NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
398813 |
1ttd   |
4415 | cing | 4-filtered-FRED | STAR | entry | full | 457 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ttd
# This FRED archive file contains, for PDB entry <1ttd>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_1ttd
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1ttd
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 7267.63
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 . 1 $DNA__5__D__GP_CP_AP_CP_GP_AP_AP_TP_TP_AP_AP_G__3__ A . 1 1
2 . 2 $DNA__5__D__CP_TP_TP_AP_AP_TP_TP_CP_GP_TP_GP_C__3__ B . 1 1
stop_
save_
save_DNA__5__D__GP_CP_AP_CP_GP_AP_AP_TP_TP_AP_AP_G__3__
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "DNA 5 D GP CP AP CP GP AP AP TP TP AP AP G 3 "
_Entity.Type polymer
_Entity.Polymer_type polydeoxyribonucleotide
_Entity.Polymer_seq_one_letter_code GCACGAATTAAG
_Entity.Number_of_monomers 12
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 DG . 1 1
2 DC . 1 1
3 DA . 1 1
4 DC . 1 1
5 DG . 1 1
6 DA . 1 1
7 DA . 1 1
8 DT . 1 1
9 DT . 1 1
10 DA . 1 1
11 DA . 1 1
12 DG . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
DG 1 1 1 1
DC 2 2 1 1
DA 3 3 1 1
DC 4 4 1 1
DG 5 5 1 1
DA 6 6 1 1
DA 7 7 1 1
DT 8 8 1 1
DT 9 9 1 1
DA 10 10 1 1
DA 11 11 1 1
DG 12 12 1 1
stop_
save_
save_DNA__5__D__CP_TP_TP_AP_AP_TP_TP_CP_GP_TP_GP_C__3__
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "DNA 5 D CP TP TP AP AP TP TP CP GP TP GP C 3 "
_Entity.Type polymer
_Entity.Polymer_type polydeoxyribonucleotide
_Entity.Polymer_seq_one_letter_code CTTAATTCGTGC
_Entity.Number_of_monomers 12
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 DC . 1 2
2 DT . 1 2
3 DT . 1 2
4 DA . 1 2
5 DA . 1 2
6 DT . 1 2
7 DT . 1 2
8 DC . 1 2
9 DG . 1 2
10 DT . 1 2
11 DG . 1 2
12 DC . 1 2
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
DC 1 1 1 2
DT 2 2 1 2
DT 3 3 1 2
DA 4 4 1 2
DA 5 5 1 2
DT 6 6 1 2
DT 7 7 1 2
DC 8 8 1 2
DG 9 9 1 2
DT 10 10 1 2
DG 11 11 1 2
DC 12 12 1 2
stop_
save_
save_Discover_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
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 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
8 1 . . . 1 1
9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
16 1 . . . 1 1
17 1 . . . 1 1
18 1 . . . 1 1
19 1 . . . 1 1
20 1 . . . 1 1
21 1 . . . 1 1
22 1 . . . 1 1
23 1 . . . 1 1
24 1 . . . 1 1
25 1 . . . 1 1
26 1 . . . 1 1
27 1 . . . 1 1
28 1 . . . 1 1
29 1 . . . 1 1
30 1 . . . 1 1
31 1 . . . 1 1
32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
37 1 . . . 1 1
38 1 . . . 1 1
39 1 . . . 1 1
40 1 . . . 1 1
41 1 . . . 1 1
42 1 . . . 1 1
43 1 . . . 1 1
44 1 . . . 1 1
45 1 . . . 1 1
46 1 . . . 1 1
47 1 . . . 1 1
48 1 . . . 1 1
49 1 . . . 1 1
50 1 . . . 1 1
51 1 . . . 1 1
52 1 . . . 1 1
53 1 . . . 1 1
54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
57 1 . . . 1 1
58 1 . . . 1 1
59 1 . . . 1 1
60 1 . . . 1 1
61 1 . . . 1 1
62 1 . . . 1 1
63 1 . . . 1 1
64 1 . . . 1 1
65 1 . . . 1 1
66 1 . . . 1 1
67 1 . . . 1 1
68 1 . . . 1 1
69 1 . . . 1 1
70 1 . . . 1 1
71 1 . . . 1 1
72 1 . . . 1 1
73 1 . . . 1 1
74 1 . . . 1 1
75 1 . . . 1 1
76 1 . . . 1 1
77 1 . . . 1 1
78 1 . . . 1 1
79 1 . . . 1 1
80 1 . . . 1 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.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_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 1 2 DC H5 1 2 C H5 1 1
1 1 2 1 1 2 DC H6 1 2 C H6 1 1
2 1 1 1 1 4 DC H5 1 4 C H5 1 1
2 1 2 1 1 4 DC H6 1 4 C H6 1 1
3 1 1 2 2 1 DC H5 2 1 C H5 1 1
3 1 2 2 2 1 DC H6 2 1 C H6 1 1
4 1 1 2 2 8 DC H5 2 8 C H5 1 1
4 1 2 2 2 8 DC H6 2 8 C H6 1 1
5 1 1 2 2 12 DC H5 2 12 C H5 1 1
5 1 2 2 2 12 DC H6 2 12 C H6 1 1
6 1 1 1 1 3 DA H8 1 3 A H8 1 1
6 1 2 1 1 4 DC H5 1 4 C H5 1 1
7 1 1 2 2 7 DT H6 2 7 T H6 1 1
7 1 2 2 2 8 DC H5 2 8 C H5 1 1
8 1 1 2 2 11 DG H8 2 11 G H8 1 1
8 1 2 2 2 12 DC H5 2 12 C H5 1 1
9 1 1 1 1 1 DG H1' 1 1 G H1' 1 1
9 1 2 1 1 2 DC H5 1 2 C H5 1 1
10 1 1 1 1 3 DA H1' 1 3 A H1' 1 1
10 1 2 1 1 4 DC H5 1 4 C H5 1 1
11 1 1 2 2 7 DT H1' 2 7 T H1' 1 1
11 1 2 2 2 8 DC H5 2 8 C H5 1 1
12 1 1 2 2 11 DG H1' 2 11 G H1' 1 1
12 1 2 2 2 12 DC H5 2 12 C H5 1 1
13 1 1 1 1 2 DC H5 1 2 C H5 1 1
13 1 2 1 1 3 DA H2 1 3 A H2 1 1
14 1 1 1 1 3 DA H1' 1 3 A H1' 1 1
14 1 2 1 1 3 DA H2 1 3 A H2 1 1
15 1 1 1 1 6 DA H1' 1 6 A H1' 1 1
15 1 2 1 1 6 DA H2 1 6 A H2 1 1
16 1 1 1 1 7 DA H1' 1 7 A H1' 1 1
16 1 2 1 1 7 DA H2 1 7 A H2 1 1
17 1 1 1 1 10 DA H1' 1 10 A H1' 1 1
17 1 2 1 1 10 DA H2 1 10 A H2 1 1
18 1 1 1 1 11 DA H1' 1 11 A H1' 1 1
18 1 2 1 1 11 DA H2 1 11 A H2 1 1
19 1 1 2 2 4 DA H1' 2 4 A H1' 1 1
19 1 2 2 2 4 DA H2 2 4 A H2 1 1
20 1 1 2 2 5 DA H1' 2 5 A H1' 1 1
20 1 2 2 2 5 DA H2 2 5 A H2 1 1
