE 21;
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: ZINNIA HAAGEANA;
*SOURCE 4 ORGANISM_TAXID: 1525732;
*SOURCE 5 OTHER_DETAILS: ASSEMBLED BY FMOC SOLID PHASE PEPTIDE SYNTHESIS AND
*SOURCE 6 CYCLISED BY NATIVE CHEMICAL LIGATION.
*KEYWDS PDP, PLANT PEPTIDE, CYCLIC PEPTIDE, PLANT PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR B.FRANKE, A.S.JAYASENA, M.F.FISHER, J.E.SWEDBERG, N.L.TAYLOR,
*AUTHOR 2 J.S.MYLNE, K.ROSENGREN
*REVDAT 1 24-AUG-16 2NDM 0
;
save_
save_DYANA/DIANA_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ndm
_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 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.8 -50.8 . . 2 ARG . . . . . . . . . . . . . parsed_2ndm 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.3 158.8 . . 2 ARG . . . . . . . . . . . . . parsed_2ndm 1
3 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.2 163.2 . . 3 PRO . . . . . . . . . . . . . parsed_2ndm 1
4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.6 -57.5 . . 4 CYSS . . . . . . . . . . . . . parsed_2ndm 1
5 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 94.3 162.8 . . 4 CYSS . . . . . . . . . . . . . parsed_2ndm 1
6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.8 -38.1 . . 5 TYR . . . . . . . . . . . . . parsed_2ndm 1
7 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.7 176.0 . . 5 TYR . . . . . . . . . . . . . parsed_2ndm 1
8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -176.3 -42.9 . . 6 THR . . . . . . . . . . . . . parsed_2ndm 1
9 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.5 196.6 . . 6 THR . . . . . . . . . . . . . parsed_2ndm 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.8 -44.8 . . 7 LEU . . . . . . . . . . . . . parsed_2ndm 1
11 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.2 -2.2 . . 7 LEU . . . . . . . . . . . . . parsed_2ndm 1
12 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.5 -68.5 . . 8 GLN . . . . . . . . . . . . . parsed_2ndm 1
13 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -23.8 16.2 . . 8 GLN . . . . . . . . . . . . . parsed_2ndm 1
14 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.9 -61.3 . . 10 CYSS . . . . . . . . . . . . . parsed_2ndm 1
15 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.8 151.8 . . 10 CYSS . . . . . . . . . . . . . parsed_2ndm 1
16 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.8 -51.8 . . 11 PHE . . . . . . . . . . . . . parsed_2ndm 1
17 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.5 154.5 . . 11 PHE . . . . . . . . . . . . . parsed_2ndm 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.6 165.7 . . 12 PRO . . . . . . . . . . . . . parsed_2ndm 1
19 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 2 ARG . . . . . . . . . . . . . parsed_2ndm 1
20 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 5 TYR . . . . . . . . . . . . . parsed_2ndm 1
21 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 6 THR . . . . . . . . . . . . . parsed_2ndm 1
22 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 8 GLN . . . . . . . . . . . . . parsed_2ndm 1