21 1 1 1 1 3 DA H2 1 3 A H2 1 1
21 1 2 1 1 4 DC H1' 1 4 C H1' 1 1
22 1 1 1 1 6 DA H2 1 6 A H2 1 1
22 1 2 1 1 7 DA H1' 1 7 A H1' 1 1
23 1 1 1 1 7 DA H2 1 7 A H2 1 1
23 1 2 1 1 8 DT H1' 1 8 T H1' 1 1
24 1 1 1 1 10 DA H2 1 10 A H2 1 1
24 1 2 1 1 11 DA H1' 1 11 A H1' 1 1
25 1 1 1 1 11 DA H2 1 11 A H2 1 1
25 1 2 1 1 12 DG H1' 1 12 G H1' 1 1
26 1 1 2 2 4 DA H2 2 4 A H2 1 1
26 1 2 2 2 5 DA H1' 2 5 A H1' 1 1
27 1 1 2 2 5 DA H2 2 5 A H2 1 1
27 1 2 2 2 6 DT H1' 2 6 T H1' 1 1
28 1 1 1 1 3 DA H2 1 3 A H2 1 1
28 1 2 2 2 11 DG H1' 2 11 G H1' 1 1
29 1 1 1 1 6 DA H2 1 6 A H2 1 1
29 1 2 2 2 8 DC H1' 2 8 C H1' 1 1
30 1 1 1 1 7 DA H2 1 7 A H2 1 1
30 1 2 2 2 7 DT H1' 2 7 T H1' 1 1
31 1 1 1 1 10 DA H2 1 10 A H2 1 1
31 1 2 2 2 4 DA H1' 2 4 A H1' 1 1
32 1 1 1 1 11 DA H2 1 11 A H2 1 1
32 1 2 2 2 3 DT H1' 2 3 T H1' 1 1
33 1 1 1 1 10 DA H1' 1 10 A H1' 1 1
33 1 2 2 2 4 DA H2 2 4 A H2 1 1
34 1 1 1 1 9 DT H1' 1 9 T H1' 1 1
34 1 2 2 2 5 DA H2 2 5 A H2 1 1
35 1 1 1 1 1 DG H1' 1 1 G H1' 1 1
35 1 2 1 1 1 DG H8 1 1 G H8 1 1
36 1 1 1 1 2 DC H1' 1 2 C H1' 1 1
36 1 2 1 1 2 DC H6 1 2 C H6 1 1
37 1 1 1 1 3 DA H1' 1 3 A H1' 1 1
37 1 2 1 1 3 DA H8 1 3 A H8 1 1
38 1 1 1 1 4 DC H1' 1 4 C H1' 1 1
38 1 2 1 1 4 DC H6 1 4 C H6 1 1
39 1 1 1 1 5 DG H1' 1 5 G H1' 1 1
39 1 2 1 1 5 DG H8 1 5 G H8 1 1
40 1 1 1 1 6 DA H1' 1 6 A H1' 1 1
40 1 2 1 1 6 DA H8 1 6 A H8 1 1
41 1 1 1 1 7 DA H1' 1 7 A H1' 1 1
41 1 2 1 1 7 DA H8 1 7 A H8 1 1
42 1 1 1 1 8 DT H1' 1 8 T H1' 1 1
42 1 2 1 1 8 DT H6 1 8 T H6 1 1
43 1 1 1 1 9 DT H1' 1 9 T H1' 1 1
43 1 2 1 1 9 DT H6 1 9 T H6 1 1
44 1 1 1 1 10 DA H1' 1 10 A H1' 1 1
44 1 2 1 1 10 DA H8 1 10 A H8 1 1
45 1 1 1 1 11 DA H1' 1 11 A H1' 1 1
45 1 2 1 1 11 DA H8 1 11 A H8 1 1
46 1 1 1 1 12 DG H1' 1 12 G H1' 1 1
46 1 2 1 1 12 DG H8 1 12 G H8 1 1
47 1 1 2 2 1 DC H1' 2 1 C H1' 1 1
47 1 2 2 2 1 DC H6 2 1 C H6 1 1
48 1 1 2 2 2 DT H1' 2 2 T H1' 1 1
48 1 2 2 2 2 DT H6 2 2 T H6 1 1
49 1 1 2 2 3 DT H1' 2 3 T H1' 1 1
49 1 2 2 2 3 DT H6 2 3 T H6 1 1
50 1 1 2 2 4 DA H1' 2 4 A H1' 1 1
50 1 2 2 2 4 DA H8 2 4 A H8 1 1
51 1 1 2 2 5 DA H1' 2 5 A H1' 1 1
51 1 2 2 2 5 DA H8 2 5 A H8 1 1
52 1 1 2 2 6 DT H1' 2 6 T H1' 1 1
52 1 2 2 2 6 DT H6 2 6 T H6 1 1
53 1 1 2 2 7 DT H1' 2 7 T H1' 1 1
53 1 2 2 2 7 DT H6 2 7 T H6 1 1
54 1 1 2 2 8 DC H1' 2 8 C H1' 1 1
54 1 2 2 2 8 DC H6 2 8 C H6 1 1
55 1 1 2 2 9 DG H1' 2 9 G H1' 1 1
55 1 2 2 2 9 DG H8 2 9 G H8 1 1
56 1 1 2 2 10 DT H1' 2 10 T H1' 1 1
56 1 2 2 2 10 DT H6 2 10 T H6 1 1
57 1 1 2 2 11 DG H1' 2 11 G H1' 1 1
57 1 2 2 2 11 DG H8 2 11 G H8 1 1
58 1 1 2 2 12 DC H1' 2 12 C H1' 1 1
58 1 2 2 2 12 DC H6 2 12 C H6 1 1
59 1 1 1 1 1 DG H1' 1 1 G H1' 1 1
59 1 2 1 1 2 DC H6 1 2 C H6 1 1
60 1 1 1 1 2 DC H1' 1 2 C H1' 1 1
60 1 2 1 1 3 DA H8 1 3 A H8 1 1
61 1 1 1 1 3 DA H1' 1 3 A H1' 1 1
61 1 2 1 1 4 DC H6 1 4 C H6 1 1
62 1 1 1 1 4 DC H1' 1 4 C H1' 1 1
62 1 2 1 1 5 DG H8 1 5 G H8 1 1
63 1 1 1 1 5 DG H1' 1 5 G H1' 1 1
63 1 2 1 1 6 DA H8 1 6 A H8 1 1
64 1 1 1 1 6 DA H1' 1 6 A H1' 1 1
64 1 2 1 1 7 DA H8 1 7 A H8 1 1
65 1 1 1 1 7 DA H1' 1 7 A H1' 1 1
65 1 2 1 1 8 DT H6 1 8 T H6 1 1
66 1 1 1 1 8 DT H1' 1 8 T H1' 1 1
66 1 2 1 1 9 DT H6 1 9 T H6 1 1
67 1 1 1 1 9 DT H1' 1 9 T H1' 1 1
67 1 2 1 1 10 DA H8 1 10 A H8 1 1
68 1 1 1 1 10 DA H1' 1 10 A H1' 1 1
68 1 2 1 1 11 DA H8 1 11 A H8 1 1
69 1 1 1 1 11 DA H1' 1 11 A H1' 1 1
69 1 2 1 1 12 DG H8 1 12 G H8 1 1
70 1 1 2 2 1 DC H1' 2 1 C H1' 1 1
70 1 2 2 2 2 DT H6 2 2 T H6 1 1
71 1 1 2 2 2 DT H1' 2 2 T H1' 1 1
71 1 2 2 2 3 DT H6 2 3 T H6 1 1
72 1 1 2 2 3 DT H1' 2 3 T H1' 1 1
72 1 2 2 2 4 DA H8 2 4 A H8 1 1
73 1 1 2 2 4 DA H1' 2 4 A H1' 1 1
73 1 2 2 2 5 DA H8 2 5 A H8 1 1
74 1 1 2 2 5 DA H1' 2 5 A H1' 1 1
74 1 2 2 2 6 DT H6 2 6 T H6 1 1
75 1 1 2 2 6 DT H1' 2 6 T H1' 1 1
75 1 2 2 2 7 DT H6 2 7 T H6 1 1
76 1 1 2 2 7 DT H1' 2 7 T H1' 1 1
76 1 2 2 2 8 DC H6 2 8 C H6 1 1
77 1 1 2 2 8 DC H1' 2 8 C H1' 1 1
77 1 2 2 2 9 DG H8 2 9 G H8 1 1
78 1 1 2 2 9 DG H1' 2 9 G H1' 1 1
78 1 2 2 2 10 DT H6 2 10 T H6 1 1
79 1 1 2 2 10 DT H1' 2 10 T H1' 1 1
79 1 2 2 2 11 DG H8 2 11 G H8 1 1
80 1 1 2 2 11 DG H1' 2 11 G H1' 1 1
80 1 2 2 2 12 DC H6 2 12 C H6 1 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 . . . . . 0.0 2.46 2.48 1 1
2 1 . . . . . 0.0 2.46 2.48 1 1
3 1 . . . . . 0.0 2.46 2.48 1 1
4 1 . . . . . 0.0 2.46 2.48 1 1
5 1 . . . . . 0.0 2.46 2.48 1 1
6 1 . . . . . 0.0 3.8 4.0 1 1
7 1 . . . . . 0.0 3.6 3.8 1 1
8 1 . . . . . 0.0 4.5 6.0 1 1
9 1 . . . . . 0.0 3.6 4.2 1 1
10 1 . . . . . 0.0 3.6 4.2 1 1
11 1 . . . . . 0.0 3.6 4.2 1 1
12 1 . . . . . 0.0 3.6 4.2 1 1
13 1 . . . . . 0.0 5.5 6.5 1 1
14 1 . . . . . 0.0 4.3 4.5 1 1
15 1 . . . . . 0.0 4.3 4.5 1 1
16 1 . . . . . 0.0 4.3 4.5 1 1
17 1 . . . . . 0.0 4.3 4.5 1 1
18 1 . . . . . 0.0 4.3 4.5 1 1
19 1 . . . . . 0.0 4.3 4.5 1 1
20 1 . . . . . 0.0 4.3 4.5 1 1
21 1 . . . . . 0.0 3.8 4.0 1 1
22 1 . . . . . 0.0 3.8 4.0 1 1
23 1 . . . . . 0.0 4.4 4.6 1 1
24 1 . . . . . 0.0 3.8 4.0 1 1
25 1 . . . . . 0.0 3.8 4.0 1 1
26 1 . . . . . 0.0 3.8 4.0 1 1
27 1 . . . . . 0.0 3.6 3.8 1 1
28 1 . . . . . 0.0 4.0 4.2 1 1
29 1 . . . . . 0.0 3.8 4.0 1 1
30 1 . . . . . 0.0 3.7 3.9 1 1
31 1 . . . . . 0.0 4.8 5.0 1 1
32 1 . . . . . 0.0 4.5 4.7 1 1
33 1 . . . . . 0.0 4.5 4.7 1 1
34 1 . . . . . 0.0 4.5 4.7 1 1
35 1 . . . . . 0.0 2.6 3.7 1 1
36 1 . . . . . 0.0 3.5 3.7 1 1
37 1 . . . . . 0.0 3.3 3.5 1 1
38 1 . . . . . 0.0 3.2 3.4 1 1
39 1 . . . . . 0.0 3.5 3.7 1 1
40 1 . . . . . 0.0 3.5 3.7 1 1
41 1 . . . . . 0.0 3.5 3.7 1 1
42 1 . . . . . 0.0 3.5 3.7 1 1
43 1 . . . . . 0.0 3.0 3.2 1 1
44 1 . . . . . 0.0 3.5 3.7 1 1
45 1 . . . . . 0.0 3.6 3.8 1 1
46 1 . . . . . 0.0 3.5 3.7 1 1
47 1 . . . . . 0.0 3.4 3.6 1 1
48 1 . . . . . 0.0 3.0 3.2 1 1
49 1 . . . . . 0.0 2.6 3.7 1 1
50 1 . . . . . 0.0 3.5 3.7 1 1
51 1 . . . . . 0.0 3.5 3.7 1 1
52 1 . . . . . 0.0 3.2 3.4 1 1
53 1 . . . . . 0.0 3.1 3.3 1 1
54 1 . . . . . 0.0 3.5 3.7 1 1
55 1 . . . . . 0.0 3.5 3.7 1 1
56 1 . . . . . 0.0 3.2 3.4 1 1
57 1 . . . . . 0.0 3.5 3.7 1 1
58 1 . . . . . 0.0 3.5 3.7 1 1
59 1 . . . . . 0.0 3.4 3.7 1 1
60 1 . . . . . 0.0 3.5 3.7 1 1
61 1 . . . . . 0.0 3.6 3.8 1 1
62 1 . . . . . 0.0 3.7 3.9 1 1
63 1 . . . . . 0.0 3.6 3.8 1 1
64 1 . . . . . 0.0 3.4 3.7 1 1
65 1 . . . . . 0.0 3.8 4.0 1 1
66 1 . . . . . 0.0 3.8 4.0 1 1
67 1 . . . . . 0.0 3.2 3.5 1 1
68 1 . . . . . 0.0 3.6 3.9 1 1
69 1 . . . . . 0.0 3.5 3.7 1 1
70 1 . . . . . 0.0 3.7 4.0 1 1
71 1 . . . . . 0.0 3.4 3.7 1 1
72 1 . . . . . 0.0 3.6 3.9 1 1
73 1 . . . . . 0.0 3.8 4.0 1 1
74 1 . . . . . 0.0 3.8 4.0 1 1
75 1 . . . . . 0.0 3.6 3.8 1 1
76 1 . . . . . 0.0 3.4 3.7 1 1
77 1 . . . . . 0.0 3.4 3.7 1 1
78 1 . . . . . 0.0 3.4 3.8 1 1
79 1 . . . . . 0.0 3.7 3.9 1 1
80 1 . . . . . 0.0 3.4 3.7 1 1
stop_
save_
save_Discover_distance_constraints_5_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
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 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 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.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_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 1 7 DA H8 1 7 A H8 1 2
1 1 2 1 1 8 DT C7 1 8 T C5M 1 2
2 1 1 1 1 8 DT H6 1 8 T H6 1 2
2 1 2 1 1 9 DT C7 1 9 T C5M 1 2
3 1 1 2 2 1 DC H6 2 1 C H6 1 2
3 1 2 2 2 2 DT C7 2 2 T C5M 1 2
4 1 1 2 2 2 DT H6 2 2 T H6 1 2
4 1 2 2 2 3 DT C7 2 3 T C5M 1 2
5 1 1 2 2 5 DA H8 2 5 A H8 1 2
5 1 2 2 2 6 DT C7 2 6 T C5M 1 2
6 1 1 2 2 9 DG H8 2 9 G H8 1 2
6 1 2 2 2 10 DT C7 2 10 T C5M 1 2
7 1 1 1 1 8 DT C7 1 8 T C5M 1 2
7 1 2 1 1 8 DT H6 1 8 T H6 1 2
8 1 1 1 1 9 DT C7 1 9 T C5M 1 2
8 1 2 1 1 9 DT H6 1 9 T H6 1 2
9 1 1 2 2 2 DT C7 2 2 T C5M 1 2
9 1 2 2 2 2 DT H6 2 2 T H6 1 2
10 1 1 2 2 3 DT C7 2 3 T C5M 1 2
10 1 2 2 2 3 DT H6 2 3 T H6 1 2
11 1 1 2 2 6 DT C7 2 6 T C5M 1 2
11 1 2 2 2 6 DT H6 2 6 T H6 1 2
12 1 1 2 2 7 DT C7 2 7 T C5M 1 2
12 1 2 2 2 7 DT H6 2 7 T H6 1 2
13 1 1 2 2 10 DT C7 2 10 T C5M 1 2
13 1 2 2 2 10 DT H6 2 10 T H6 1 2
14 1 1 1 1 8 DT C7 1 8 T C5M 1 2
14 1 2 1 1 9 DT H6 1 9 T H6 1 2
15 1 1 2 2 2 DT C7 2 2 T C5M 1 2
15 1 2 2 2 3 DT C7 2 3 T C5M 1 2
16 1 1 1 1 7 DA H1' 1 7 A H1' 1 2
16 1 2 1 1 8 DT C7 1 8 T C5M 1 2
17 1 1 1 1 7 DA H3' 1 7 A H3' 1 2
17 1 2 1 1 8 DT C7 1 8 T C5M 1 2
18 1 1 2 2 5 DA H3' 2 5 A H3' 1 2
18 1 2 2 2 6 DT C7 2 6 T C5M 1 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 . . . . . 0.0 4.2 4.6 1 2
2 1 . . . . . 0.0 3.2 3.5 1 2
3 1 . . . . . 0.0 3.4 3.7 1 2
4 1 . . . . . 0.0 3.4 3.7 1 2
5 1 . . . . . 0.0 4.2 4.6 1 2
6 1 . . . . . 0.0 3.5 4.0 1 2
7 1 . . . . . 0.0 3.2 3.6 1 2
8 1 . . . . . 0.0 2.6 2.8 1 2
9 1 . . . . . 0.0 2.8 3.0 1 2
10 1 . . . . . 0.0 2.5 2.8 1 2
11 1 . . . . . 0.0 2.8 3.4 1 2
12 1 . . . . . 0.0 2.8 3.4 1 2
13 1 . . . . . 0.0 2.8 3.4 1 2
14 1 . . . . . 0.0 4.0 4.5 1 2
15 1 . . . . . 0.0 3.5 3.9 1 2
16 1 . . . . . 0.0 4.2 4.8 1 2
17 1 . . . . . 0.0 5.5 6.0 1 2
18 1 . . . . . 0.0 5.0 6.0 1 2
stop_
save_
save_Discover_distance_constraints_6_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
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 . . . 1 3
2 1 . . . 1 3
3 1 . . . 1 3
4 1 . . . 1 3
5 1 . . . 1 3
6 1 . . . 1 3
7 1 . . . 1 3
8 1 . . . 1 3
9 1 . . . 1 3
10 1 . . . 1 3
11 1 . . . 1 3
12 1 . . . 1 3
13 1 . . . 1 3
14 1 . . . 1 3
15 1 . . . 1 3
16 1 . . . 1 3
17 1 . . . 1 3
18 1 . . . 1 3
19 1 . . . 1 3
20 1 . . . 1 3
21 1 . . . 1 3
22 1 . . . 1 3
23 1 . . . 1 3
24 1 . . . 1 3
25 1 . . . 1 3
26 1 . . . 1 3
27 1 . . . 1 3
28 1 . . . 1 3
29 1 . . . 1 3
30 1 . . . 1 3
31 1 . . . 1 3
32 1 . . . 1 3
33 1 . . . 1 3
34 1 . . . 1 3