23 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 11 PHE . . . . . . . . . . . . . parsed_2ndm 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 "2 R -70.801 138.034 5.849 10.372 0.447 0.606 25 12 Strong" 1 1 1 72 parsed_2ndm 1
2 "3 P -63.977 143.217 5.858 6.581 0.404 0.702 25 13 Strong" 5 1 5 72 parsed_2ndm 1
3 "3 PRO PHI -84.0 -44.0" 6 4 6 34 parsed_2ndm 1
4 "4 c -88.523 128.580 15.514 17.133 0.359 0.796 25 13 Strong" 9 1 9 72 parsed_2ndm 1
5 "5 Y -78.938 141.845 13.626 11.370 0.398 0.725 10 15 Generous" 13 1 13 74 parsed_2ndm 1
6 "6 T -109.621 167.550 33.361 14.522 0.370 0.684 25 15 Strong" 17 1 17 72 parsed_2ndm 1
7 "7 L -64.774 -22.168 6.760 6.086 0.336 0.632 25 15 Strong" 21 1 21 72 parsed_2ndm 1
8 "8 Q -88.454 -3.815 8.011 6.886 0.337 0.676 25 15 Strong" 25 1 25 72 parsed_2ndm 1
9 "10 c -86.593 121.780 12.654 15.004 0.446 0.799 25 15 Strong" 29 1 29 72 parsed_2ndm 1
10 "11 F -71.755 134.461 9.963 8.715 0.649 0.791 25 13 Strong" 33 1 33 72 parsed_2ndm 1
11 "12 P -65.137 144.626 7.455 10.516 0.817 0.759 25 13 Strong" 37 1 37 72 parsed_2ndm 1
12 "12 PRO PHI -85.1 -45.1" 38 3 38 34 parsed_2ndm 1
13 "CHI1 From Talos in agreement with original structure" 41 1 41 53 parsed_2ndm 1
stop_
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1 "ARG H 13 ASP O 2.3" 46 37 46 59 parsed_2ndm 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2ndm
_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_2ndm 1
2 1 . . . parsed_2ndm 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 . . . . . . . . . 2 ARG N parsed_2ndm 1
1 1 2 . . . . . . . . . 13 ASP O parsed_2ndm 1
2 1 1 . . . . . . . . . 13 ASP H parsed_2ndm 1
2 1 2 . . . . . . . . . 2 ARG O parsed_2ndm 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 . . . . . . . 3.3 parsed_2ndm 1
2 1 . . . . . . . 2.3 parsed_2ndm 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 "13 ASP N 2 ARG O 3.3 2 ARG H 2 ARG QB 3.26 #peak 8 #SUP 0.98 #QF 0.98" 3 1 3 100 parsed_2ndm 1
stop_
save_
save_DYANA/DIANA_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2ndm
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_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_2ndm 2
2 1 . . . parsed_2ndm 2
3 1 . . . parsed_2ndm 2
4 1 . . . parsed_2ndm 2
5 1 . . . parsed_2ndm 2
6 1 . . . parsed_2ndm 2
7 1 . . . parsed_2ndm 2
8 1 . . . parsed_2ndm 2
9 1 . . . parsed_2ndm 2
10 1 . . . parsed_2ndm 2
11 1 . . . parsed_2ndm 2
12 1 . . . parsed_2ndm 2
13 1 . . . parsed_2ndm 2
14 1 . . . parsed_2ndm 2
15 1 . . . parsed_2ndm 2
16 1 . . . parsed_2ndm 2
17 1 . . . parsed_2ndm 2
18 1 . . . parsed_2ndm 2
19 1 . . . parsed_2ndm 2
20 1 . . . parsed_2ndm 2
21 1 . . . parsed_2ndm 2
22 1 . . . parsed_2ndm 2
23 1 . . . parsed_2ndm 2
24 1 . . . parsed_2ndm 2
25 1 . . . parsed_2ndm 2
26 1 . . . parsed_2ndm 2
27 1 . . . parsed_2ndm 2
28 1 . . . parsed_2ndm 2
29 1 . . . parsed_2ndm 2
30 1 . . . parsed_2ndm 2
31 1 . . . parsed_2ndm 2
32 1 . . . parsed_2ndm 2
33 1 . . . parsed_2ndm 2
34 1 . . . parsed_2ndm 2
35 1 . . . parsed_2ndm 2
36 1 . . . parsed_2ndm 2
37 1 . . . parsed_2ndm 2
38 1 . . . parsed_2ndm 2
39 1 . . . parsed_2ndm 2
40 1 . . . parsed_2ndm 2