35 1 . . . 1 3
36 1 . . . 1 3
37 1 . . . 1 3
38 1 . . . 1 3
39 1 . . . 1 3
40 1 . . . 1 3
41 1 . . . 1 3
42 1 . . . 1 3
43 1 . . . 1 3
44 1 . . . 1 3
45 1 . . . 1 3
46 1 . . . 1 3
47 1 . . . 1 3
48 1 . . . 1 3
49 1 . . . 1 3
50 1 . . . 1 3
51 1 . . . 1 3
52 1 . . . 1 3
53 1 . . . 1 3
54 1 . . . 1 3
55 1 . . . 1 3
56 1 . . . 1 3
57 1 . . . 1 3
58 1 . . . 1 3
59 1 . . . 1 3
60 1 . . . 1 3
61 1 . . . 1 3
62 1 . . . 1 3
63 1 . . . 1 3
64 1 . . . 1 3
65 1 . . . 1 3
66 1 . . . 1 3
67 1 . . . 1 3
68 1 . . . 1 3
69 1 . . . 1 3
70 1 . . . 1 3
71 1 . . . 1 3
72 1 . . . 1 3
73 1 . . . 1 3
74 1 . . . 1 3
75 1 . . . 1 3
76 1 . . . 1 3
77 1 . . . 1 3
78 1 . . . 1 3
79 1 . . . 1 3
80 1 . . . 1 3
81 1 . . . 1 3
82 1 . . . 1 3
83 1 . . . 1 3
84 1 . . . 1 3
85 1 . . . 1 3
86 1 . . . 1 3
87 1 . . . 1 3
88 1 . . . 1 3
89 1 . . . 1 3
90 1 . . . 1 3
91 1 . . . 1 3
92 1 . . . 1 3
93 1 . . . 1 3
94 1 . . . 1 3
95 1 . . . 1 3
96 1 . . . 1 3
97 1 . . . 1 3
98 1 . . . 1 3
99 1 . . . 1 3
100 1 . . . 1 3
101 1 . . . 1 3
102 1 . . . 1 3
103 1 . . . 1 3
104 1 . . . 1 3
105 1 . . . 1 3
106 1 . . . 1 3
107 1 . . . 1 3
108 1 . . . 1 3
109 1 . . . 1 3
110 1 . . . 1 3
111 1 . . . 1 3
112 1 . . . 1 3
113 1 . . . 1 3
114 1 . . . 1 3
115 1 . . . 1 3
116 1 . . . 1 3
117 1 . . . 1 3
118 1 . . . 1 3
119 1 . . . 1 3
120 1 . . . 1 3
121 1 . . . 1 3
122 1 . . . 1 3
123 1 . . . 1 3
124 1 . . . 1 3
125 1 . . . 1 3
126 1 . . . 1 3
127 1 . . . 1 3
128 1 . . . 1 3
129 1 . . . 1 3
130 1 . . . 1 3
131 1 . . . 1 3
132 1 . . . 1 3
133 1 . . . 1 3
134 1 . . . 1 3
135 1 . . . 1 3
136 1 . . . 1 3
137 1 . . . 1 3
138 1 . . . 1 3
139 1 . . . 1 3
140 1 . . . 1 3
141 1 . . . 1 3
142 1 . . . 1 3
143 1 . . . 1 3
144 1 . . . 1 3
145 1 . . . 1 3
146 1 . . . 1 3
147 1 . . . 1 3
148 1 . . . 1 3
149 1 . . . 1 3
150 1 . . . 1 3
151 1 . . . 1 3
152 1 . . . 1 3
153 1 . . . 1 3
154 1 . . . 1 3
155 1 . . . 1 3
156 1 . . . 1 3
157 1 . . . 1 3
158 1 . . . 1 3
159 1 . . . 1 3
160 1 . . . 1 3
161 1 . . . 1 3
162 1 . . . 1 3
163 1 . . . 1 3
164 1 . . . 1 3
165 1 . . . 1 3
166 1 . . . 1 3
167 1 . . . 1 3
168 1 . . . 1 3
169 1 . . . 1 3
170 1 . . . 1 3
171 1 . . . 1 3
172 1 . . . 1 3
173 1 . . . 1 3
174 1 . . . 1 3
175 1 . . . 1 3
176 1 . . . 1 3
177 1 . . . 1 3
178 1 . . . 1 3
179 1 . . . 1 3
180 1 . . . 1 3
181 1 . . . 1 3
182 1 . . . 1 3
183 1 . . . 1 3
184 1 . . . 1 3
185 1 . . . 1 3
186 1 . . . 1 3
187 1 . . . 1 3
188 1 . . . 1 3
189 1 . . . 1 3
190 1 . . . 1 3
191 1 . . . 1 3
192 1 . . . 1 3
193 1 . . . 1 3
194 1 . . . 1 3
195 1 . . . 1 3
196 1 . . . 1 3
197 1 . . . 1 3
198 1 . . . 1 3
199 1 . . . 1 3
200 1 . . . 1 3
201 1 . . . 1 3
202 1 . . . 1 3
203 1 . . . 1 3
204 1 . . . 1 3
205 1 . . . 1 3
206 1 . . . 1 3
207 1 . . . 1 3
208 1 . . . 1 3
209 1 . . . 1 3
210 1 . . . 1 3
211 1 . . . 1 3
212 1 . . . 1 3
213 1 . . . 1 3
214 1 . . . 1 3
215 1 . . . 1 3
216 1 . . . 1 3
217 1 . . . 1 3
218 1 . . . 1 3
219 1 . . . 1 3
220 1 . . . 1 3
221 1 . . . 1 3
222 1 . . . 1 3
223 1 . . . 1 3
224 1 . . . 1 3
225 1 . . . 1 3
226 1 . . . 1 3
227 1 . . . 1 3
228 1 . . . 1 3
229 1 . . . 1 3
230 1 . . . 1 3
231 1 . . . 1 3
232 1 . . . 1 3
233 1 . . . 1 3
234 1 . . . 1 3
235 1 . . . 1 3
236 1 . . . 1 3
237 1 . . . 1 3
238 1 . . . 1 3
239 1 . . . 1 3
240 1 . . . 1 3
241 1 . . . 1 3
242 1 . . . 1 3
243 1 . . . 1 3
244 1 . . . 1 3
245 1 . . . 1 3
246 1 . . . 1 3
247 1 . . . 1 3
248 1 . . . 1 3
249 1 . . . 1 3
250 1 . . . 1 3
251 1 . . . 1 3
252 1 . . . 1 3
253 1 . . . 1 3
254 1 . . . 1 3
255 1 . . . 1 3
256 1 . . . 1 3
257 1 . . . 1 3
258 1 . . . 1 3
259 1 . . . 1 3
260 1 . . . 1 3
261 1 . . . 1 3
262 1 . . . 1 3
263 1 . . . 1 3
264 1 . . . 1 3
265 1 . . . 1 3
266 1 . . . 1 3
267 1 . . . 1 3
268 1 . . . 1 3
269 1 . . . 1 3
270 1 . . . 1 3
271 1 . . . 1 3
272 1 . . . 1 3
273 1 . . . 1 3
274 1 . . . 1 3
275 1 . . . 1 3
276 1 . . . 1 3
277 1 . . . 1 3
278 1 . . . 1 3
279 1 . . . 1 3
280 1 . . . 1 3
281 1 . . . 1 3
282 1 . . . 1 3
283 1 . . . 1 3
284 1 . . . 1 3
285 1 . . . 1 3
286 1 . . . 1 3
287 1 . . . 1 3
288 1 . . . 1 3
289 1 . . . 1 3
290 1 . . . 1 3
291 1 . . . 1 3
292 1 . . . 1 3
293 1 . . . 1 3
294 1 . . . 1 3
295 1 . . . 1 3
296 1 . . . 1 3
297 1 . . . 1 3
298 1 . . . 1 3
299 1 . . . 1 3
300 1 . . . 1 3
301 1 . . . 1 3
302 1 . . . 1 3
303 1 . . . 1 3
304 1 . . . 1 3
305 1 . . . 1 3
306 1 . . . 1 3
307 1 . . . 1 3
308 1 . . . 1 3
309 1 . . . 1 3
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.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_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 1 1 DG H2' 1 1 G H2'2 1 3
1 1 2 1 1 1 DG H8 1 1 G H8 1 3
2 1 1 1 1 2 DC H2' 1 2 C H2'2 1 3
2 1 2 1 1 2 DC H6 1 2 C H6 1 3
3 1 1 1 1 3 DA H2' 1 3 A H2'2 1 3
3 1 2 1 1 3 DA H8 1 3 A H8 1 3
4 1 1 1 1 4 DC H2' 1 4 C H2'2 1 3
4 1 2 1 1 4 DC H6 1 4 C H6 1 3
5 1 1 1 1 5 DG H2' 1 5 G H2'2 1 3
5 1 2 1 1 5 DG H8 1 5 G H8 1 3
6 1 1 1 1 6 DA H2' 1 6 A H2'2 1 3
6 1 2 1 1 6 DA H8 1 6 A H8 1 3
7 1 1 1 1 7 DA H2' 1 7 A H2'2 1 3
7 1 2 1 1 7 DA H8 1 7 A H8 1 3
8 1 1 1 1 8 DT H2' 1 8 T H2'2 1 3
8 1 2 1 1 8 DT H6 1 8 T H6 1 3
9 1 1 1 1 9 DT H2' 1 9 T H2'2 1 3
9 1 2 1 1 9 DT H6 1 9 T H6 1 3
10 1 1 1 1 10 DA H2' 1 10 A H2'2 1 3
10 1 2 1 1 10 DA H8 1 10 A H8 1 3
11 1 1 1 1 11 DA H2' 1 11 A H2'2 1 3
11 1 2 1 1 11 DA H8 1 11 A H8 1 3
12 1 1 1 1 12 DG H2' 1 12 G H2'2 1 3
12 1 2 1 1 12 DG H8 1 12 G H8 1 3
13 1 1 2 2 1 DC H2' 2 1 C H2'2 1 3
13 1 2 2 2 1 DC H6 2 1 C H6 1 3
14 1 1 2 2 2 DT H2' 2 2 T H2'2 1 3
14 1 2 2 2 2 DT H6 2 2 T H6 1 3
15 1 1 2 2 3 DT H2' 2 3 T H2'2 1 3
15 1 2 2 2 3 DT H6 2 3 T H6 1 3
16 1 1 2 2 4 DA H2' 2 4 A H2'2 1 3
16 1 2 2 2 4 DA H8 2 4 A H8 1 3
17 1 1 2 2 5 DA H2' 2 5 A H2'2 1 3
17 1 2 2 2 5 DA H8 2 5 A H8 1 3
18 1 1 2 2 6 DT H2' 2 6 T H2'2 1 3
18 1 2 2 2 6 DT H6 2 6 T H6 1 3
19 1 1 2 2 7 DT H2' 2 7 T H2'2 1 3
19 1 2 2 2 7 DT H6 2 7 T H6 1 3
20 1 1 2 2 8 DC H2' 2 8 C H2'2 1 3
20 1 2 2 2 8 DC H6 2 8 C H6 1 3
21 1 1 2 2 9 DG H2' 2 9 G H2'2 1 3
21 1 2 2 2 9 DG H8 2 9 G H8 1 3
22 1 1 2 2 10 DT H2' 2 10 T H2'2 1 3
22 1 2 2 2 10 DT H6 2 10 T H6 1 3
23 1 1 2 2 11 DG H2' 2 11 G H2'2 1 3
23 1 2 2 2 11 DG H8 2 11 G H8 1 3
24 1 1 2 2 12 DC H2' 2 12 C H2'2 1 3
24 1 2 2 2 12 DC H6 2 12 C H6 1 3
25 1 1 1 1 1 DG H2' 1 1 G H2'2 1 3
25 1 2 1 1 2 DC H6 1 2 C H6 1 3
26 1 1 1 1 2 DC H2' 1 2 C H2'2 1 3
26 1 2 1 1 3 DA H8 1 3 A H8 1 3
27 1 1 1 1 3 DA H2' 1 3 A H2'2 1 3
27 1 2 1 1 4 DC H6 1 4 C H6 1 3
28 1 1 1 1 4 DC H2' 1 4 C H2'2 1 3
28 1 2 1 1 5 DG H8 1 5 G H8 1 3
29 1 1 1 1 5 DG H2' 1 5 G H2'2 1 3
29 1 2 1 1 6 DA H8 1 6 A H8 1 3
30 1 1 1 1 6 DA H2' 1 6 A H2'2 1 3
30 1 2 1 1 7 DA H8 1 7 A H8 1 3
31 1 1 1 1 7 DA H2' 1 7 A H2'2 1 3
31 1 2 1 1 8 DT H6 1 8 T H6 1 3
32 1 1 1 1 8 DT H2' 1 8 T H2'2 1 3
32 1 2 1 1 9 DT H6 1 9 T H6 1 3
33 1 1 1 1 9 DT H2' 1 9 T H2'2 1 3
33 1 2 1 1 10 DA H8 1 10 A H8 1 3
34 1 1 1 1 10 DA H2' 1 10 A H2'2 1 3
34 1 2 1 1 11 DA H8 1 11 A H8 1 3
35 1 1 1 1 11 DA H2' 1 11 A H2'2 1 3
35 1 2 1 1 12 DG H8 1 12 G H8 1 3
36 1 1 2 2 1 DC H2' 2 1 C H2'2 1 3
36 1 2 2 2 2 DT H6 2 2 T H6 1 3
37 1 1 2 2 2 DT H2' 2 2 T H2'2 1 3
37 1 2 2 2 3 DT H6 2 3 T H6 1 3
38 1 1 2 2 3 DT H2' 2 3 T H2'2 1 3
38 1 2 2 2 4 DA H8 2 4 A H8 1 3
39 1 1 2 2 4 DA H2' 2 4 A H2'2 1 3
39 1 2 2 2 5 DA H8 2 5 A H8 1 3
40 1 1 2 2 5 DA H2' 2 5 A H2'2 1 3
40 1 2 2 2 6 DT H6 2 6 T H6 1 3
41 1 1 2 2 6 DT H2' 2 6 T H2'2 1 3
41 1 2 2 2 7 DT H6 2 7 T H6 1 3
42 1 1 2 2 7 DT H2' 2 7 T H2'2 1 3
42 1 2 2 2 8 DC H6 2 8 C H6 1 3
43 1 1 2 2 8 DC H2' 2 8 C H2'2 1 3
43 1 2 2 2 9 DG H8 2 9 G H8 1 3
44 1 1 2 2 9 DG H2' 2 9 G H2'2 1 3
44 1 2 2 2 10 DT H6 2 10 T H6 1 3
45 1 1 2 2 10 DT H2' 2 10 T H2'2 1 3
45 1 2 2 2 11 DG H8 2 11 G H8 1 3
46 1 1 2 2 11 DG H2' 2 11 G H2'2 1 3
46 1 2 2 2 12 DC H6 2 12 C H6 1 3
47 1 1 1 1 1 DG H2'' 1 1 G H2'1 1 3
47 1 2 1 1 1 DG H8 1 1 G H8 1 3
48 1 1 1 1 2 DC H2'' 1 2 C H2'1 1 3
48 1 2 1 1 2 DC H6 1 2 C H6 1 3
49 1 1 1 1 3 DA H2'' 1 3 A H2'1 1 3
49 1 2 1 1 3 DA H8 1 3 A H8 1 3
50 1 1 1 1 4 DC H2'' 1 4 C H2'1 1 3
50 1 2 1 1 4 DC H6 1 4 C H6 1 3
51 1 1 1 1 5 DG H2'' 1 5 G H2'1 1 3
51 1 2 1 1 5 DG H8 1 5 G H8 1 3
52 1 1 1 1 6 DA H2'' 1 6 A H2'1 1 3
52 1 2 1 1 6 DA H8 1 6 A H8 1 3
53 1 1 1 1 7 DA H2'' 1 7 A H2'1 1 3
53 1 2 1 1 7 DA H8 1 7 A H8 1 3
54 1 1 1 1 8 DT H2'' 1 8 T H2'1 1 3
54 1 2 1 1 8 DT H6 1 8 T H6 1 3
55 1 1 1 1 9 DT H2'' 1 9 T H2'1 1 3
55 1 2 1 1 9 DT H6 1 9 T H6 1 3
56 1 1 1 1 10 DA H2'' 1 10 A H2'1 1 3
56 1 2 1 1 10 DA H8 1 10 A H8 1 3
57 1 1 1 1 11 DA H2'' 1 11 A H2'1 1 3
57 1 2 1 1 11 DA H8 1 11 A H8 1 3
58 1 1 1 1 12 DG H2'' 1 12 G H2'1 1 3
58 1 2 1 1 12 DG H8 1 12 G H8 1 3
59 1 1 2 2 1 DC H2'' 2 1 C H2'1 1 3
59 1 2 2 2 1 DC H6 2 1 C H6 1 3
60 1 1 2 2 2 DT H2'' 2 2 T H2'1 1 3
60 1 2 2 2 2 DT H6 2 2 T H6 1 3
61 1 1 2 2 3 DT H2'' 2 3 T H2'1 1 3
61 1 2 2 2 3 DT H6 2 3 T H6 1 3
62 1 1 2 2 4 DA H2'' 2 4 A H2'1 1 3
62 1 2 2 2 4 DA H8 2 4 A H8 1 3
63 1 1 2 2 5 DA H2'' 2 5 A H2'1 1 3
63 1 2 2 2 5 DA H8 2 5 A H8 1 3
64 1 1 2 2 6 DT H2'' 2 6 T H2'1 1 3
64 1 2 2 2 6 DT H6 2 6 T H6 1 3
65 1 1 2 2 7 DT H2'' 2 7 T H2'1 1 3
65 1 2 2 2 7 DT H6 2 7 T H6 1 3
66 1 1 2 2 8 DC H2'' 2 8 C H2'1 1 3
66 1 2 2 2 8 DC H6 2 8 C H6 1 3
67 1 1 2 2 9 DG H2'' 2 9 G H2'1 1 3
67 1 2 2 2 9 DG H8 2 9 G H8 1 3
68 1 1 2 2 10 DT H2'' 2 10 T H2'1 1 3
68 1 2 2 2 10 DT H6 2 10 T H6 1 3
69 1 1 2 2 11 DG H2'' 2 11 G H2'1 1 3
69 1 2 2 2 11 DG H8 2 11 G H8 1 3
70 1 1 2 2 12 DC H2'' 2 12 C H2'1 1 3
70 1 2 2 2 12 DC H6 2 12 C H6 1 3
71 1 1 1 1 1 DG H2'' 1 1 G H2'1 1 3
71 1 2 1 1 2 DC H6 1 2 C H6 1 3