41 1 . . . parsed_2ndm 2
42 1 . . . parsed_2ndm 2
43 1 . . . parsed_2ndm 2
44 1 . . . parsed_2ndm 2
45 1 . . . parsed_2ndm 2
46 1 . . . parsed_2ndm 2
47 1 . . . parsed_2ndm 2
48 1 . . . parsed_2ndm 2
49 1 . . . parsed_2ndm 2
50 1 . . . parsed_2ndm 2
51 1 . . . parsed_2ndm 2
52 1 . . . parsed_2ndm 2
53 1 . . . parsed_2ndm 2
54 1 . . . parsed_2ndm 2
55 1 . . . parsed_2ndm 2
56 1 . . . parsed_2ndm 2
57 1 . . . parsed_2ndm 2
58 1 . . . parsed_2ndm 2
59 1 . . . parsed_2ndm 2
60 1 . . . parsed_2ndm 2
61 1 . . . parsed_2ndm 2
62 1 . . . parsed_2ndm 2
63 1 . . . parsed_2ndm 2
64 1 . . . parsed_2ndm 2
65 1 . . . parsed_2ndm 2
66 1 . . . parsed_2ndm 2
67 1 . . . parsed_2ndm 2
68 1 . . . parsed_2ndm 2
69 1 . . . parsed_2ndm 2
70 1 . . . parsed_2ndm 2
71 1 . . . parsed_2ndm 2
72 1 . . . parsed_2ndm 2
73 1 . . . parsed_2ndm 2
74 1 . . . parsed_2ndm 2
75 1 . . . parsed_2ndm 2
76 1 . . . parsed_2ndm 2
77 1 . . . parsed_2ndm 2
78 1 . . . parsed_2ndm 2
79 1 . . . parsed_2ndm 2
80 1 . . . parsed_2ndm 2
81 1 . . . parsed_2ndm 2
82 1 . . . parsed_2ndm 2
83 1 . . . parsed_2ndm 2
84 1 . . . parsed_2ndm 2
85 1 . . . parsed_2ndm 2
86 1 . . . parsed_2ndm 2
87 1 . . . parsed_2ndm 2
88 1 . . . parsed_2ndm 2
89 1 . . . parsed_2ndm 2
90 1 . . . parsed_2ndm 2
91 1 . . . parsed_2ndm 2
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 . . . . . . . . . 2 ARG H parsed_2ndm 2
1 1 2 . . . . . . . . . 2 ARG HG3 parsed_2ndm 2
2 1 1 . . . . . . . . . 2 ARG H parsed_2ndm 2
2 1 2 . . . . . . . . . 2 ARG HG2 parsed_2ndm 2
3 1 1 . . . . . . . . . 3 PRO HA parsed_2ndm 2
3 1 2 . . . . . . . . . 4 CYSS H parsed_2ndm 2
4 1 1 . . . . . . . . . 4 CYSS H parsed_2ndm 2
4 1 2 . . . . . . . . . 4 CYSS HB3 parsed_2ndm 2
5 1 1 . . . . . . . . . 4 CYSS H parsed_2ndm 2
5 1 2 . . . . . . . . . 4 CYSS HB2 parsed_2ndm 2
6 1 1 . . . . . . . . . 4 CYSS HA parsed_2ndm 2
6 1 2 . . . . . . . . . 5 TYR H parsed_2ndm 2
7 1 1 . . . . . . . . . 4 CYSS HB2 parsed_2ndm 2
7 1 2 . . . . . . . . . 5 TYR H parsed_2ndm 2
8 1 1 . . . . . . . . . 4 CYSS HB3 parsed_2ndm 2
8 1 2 . . . . . . . . . 5 TYR H parsed_2ndm 2
9 1 1 . . . . . . . . . 5 TYR HA parsed_2ndm 2
9 1 2 . . . . . . . . . 5 TYR QD parsed_2ndm 2
10 1 1 . . . . . . . . . 6 THR H parsed_2ndm 2
10 1 2 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
11 1 1 . . . . . . . . . 6 THR HA parsed_2ndm 2
11 1 2 . . . . . . . . . 7 LEU H parsed_2ndm 2
12 1 1 . . . . . . . . . 6 THR HB parsed_2ndm 2
12 1 2 . . . . . . . . . 7 LEU H parsed_2ndm 2
13 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
13 1 2 . . . . . . . . . 7 LEU HB3 parsed_2ndm 2
14 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
14 1 2 . . . . . . . . . 7 LEU HB2 parsed_2ndm 2
15 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
15 1 2 . . . . . . . . . 7 LEU QD2 parsed_2ndm 2
16 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
16 1 2 . . . . . . . . . 7 LEU QD1 parsed_2ndm 2
17 1 1 . . . . . . . . . 8 GLN H parsed_2ndm 2
17 1 2 . . . . . . . . . 8 GLN QG parsed_2ndm 2
18 1 1 . . . . . . . . . 7 LEU HB3 parsed_2ndm 2
18 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