72 1 1 1 1 2 DC H2'' 1 2 C H2'1 1 3
72 1 2 1 1 3 DA H8 1 3 A H8 1 3
73 1 1 1 1 3 DA H2'' 1 3 A H2'1 1 3
73 1 2 1 1 4 DC H6 1 4 C H6 1 3
74 1 1 1 1 4 DC H2'' 1 4 C H2'1 1 3
74 1 2 1 1 5 DG H8 1 5 G H8 1 3
75 1 1 1 1 5 DG H2'' 1 5 G H2'1 1 3
75 1 2 1 1 6 DA H8 1 6 A H8 1 3
76 1 1 1 1 6 DA H2'' 1 6 A H2'1 1 3
76 1 2 1 1 7 DA H8 1 7 A H8 1 3
77 1 1 1 1 7 DA H2'' 1 7 A H2'1 1 3
77 1 2 1 1 8 DT H6 1 8 T H6 1 3
78 1 1 1 1 8 DT H2'' 1 8 T H2'1 1 3
78 1 2 1 1 9 DT H6 1 9 T H6 1 3
79 1 1 1 1 9 DT H2'' 1 9 T H2'1 1 3
79 1 2 1 1 10 DA H8 1 10 A H8 1 3
80 1 1 1 1 10 DA H2'' 1 10 A H2'1 1 3
80 1 2 1 1 11 DA H8 1 11 A H8 1 3
81 1 1 1 1 11 DA H2'' 1 11 A H2'1 1 3
81 1 2 1 1 12 DG H8 1 12 G H8 1 3
82 1 1 2 2 1 DC H2'' 2 1 C H2'1 1 3
82 1 2 2 2 2 DT H6 2 2 T H6 1 3
83 1 1 2 2 2 DT H2'' 2 2 T H2'1 1 3
83 1 2 2 2 3 DT H6 2 3 T H6 1 3
84 1 1 2 2 3 DT H2'' 2 3 T H2'1 1 3
84 1 2 2 2 4 DA H8 2 4 A H8 1 3
85 1 1 2 2 4 DA H2'' 2 4 A H2'1 1 3
85 1 2 2 2 5 DA H8 2 5 A H8 1 3
86 1 1 2 2 5 DA H2'' 2 5 A H2'1 1 3
86 1 2 2 2 6 DT H6 2 6 T H6 1 3
87 1 1 2 2 6 DT H2'' 2 6 T H2'1 1 3
87 1 2 2 2 7 DT H6 2 7 T H6 1 3
88 1 1 2 2 7 DT H2'' 2 7 T H2'1 1 3
88 1 2 2 2 8 DC H6 2 8 C H6 1 3
89 1 1 2 2 8 DC H2'' 2 8 C H2'1 1 3
89 1 2 2 2 9 DG H8 2 9 G H8 1 3
90 1 1 2 2 9 DG H2'' 2 9 G H2'1 1 3
90 1 2 2 2 10 DT H6 2 10 T H6 1 3
91 1 1 2 2 10 DT H2'' 2 10 T H2'1 1 3
91 1 2 2 2 11 DG H8 2 11 G H8 1 3
92 1 1 2 2 11 DG H2'' 2 11 G H2'1 1 3
92 1 2 2 2 12 DC H6 2 12 C H6 1 3
93 1 1 1 1 8 DT H6 1 8 T H6 1 3
93 1 2 1 1 9 DT H2' 1 9 T H2'2 1 3
94 1 1 1 1 1 DG H3' 1 1 G H3' 1 3
94 1 2 1 1 1 DG H8 1 1 G H8 1 3
95 1 1 1 1 2 DC H3' 1 2 C H3' 1 3
95 1 2 1 1 2 DC H6 1 2 C H6 1 3
96 1 1 1 1 3 DA H3' 1 3 A H3' 1 3
96 1 2 1 1 3 DA H8 1 3 A H8 1 3
97 1 1 1 1 4 DC H3' 1 4 C H3' 1 3
97 1 2 1 1 4 DC H6 1 4 C H6 1 3
98 1 1 1 1 5 DG H3' 1 5 G H3' 1 3
98 1 2 1 1 5 DG H8 1 5 G H8 1 3
99 1 1 1 1 6 DA H3' 1 6 A H3' 1 3
99 1 2 1 1 6 DA H8 1 6 A H8 1 3
100 1 1 1 1 7 DA H3' 1 7 A H3' 1 3
100 1 2 1 1 7 DA H8 1 7 A H8 1 3
101 1 1 1 1 8 DT H3' 1 8 T H3' 1 3
101 1 2 1 1 8 DT H6 1 8 T H6 1 3
102 1 1 1 1 9 DT H3' 1 9 T H3' 1 3
102 1 2 1 1 9 DT H6 1 9 T H6 1 3
103 1 1 1 1 10 DA H3' 1 10 A H3' 1 3
103 1 2 1 1 10 DA H8 1 10 A H8 1 3
104 1 1 1 1 11 DA H3' 1 11 A H3' 1 3
104 1 2 1 1 11 DA H8 1 11 A H8 1 3
105 1 1 1 1 12 DG H3' 1 12 G H3' 1 3
105 1 2 1 1 12 DG H8 1 12 G H8 1 3
106 1 1 2 2 1 DC H3' 2 1 C H3' 1 3
106 1 2 2 2 1 DC H6 2 1 C H6 1 3
107 1 1 2 2 2 DT H3' 2 2 T H3' 1 3
107 1 2 2 2 2 DT H6 2 2 T H6 1 3
108 1 1 2 2 3 DT H3' 2 3 T H3' 1 3
108 1 2 2 2 3 DT H6 2 3 T H6 1 3
109 1 1 2 2 4 DA H3' 2 4 A H3' 1 3
109 1 2 2 2 4 DA H8 2 4 A H8 1 3
110 1 1 2 2 5 DA H3' 2 5 A H3' 1 3
110 1 2 2 2 5 DA H8 2 5 A H8 1 3
111 1 1 2 2 6 DT H3' 2 6 T H3' 1 3
111 1 2 2 2 6 DT H6 2 6 T H6 1 3
112 1 1 2 2 7 DT H3' 2 7 T H3' 1 3
112 1 2 2 2 7 DT H6 2 7 T H6 1 3
113 1 1 2 2 8 DC H3' 2 8 C H3' 1 3
113 1 2 2 2 8 DC H6 2 8 C H6 1 3
114 1 1 2 2 9 DG H3' 2 9 G H3' 1 3
114 1 2 2 2 9 DG H8 2 9 G H8 1 3
115 1 1 2 2 10 DT H3' 2 10 T H3' 1 3
115 1 2 2 2 10 DT H6 2 10 T H6 1 3
116 1 1 2 2 11 DG H3' 2 11 G H3' 1 3
116 1 2 2 2 11 DG H8 2 11 G H8 1 3
117 1 1 2 2 12 DC H3' 2 12 C H3' 1 3
117 1 2 2 2 12 DC H6 2 12 C H6 1 3
118 1 1 1 1 1 DG H3' 1 1 G H3' 1 3
118 1 2 1 1 2 DC H6 1 2 C H6 1 3
119 1 1 1 1 2 DC H3' 1 2 C H3' 1 3
119 1 2 1 1 3 DA H8 1 3 A H8 1 3
120 1 1 1 1 3 DA H3' 1 3 A H3' 1 3
120 1 2 1 1 4 DC H6 1 4 C H6 1 3
121 1 1 1 1 4 DC H3' 1 4 C H3' 1 3
121 1 2 1 1 5 DG H8 1 5 G H8 1 3
122 1 1 1 1 5 DG H3' 1 5 G H3' 1 3
122 1 2 1 1 6 DA H8 1 6 A H8 1 3
123 1 1 1 1 6 DA H3' 1 6 A H3' 1 3
123 1 2 1 1 7 DA H8 1 7 A H8 1 3
124 1 1 1 1 7 DA H3' 1 7 A H3' 1 3
124 1 2 1 1 8 DT H6 1 8 T H6 1 3
125 1 1 1 1 8 DT H3' 1 8 T H3' 1 3
125 1 2 1 1 9 DT H6 1 9 T H6 1 3
126 1 1 1 1 9 DT H3' 1 9 T H3' 1 3
126 1 2 1 1 10 DA H8 1 10 A H8 1 3
127 1 1 1 1 10 DA H3' 1 10 A H3' 1 3
127 1 2 1 1 11 DA H8 1 11 A H8 1 3
128 1 1 1 1 11 DA H3' 1 11 A H3' 1 3
128 1 2 1 1 12 DG H8 1 12 G H8 1 3
129 1 1 2 2 1 DC H3' 2 1 C H3' 1 3
129 1 2 2 2 2 DT H6 2 2 T H6 1 3
130 1 1 2 2 2 DT H3' 2 2 T H3' 1 3
130 1 2 2 2 3 DT H6 2 3 T H6 1 3
131 1 1 2 2 3 DT H3' 2 3 T H3' 1 3
131 1 2 2 2 4 DA H8 2 4 A H8 1 3
132 1 1 2 2 4 DA H3' 2 4 A H3' 1 3
132 1 2 2 2 5 DA H8 2 5 A H8 1 3
133 1 1 2 2 5 DA H3' 2 5 A H3' 1 3
133 1 2 2 2 6 DT H6 2 6 T H6 1 3
134 1 1 2 2 6 DT H3' 2 6 T H3' 1 3
134 1 2 2 2 7 DT H6 2 7 T H6 1 3
135 1 1 2 2 7 DT H3' 2 7 T H3' 1 3
135 1 2 2 2 8 DC H6 2 8 C H6 1 3
136 1 1 2 2 8 DC H3' 2 8 C H3' 1 3
136 1 2 2 2 9 DG H8 2 9 G H8 1 3
137 1 1 2 2 9 DG H3' 2 9 G H3' 1 3
137 1 2 2 2 10 DT H6 2 10 T H6 1 3
138 1 1 2 2 10 DT H3' 2 10 T H3' 1 3
138 1 2 2 2 11 DG H8 2 11 G H8 1 3
139 1 1 2 2 11 DG H3' 2 11 G H3' 1 3
139 1 2 2 2 12 DC H6 2 12 C H6 1 3
140 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
140 1 2 1 1 1 DG H3' 1 1 G H3' 1 3
141 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
141 1 2 1 1 2 DC H3' 1 2 C H3' 1 3
142 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
142 1 2 1 1 3 DA H3' 1 3 A H3' 1 3
143 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
143 1 2 1 1 4 DC H3' 1 4 C H3' 1 3
144 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
144 1 2 1 1 5 DG H3' 1 5 G H3' 1 3
145 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
145 1 2 1 1 6 DA H3' 1 6 A H3' 1 3
146 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
146 1 2 1 1 7 DA H3' 1 7 A H3' 1 3
147 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
147 1 2 1 1 8 DT H3' 1 8 T H3' 1 3
148 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
148 1 2 1 1 9 DT H3' 1 9 T H3' 1 3
149 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
149 1 2 1 1 10 DA H3' 1 10 A H3' 1 3
150 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
150 1 2 1 1 11 DA H3' 1 11 A H3' 1 3
151 1 1 1 1 12 DG H1' 1 12 G H1' 1 3
151 1 2 1 1 12 DG H3' 1 12 G H3' 1 3
152 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
152 1 2 2 2 1 DC H3' 2 1 C H3' 1 3
153 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
153 1 2 2 2 2 DT H3' 2 2 T H3' 1 3
154 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
154 1 2 2 2 3 DT H3' 2 3 T H3' 1 3
155 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
155 1 2 2 2 4 DA H3' 2 4 A H3' 1 3
156 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
156 1 2 2 2 5 DA H3' 2 5 A H3' 1 3
157 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
157 1 2 2 2 6 DT H3' 2 6 T H3' 1 3
158 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
158 1 2 2 2 7 DT H3' 2 7 T H3' 1 3
159 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
159 1 2 2 2 8 DC H3' 2 8 C H3' 1 3
160 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
160 1 2 2 2 9 DG H3' 2 9 G H3' 1 3
161 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
161 1 2 2 2 10 DT H3' 2 10 T H3' 1 3
162 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
162 1 2 2 2 11 DG H3' 2 11 G H3' 1 3
163 1 1 2 2 12 DC H1' 2 12 C H1' 1 3
163 1 2 2 2 12 DC H3' 2 12 C H3' 1 3
164 1 1 1 1 1 DG H2'' 1 1 G H2'1 1 3
164 1 2 1 1 1 DG H3' 1 1 G H3' 1 3
165 1 1 1 1 2 DC H2'' 1 2 C H2'1 1 3
165 1 2 1 1 2 DC H3' 1 2 C H3' 1 3
166 1 1 1 1 3 DA H2'' 1 3 A H2'1 1 3
166 1 2 1 1 3 DA H3' 1 3 A H3' 1 3
167 1 1 1 1 4 DC H2'' 1 4 C H2'1 1 3
167 1 2 1 1 4 DC H3' 1 4 C H3' 1 3
168 1 1 1 1 5 DG H2'' 1 5 G H2'1 1 3
168 1 2 1 1 5 DG H3' 1 5 G H3' 1 3
169 1 1 1 1 6 DA H2'' 1 6 A H2'1 1 3
169 1 2 1 1 6 DA H3' 1 6 A H3' 1 3
170 1 1 1 1 7 DA H2'' 1 7 A H2'1 1 3
170 1 2 1 1 7 DA H3' 1 7 A H3' 1 3
171 1 1 1 1 8 DT H2'' 1 8 T H2'1 1 3
171 1 2 1 1 8 DT H3' 1 8 T H3' 1 3
172 1 1 1 1 9 DT H2'' 1 9 T H2'1 1 3
172 1 2 1 1 9 DT H3' 1 9 T H3' 1 3
173 1 1 1 1 10 DA H2'' 1 10 A H2'1 1 3
173 1 2 1 1 10 DA H3' 1 10 A H3' 1 3
174 1 1 1 1 11 DA H2'' 1 11 A H2'1 1 3
174 1 2 1 1 11 DA H3' 1 11 A H3' 1 3
175 1 1 1 1 12 DG H2'' 1 12 G H2'1 1 3
175 1 2 1 1 12 DG H3' 1 12 G H3' 1 3
176 1 1 2 2 1 DC H2'' 2 1 C H2'1 1 3
176 1 2 2 2 1 DC H3' 2 1 C H3' 1 3
177 1 1 2 2 2 DT H2'' 2 2 T H2'1 1 3
177 1 2 2 2 2 DT H3' 2 2 T H3' 1 3
178 1 1 2 2 3 DT H2'' 2 3 T H2'1 1 3
178 1 2 2 2 3 DT H3' 2 3 T H3' 1 3
179 1 1 2 2 4 DA H2'' 2 4 A H2'1 1 3
179 1 2 2 2 4 DA H3' 2 4 A H3' 1 3
180 1 1 2 2 5 DA H2'' 2 5 A H2'1 1 3
180 1 2 2 2 5 DA H3' 2 5 A H3' 1 3
181 1 1 2 2 6 DT H2'' 2 6 T H2'1 1 3
181 1 2 2 2 6 DT H3' 2 6 T H3' 1 3
182 1 1 2 2 7 DT H2'' 2 7 T H2'1 1 3
182 1 2 2 2 7 DT H3' 2 7 T H3' 1 3
183 1 1 2 2 8 DC H2'' 2 8 C H2'1 1 3
183 1 2 2 2 8 DC H3' 2 8 C H3' 1 3
184 1 1 2 2 9 DG H2'' 2 9 G H2'1 1 3
184 1 2 2 2 9 DG H3' 2 9 G H3' 1 3
185 1 1 2 2 10 DT H2'' 2 10 T H2'1 1 3
185 1 2 2 2 10 DT H3' 2 10 T H3' 1 3
186 1 1 2 2 11 DG H2'' 2 11 G H2'1 1 3
186 1 2 2 2 11 DG H3' 2 11 G H3' 1 3
187 1 1 2 2 12 DC H2'' 2 12 C H2'1 1 3
187 1 2 2 2 12 DC H3' 2 12 C H3' 1 3
188 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
188 1 2 1 1 1 DG H4' 1 1 G H4' 1 3
189 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
189 1 2 1 1 2 DC H4' 1 2 C H4' 1 3
190 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
190 1 2 1 1 3 DA H4' 1 3 A H4' 1 3
191 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
191 1 2 1 1 4 DC H4' 1 4 C H4' 1 3
192 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
192 1 2 1 1 5 DG H4' 1 5 G H4' 1 3
193 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
193 1 2 1 1 6 DA H4' 1 6 A H4' 1 3
194 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
194 1 2 1 1 7 DA H4' 1 7 A H4' 1 3
195 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