19 1 1 . . . . . . . . . 7 LEU HB2 parsed_2ndm 2
19 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
20 1 1 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
20 1 2 . . . . . . . . . 7 LEU H parsed_2ndm 2
21 1 1 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
21 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
22 1 1 . . . . . . . . . 9 SER H parsed_2ndm 2
22 1 2 . . . . . . . . . 9 SER QB parsed_2ndm 2
23 1 1 . . . . . . . . . 8 GLN QG parsed_2ndm 2
23 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
24 1 1 . . . . . . . . . 8 GLN HB3 parsed_2ndm 2
24 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
25 1 1 . . . . . . . . . 8 GLN HB2 parsed_2ndm 2
25 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
26 1 1 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
26 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
27 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
27 1 2 . . . . . . . . . 8 GLN QG parsed_2ndm 2
28 1 1 . . . . . . . . . 9 SER HA parsed_2ndm 2
28 1 2 . . . . . . . . . 10 CYSS H parsed_2ndm 2
29 1 1 . . . . . . . . . 10 CYSS H parsed_2ndm 2
29 1 2 . . . . . . . . . 10 CYSS HB2 parsed_2ndm 2
30 1 1 . . . . . . . . . 10 CYSS H parsed_2ndm 2
30 1 2 . . . . . . . . . 10 CYSS HB3 parsed_2ndm 2
31 1 1 . . . . . . . . . 9 SER QB parsed_2ndm 2
31 1 2 . . . . . . . . . 10 CYSS H parsed_2ndm 2
32 1 1 . . . . . . . . . 10 CYSS HA parsed_2ndm 2
32 1 2 . . . . . . . . . 11 PHE H parsed_2ndm 2
33 1 1 . . . . . . . . . 11 PHE H parsed_2ndm 2
33 1 2 . . . . . . . . . 11 PHE HB2 parsed_2ndm 2
34 1 1 . . . . . . . . . 11 PHE H parsed_2ndm 2
34 1 2 . . . . . . . . . 11 PHE HB3 parsed_2ndm 2
35 1 1 . . . . . . . . . 2 ARG HA parsed_2ndm 2
35 1 2 . . . . . . . . . 3 PRO HD2 parsed_2ndm 2
36 1 1 . . . . . . . . . 2 ARG HA parsed_2ndm 2
36 1 2 . . . . . . . . . 3 PRO HD3 parsed_2ndm 2
37 1 1 . . . . . . . . . 2 ARG QB parsed_2ndm 2
37 1 2 . . . . . . . . . 3 PRO HA parsed_2ndm 2
38 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
38 1 2 . . . . . . . . . 12 PRO HD2 parsed_2ndm 2
39 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
39 1 2 . . . . . . . . . 12 PRO HD3 parsed_2ndm 2
40 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
40 1 2 . . . . . . . . . 12 PRO HG3 parsed_2ndm 2
41 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
41 1 2 . . . . . . . . . 12 PRO HG2 parsed_2ndm 2
42 1 1 . . . . . . . . . 12 PRO HA parsed_2ndm 2
42 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
43 1 1 . . . . . . . . . 13 ASP H parsed_2ndm 2
43 1 2 . . . . . . . . . 13 ASP HB2 parsed_2ndm 2
44 1 1 . . . . . . . . . 13 ASP H parsed_2ndm 2
44 1 2 . . . . . . . . . 13 ASP HB3 parsed_2ndm 2
45 1 1 . . . . . . . . . 12 PRO HG2 parsed_2ndm 2
45 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
46 1 1 . . . . . . . . . 12 PRO HG3 parsed_2ndm 2
46 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
47 1 1 . . . . . . . . . 2 ARG H parsed_2ndm 2
47 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
48 1 1 . . . . . . . . . 5 TYR H parsed_2ndm 2
48 1 2 . . . . . . . . . 5 TYR QD parsed_2ndm 2
49 1 1 . . . . . . . . . 5 TYR H parsed_2ndm 2
49 1 2 . . . . . . . . . 5 TYR QE parsed_2ndm 2
50 1 1 . . . . . . . . . 5 TYR H parsed_2ndm 2
50 1 2 . . . . . . . . . 6 THR H parsed_2ndm 2
51 1 1 . . . . . . . . . 11 PHE H parsed_2ndm 2
51 1 2 . . . . . . . . . 11 PHE QD parsed_2ndm 2
52 1 1 . . . . . . . . . 10 CYSS H parsed_2ndm 2
52 1 2 . . . . . . . . . 11 PHE H parsed_2ndm 2
53 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
53 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
54 1 1 . . . . . . . . . 4 CYSS H parsed_2ndm 2
54 1 2 . . . . . . . . . 5 TYR H parsed_2ndm 2
55 1 1 . . . . . . . . . 9 SER H parsed_2ndm 2
55 1 2 . . . . . . . . . 10 CYSS H parsed_2ndm 2
56 1 1 . . . . . . . . . 6 THR H parsed_2ndm 2
56 1 2 . . . . . . . . . 7 LEU H parsed_2ndm 2
57 1 1 . . . . . . . . . 5 TYR H parsed_2ndm 2
57 1 2 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
58 1 1 . . . . . . . . . 6 THR HA parsed_2ndm 2
58 1 2 . . . . . . . . . 6 THR HB parsed_2ndm 2
59 1 1 . . . . . . . . . 5 TYR QD parsed_2ndm 2
59 1 2 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
60 1 1 . . . . . . . . . 6 THR HA parsed_2ndm 2
60 1 2 . . . . . . . . . 6 THR QG2 parsed_2ndm 2
61 1 1 . . . . . . . . . 8 GLN HA parsed_2ndm 2
61 1 2 . . . . . . . . . 8 GLN QG parsed_2ndm 2
62 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
62 1 2 . . . . . . . . . 11 PHE QD parsed_2ndm 2
63 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
63 1 2 . . . . . . . . . 11 PHE QE parsed_2ndm 2
64 1 1 . . . . . . . . . 1 GLY QA parsed_2ndm 2
64 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
65 1 1 . . . . . . . . . 2 ARG H parsed_2ndm 2
65 1 2 . . . . . . . . . 2 ARG QG parsed_2ndm 2
66 1 1 . . . . . . . . . 2 ARG H parsed_2ndm 2
66 1 2 . . . . . . . . . 2 ARG QD parsed_2ndm 2
67 1 1 . . . . . . . . . 2 ARG HA parsed_2ndm 2
67 1 2 . . . . . . . . . 2 ARG QD parsed_2ndm 2
68 1 1 . . . . . . . . . 2 ARG HA parsed_2ndm 2
68 1 2 . . . . . . . . . 3 PRO QD parsed_2ndm 2
69 1 1 . . . . . . . . . 2 ARG QB parsed_2ndm 2
69 1 2 . . . . . . . . . 2 ARG QD parsed_2ndm 2
70 1 1 . . . . . . . . . 2 ARG QB parsed_2ndm 2
70 1 2 . . . . . . . . . 3 PRO QD parsed_2ndm 2
71 1 1 . . . . . . . . . 3 PRO QB parsed_2ndm 2
71 1 2 . . . . . . . . . 5 TYR QD parsed_2ndm 2
72 1 1 . . . . . . . . . 3 PRO QG parsed_2ndm 2
72 1 2 . . . . . . . . . 4 CYSS H parsed_2ndm 2
73 1 1 . . . . . . . . . 3 PRO QG parsed_2ndm 2
73 1 2 . . . . . . . . . 5 TYR QD parsed_2ndm 2
74 1 1 . . . . . . . . . 4 CYSS QB parsed_2ndm 2
74 1 2 . . . . . . . . . 5 TYR H parsed_2ndm 2
75 1 1 . . . . . . . . . 5 TYR H parsed_2ndm 2
75 1 2 . . . . . . . . . 5 TYR QB parsed_2ndm 2
76 1 1 . . . . . . . . . 5 TYR QB parsed_2ndm 2
76 1 2 . . . . . . . . . 6 THR H parsed_2ndm 2
77 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
77 1 2 . . . . . . . . . 7 LEU QQD parsed_2ndm 2
78 1 1 . . . . . . . . . 7 LEU H parsed_2ndm 2
78 1 2 . . . . . . . . . 8 GLN QB parsed_2ndm 2
79 1 1 . . . . . . . . . 7 LEU HA parsed_2ndm 2
79 1 2 . . . . . . . . . 7 LEU QQD parsed_2ndm 2
80 1 1 . . . . . . . . . 7 LEU QB parsed_2ndm 2
80 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
81 1 1 . . . . . . . . . 7 LEU QB parsed_2ndm 2
81 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
82 1 1 . . . . . . . . . 7 LEU QQD parsed_2ndm 2
82 1 2 . . . . . . . . . 8 GLN H parsed_2ndm 2
83 1 1 . . . . . . . . . 8 GLN H parsed_2ndm 2
83 1 2 . . . . . . . . . 8 GLN QB parsed_2ndm 2
84 1 1 . . . . . . . . . 8 GLN QB parsed_2ndm 2
84 1 2 . . . . . . . . . 9 SER H parsed_2ndm 2
85 1 1 . . . . . . . . . 10 CYSS H parsed_2ndm 2
85 1 2 . . . . . . . . . 10 CYSS QB parsed_2ndm 2
86 1 1 . . . . . . . . . 10 CYSS QB parsed_2ndm 2
86 1 2 . . . . . . . . . 11 PHE H parsed_2ndm 2
87 1 1 . . . . . . . . . 11 PHE H parsed_2ndm 2
87 1 2 . . . . . . . . . 11 PHE QB parsed_2ndm 2
88 1 1 . . . . . . . . . 11 PHE H parsed_2ndm 2
88 1 2 . . . . . . . . . 12 PRO QD parsed_2ndm 2
89 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
89 1 2 . . . . . . . . . 12 PRO QG parsed_2ndm 2
90 1 1 . . . . . . . . . 11 PHE HA parsed_2ndm 2
90 1 2 . . . . . . . . . 12 PRO QD parsed_2ndm 2
91 1 1 . . . . . . . . . 12 PRO QG parsed_2ndm 2
91 1 2 . . . . . . . . . 13 ASP H parsed_2ndm 2
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 . . . . . . . 3.88 parsed_2ndm 2
2 1 . . . . . . . 3.88 parsed_2ndm 2
3 1 . . . . . . . 3.16 parsed_2ndm 2
4 1 . . . . . . . 4.05 parsed_2ndm 2
5 1 . . . . . . . 4.05 parsed_2ndm 2
6 1 . . . . . . . 3.15 parsed_2ndm 2
7 1 . . . . . . . 4.84 parsed_2ndm 2
8 1 . . . . . . . 4.84 parsed_2ndm 2
9 1 . . . . . . . 3.63 parsed_2ndm 2
10 1 . . . . . . . 4.16 parsed_2ndm 2
11 1 . . . . . . . 3.32 parsed_2ndm 2
12 1 . . . . . . . 3.82 parsed_2ndm 2
13 1 . . . . . . . 3.80 parsed_2ndm 2
14 1 . . . . . . . 3.80 parsed_2ndm 2
15 1 . . . . . . . 5.38 parsed_2ndm 2
16 1 . . . . . . . 5.38 parsed_2ndm 2
17 1 . . . . . . . 4.28 parsed_2ndm 2
18 1 . . . . . . . 4.70 parsed_2ndm 2
19 1 . . . . . . . 4.70 parsed_2ndm 2
20 1 . . . . . . . 4.80 parsed_2ndm 2
21 1 . . . . . . . 5.29 parsed_2ndm 2
22 1 . . . . . . . 3.77 parsed_2ndm 2
23 1 . . . . . . . 5.03 parsed_2ndm 2
24 1 . . . . . . . 4.44 parsed_2ndm 2
25 1 . . . . . . . 4.44 parsed_2ndm 2
26 1 . . . . . . . 5.50 parsed_2ndm 2
27 1 . . . . . . . 5.50 parsed_2ndm 2
28 1 . . . . . . . 3.46 parsed_2ndm 2
29 1 . . . . . . . 4.20 parsed_2ndm 2
30 1 . . . . . . . 4.20 parsed_2ndm 2
31 1 . . . . . . . 4.63 parsed_2ndm 2
32 1 . . . . . . . 3.03 parsed_2ndm 2
33 1 . . . . . . . 3.77 parsed_2ndm 2
34 1 . . . . . . . 3.77 parsed_2ndm 2
35 1 . . . . . . . 3.75 parsed_2ndm 2
36 1 . . . . . . . 3.75 parsed_2ndm 2
37 1 . . . . . . . 4.98 parsed_2ndm 2
38 1 . . . . . . . 3.50 parsed_2ndm 2
39 1 . . . . . . . 3.50 parsed_2ndm 2
40 1 . . . . . . . 5.20 parsed_2ndm 2
41 1 . . . . . . . 5.20 parsed_2ndm 2
42 1 . . . . . . . 3.46 parsed_2ndm 2
43 1 . . . . . . . 4.12 parsed_2ndm 2
44 1 . . . . . . . 4.12 parsed_2ndm 2
45 1 . . . . . . . 5.50 parsed_2ndm 2
46 1 . . . . . . . 5.50 parsed_2ndm 2
47 1 . . . . . . . 3.62 parsed_2ndm 2
48 1 . . . . . . . 4.41 parsed_2ndm 2
49 1 . . . . . . . 4.94 parsed_2ndm 2
50 1 . . . . . . . 5.23 parsed_2ndm 2
51 1 . . . . . . . 4.84 parsed_2ndm 2
52 1 . . . . . . . 5.39 parsed_2ndm 2
53 1 . . . . . . . 4.00 parsed_2ndm 2
54 1 . . . . . . . 4.95 parsed_2ndm 2
55 1 . . . . . . . 4.73 parsed_2ndm 2
56 1 . . . . . . . 4.75 parsed_2ndm 2
57 1 . . . . . . . 5.50 parsed_2ndm 2
58 1 . . . . . . . 2.82 parsed_2ndm 2
59 1 . . . . . . . 5.50 parsed_2ndm 2
60 1 . . . . . . . 3.64 parsed_2ndm 2
61 1 . . . . . . . 4.17 parsed_2ndm 2
62 1 . . . . . . . 3.92 parsed_2ndm 2
63 1 . . . . . . . 4.82 parsed_2ndm 2
64 1 . . . . . . . 4.66 parsed_2ndm 2
65 1 . . . . . . . 3.32 parsed_2ndm 2
66 1 . . . . . . . 4.91 parsed_2ndm 2
67 1 . . . . . . . 5.34 parsed_2ndm 2
68 1 . . . . . . . 3.10 parsed_2ndm 2
69 1 . . . . . . . 3.63 parsed_2ndm 2
70 1 . . . . . . . 3.93 parsed_2ndm 2
71 1 . . . . . . . 5.34 parsed_2ndm 2
72 1 . . . . . . . 4.70 parsed_2ndm 2
73 1 . . . . . . . 5.35 parsed_2ndm 2
74 1 . . . . . . . 4.21 parsed_2ndm 2
75 1 . . . . . . . 3.48 parsed_2ndm 2
76 1 . . . . . . . 4.31 parsed_2ndm 2
77 1 . . . . . . . 4.57 parsed_2ndm 2
78 1 . . . . . . . 5.34 parsed_2ndm 2
79 1 . . . . . . . 3.55 parsed_2ndm 2
80 1 . . . . . . . 4.11 parsed_2ndm 2
81 1 . . . . . . . 5.21 parsed_2ndm 2
82 1 . . . . . . . 5.44 parsed_2ndm 2
83 1 . . . . . . . 3.55 parsed_2ndm 2
84 1 . . . . . . . 3.85 parsed_2ndm 2
85 1 . . . . . . . 3.55 parsed_2ndm 2
86 1 . . . . . . . 3.40 parsed_2ndm 2
87 1 . . . . . . . 3.13 parsed_2ndm 2
88 1 . . . . . . . 5.35 parsed_2ndm 2
89 1 . . . . . . . 4.58 parsed_2ndm 2
90 1 . . . . . . . 3.06 parsed_2ndm 2
91 1 . . . . . . . 4.75 parsed_2ndm 2
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 "peak 9 #SUP 0.96 #QF 0.96" 1 49 1 74 parsed_2ndm 2
2 "peak 10 #SUP 0.99 #QF 0.99" 2 49 2 75 parsed_2ndm 2
3 "peak 11 #SUP 0.77 #QF 0.77" 3 49 3 75 parsed_2ndm 2
4 "peak 12 #SUP 0.97 #QF 0.97" 4 49 4 75 parsed_2ndm 2
5 "peak 13 #SUP 1.00" 5 49 5 66 parsed_2ndm 2
6 "peak 15 #SUP 0.70 #QF 0.70" 6 49 6 75 parsed_2ndm 2
7 "peak 17 #SUP 1.00" 7 49 7 66 parsed_2ndm 2
8 "peak 18 #SUP 1.00" 8 49 8 66 parsed_2ndm 2
9 "peak 25 #SUP 0.96 #QF 0.96" 9 49 9 75 parsed_2ndm 2
10 "peak 29 #SUP 1.00" 10 49 10 66 parsed_2ndm 2
11 "peak 30 #SUP 0.89 #QF 0.89" 11 49 11 75 parsed_2ndm 2
12 "peak 31 #SUP 0.90 #QF 0.90" 12 49 12 75 parsed_2ndm 2
13 "peak 33 #SUP 0.98 #QF 0.98" 13 49 13 75 parsed_2ndm 2
14 "peak 34 #SUP 0.99 #QF 0.99" 14 49 14 75 parsed_2ndm 2
15 "peak 35 #SUP 1.00" 15 49 15 66 parsed_2ndm 2
16 "peak 36 #SUP 1.00" 16 49 16 66 parsed_2ndm 2
17 "peak 39 #SUP 0.99 #QF 0.99" 17 49 17 75 parsed_2ndm 2
18 "peak 42 #SUP 1.00" 18 49 18 66 parsed_2ndm 2
19 "peak 43 #SUP 1.00" 19 49 19 66 parsed_2ndm 2
20 "peak 45 #SUP 1.00" 20 49 20 66 parsed_2ndm 2
21 "peak 46 #SUP 0.88 #QF 0.88" 21 49 21 75 parsed_2ndm 2
22 "peak 50 #SUP 1.00" 22 49 22 66 parsed_2ndm 2
23 "peak 51 #SUP 1.00" 23 49 23 66 parsed_2ndm 2
24 "peak 52 #SUP 0.95 #QF 0.95" 24 49 24 75 parsed_2ndm 2
25 "peak 53 #SUP 1.00" 25 49 25 66 parsed_2ndm 2
26 "peak 56 #SUP 0.63 #QF 0.63" 26 49 26 75 parsed_2ndm 2
27 "peak 59 #SUP 0.95 #QF 0.95" 27 49 27 75 parsed_2ndm 2
28 "peak 60 #SUP 0.91 #QF 0.91" 28 49 28 75 parsed_2ndm 2
29 "peak 62 #SUP 1.00" 29 49 29 66 parsed_2ndm 2
30 "peak 63 #SUP 0.95 #QF 0.95" 30 49 30 75 parsed_2ndm 2
31 "peak 64 #SUP 1.00" 31 49 31 66 parsed_2ndm 2
32 "peak 65 #SUP 0.84 #QF 0.84" 32 49 32 75 parsed_2ndm 2
33 "peak 66 #SUP 0.98 #QF 0.98" 33 49 33 75 parsed_2ndm 2
34 "peak 67 #SUP 0.84 #QF 0.84" 34 49 34 75 parsed_2ndm 2
35 "peak 70 #SUP 1.00" 35 49 35 66 parsed_2ndm 2
36 "peak 71 #SUP 0.99 #QF 0.99" 36 49 36 75 parsed_2ndm 2
37 "peak 74 #SUP 1.00 #QF 0.20" 37 49 37 75 parsed_2ndm 2
38 "peak 85 #SUP 0.78 #QF 0.78" 38 49 38 75 parsed_2ndm 2
39 "peak 86 #SUP 0.77 #QF 0.77" 39 49 39 75 parsed_2ndm 2
40 "peak 89 #SUP 1.00 #QF 0.78" 40 49 40 75 parsed_2ndm 2
41 "peak 95 #SUP 1.00 #QF 0.69" 41 49 41 75 parsed_2ndm 2
42 "peak 111 #SUP 0.95 #QF 0.95" 42 49 42 76 parsed_2ndm 2
43 "peak 113 #SUP 0.96 #QF 0.96" 43 49 43 76 parsed_2ndm 2
44 "peak 114 #SUP 1.00" 44 49 44 67 parsed_2ndm 2
45 "peak 116 #SUP 0.89 #QF 0.89" 45 49 45 76 parsed_2ndm 2
46 "peak 118 #SUP 0.96 #QF 0.96" 46 49 46 76 parsed_2ndm 2
47 "peak 120 #SUP 0.95 #QF 0.95" 47 49 47 76 parsed_2ndm 2
48 "peak 121 #SUP 0.88 #QF 0.88" 48 49 48 76 parsed_2ndm 2
49 "peak 122 #SUP 0.99 #QF 0.49" 49 49 49 76 parsed_2ndm 2
50 "peak 122 #SUP 0.99 #QF 0.49" 50 49 50 76 parsed_2ndm 2
51 "peak 123 #SUP 0.96 #QF 0.96" 51 49 51 76 parsed_2ndm 2
52 "peak 124 #SUP 0.94 #QF 0.94" 52 49 52 76 parsed_2ndm 2
53 "peak 125 #SUP 0.98 #QF 0.98" 53 49 53 76 parsed_2ndm 2
54 "peak 127 #SUP 0.99 #QF 0.99" 54 49 54 76 parsed_2ndm 2
55 "peak 131 #SUP 1.00" 55 49 55 67 parsed_2ndm 2
56 "peak 135 #SUP 0.97 #QF 0.97" 56 49 56 76 parsed_2ndm 2
57 "peak 163 #SUP 0.71 #QF 0.71" 57 49 57 76 parsed_2ndm 2
58 "peak 167 #SUP 0.87 #QF 0.87" 58 49 58 76 parsed_2ndm 2
59 "peak 168 #SUP 0.62 #QF 0.62" 59 49 59 76 parsed_2ndm 2
60 "peak 175 #SUP 1.00" 60 49 60 67 parsed_2ndm 2
61 "peak 186 #SUP 1.00" 61 49 61 67 parsed_2ndm 2
62 "peak 209 #SUP 0.73 #QF 0.73" 62 49 62 76 parsed_2ndm 2
63 "peak 210 #SUP 0.49 #QF 0.49" 63 49 63 76 parsed_2ndm 2
64 "peak 3" 64 49 64 55 parsed_2ndm 2
65 "peak 9" 65 49 65 55 parsed_2ndm 2
66 "peak 138" 66 49 66 57 parsed_2ndm 2
67 "peak 140" 67 49 67 57 parsed_2ndm 2
68 "peak 70" 68 49 68 56 parsed_2ndm 2
69 "peak 144" 69 49 69 57 parsed_2ndm 2
70 "peak 77" 70 49 70 56 parsed_2ndm 2
71 "peak 173" 71 49 71 57 parsed_2ndm 2
72 "peak 157" 72 49 72 57 parsed_2ndm 2
73 "peak 172" 73 49 73 57 parsed_2ndm 2
74 "peak 17" 74 49 74 56 parsed_2ndm 2
75 "peak 19" 75 49 75 56 parsed_2ndm 2
76 "peak 24" 76 49 76 56 parsed_2ndm 2
77 "peak 35" 77 49 77 56 parsed_2ndm 2
78 "peak 57" 78 49 78 56 parsed_2ndm 2
79 "peak 179" 79 49 79 57 parsed_2ndm 2
80 "peak 43" 80 49 80 56 parsed_2ndm 2
81 "peak 55" 81 49 81 56 parsed_2ndm 2
82 "peak 44" 82 49 82 56 parsed_2ndm 2
83 "peak 41" 83 49 83 56 parsed_2ndm 2
84 "peak 52" 84 49 84 56 parsed_2ndm 2
85 "peak 63" 85 49 85 56 parsed_2ndm 2
86 "peak 68" 86 49 86 56 parsed_2ndm 2
87 "peak 67" 87 49 87 56 parsed_2ndm 2
88 "peak 108" 88 49 88 57 parsed_2ndm 2
89 "peak 95" 89 49 89 56 parsed_2ndm 2
90 "peak 86" 90 49 90 56 parsed_2ndm 2
91 "peak 118" 91 49 91 57 parsed_2ndm 2
stop_
save_
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