195 1 2 1 1 8 DT H4' 1 8 T H4' 1 3
196 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
196 1 2 1 1 9 DT H4' 1 9 T H4' 1 3
197 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
197 1 2 1 1 10 DA H4' 1 10 A H4' 1 3
198 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
198 1 2 1 1 11 DA H4' 1 11 A H4' 1 3
199 1 1 1 1 12 DG H1' 1 12 G H1' 1 3
199 1 2 1 1 12 DG H4' 1 12 G H4' 1 3
200 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
200 1 2 2 2 1 DC H4' 2 1 C H4' 1 3
201 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
201 1 2 2 2 2 DT H4' 2 2 T H4' 1 3
202 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
202 1 2 2 2 3 DT H4' 2 3 T H4' 1 3
203 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
203 1 2 2 2 4 DA H4' 2 4 A H4' 1 3
204 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
204 1 2 2 2 5 DA H4' 2 5 A H4' 1 3
205 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
205 1 2 2 2 6 DT H4' 2 6 T H4' 1 3
206 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
206 1 2 2 2 7 DT H4' 2 7 T H4' 1 3
207 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
207 1 2 2 2 8 DC H4' 2 8 C H4' 1 3
208 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
208 1 2 2 2 9 DG H4' 2 9 G H4' 1 3
209 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
209 1 2 2 2 10 DT H4' 2 10 T H4' 1 3
210 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
210 1 2 2 2 11 DG H4' 2 11 G H4' 1 3
211 1 1 2 2 12 DC H1' 2 12 C H1' 1 3
211 1 2 2 2 12 DC H4' 2 12 C H4' 1 3
212 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
212 1 2 1 1 9 DT H4' 1 9 T H4' 1 3
213 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
213 1 2 1 1 5 DG H4' 1 5 G H4' 1 3
214 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
214 1 2 1 1 1 DG H5'' 1 1 G H5'2 1 3
215 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
215 1 2 1 1 2 DC H5'' 1 2 C H5'2 1 3
216 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
216 1 2 1 1 3 DA H5'' 1 3 A H5'2 1 3
217 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
217 1 2 1 1 4 DC H5'' 1 4 C H5'2 1 3
218 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
218 1 2 1 1 5 DG H5'' 1 5 G H5'2 1 3
219 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
219 1 2 1 1 6 DA H5'' 1 6 A H5'2 1 3
220 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
220 1 2 1 1 7 DA H5'' 1 7 A H5'2 1 3
221 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
221 1 2 1 1 8 DT H5'' 1 8 T H5'2 1 3
222 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
222 1 2 1 1 9 DT H5'' 1 9 T H5'2 1 3
223 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
223 1 2 1 1 10 DA H5'' 1 10 A H5'2 1 3
224 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
224 1 2 1 1 11 DA H5'' 1 11 A H5'2 1 3
225 1 1 1 1 12 DG H1' 1 12 G H1' 1 3
225 1 2 1 1 12 DG H5'' 1 12 G H5'2 1 3
226 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
226 1 2 2 2 1 DC H5'' 2 1 C H5'2 1 3
227 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
227 1 2 2 2 2 DT H5'' 2 2 T H5'2 1 3
228 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
228 1 2 2 2 3 DT H5'' 2 3 T H5'2 1 3
229 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
229 1 2 2 2 4 DA H5'' 2 4 A H5'2 1 3
230 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
230 1 2 2 2 5 DA H5'' 2 5 A H5'2 1 3
231 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
231 1 2 2 2 6 DT H5'' 2 6 T H5'2 1 3
232 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
232 1 2 2 2 7 DT H5'' 2 7 T H5'2 1 3
233 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
233 1 2 2 2 8 DC H5'' 2 8 C H5'2 1 3
234 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
234 1 2 2 2 9 DG H5'' 2 9 G H5'2 1 3
235 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
235 1 2 2 2 10 DT H5'' 2 10 T H5'2 1 3
236 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
236 1 2 2 2 11 DG H5'' 2 11 G H5'2 1 3
237 1 1 2 2 12 DC H1' 2 12 C H1' 1 3
237 1 2 2 2 12 DC H5'' 2 12 C H5'2 1 3
238 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
238 1 2 1 1 1 DG H5' 1 1 G H5'1 1 3
239 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
239 1 2 1 1 2 DC H5' 1 2 C H5'1 1 3
240 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
240 1 2 1 1 3 DA H5' 1 3 A H5'1 1 3
241 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
241 1 2 1 1 4 DC H5' 1 4 C H5'1 1 3
242 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
242 1 2 1 1 5 DG H5' 1 5 G H5'1 1 3
243 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
243 1 2 1 1 6 DA H5' 1 6 A H5'1 1 3
244 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
244 1 2 1 1 7 DA H5' 1 7 A H5'1 1 3
245 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
245 1 2 1 1 8 DT H5' 1 8 T H5'1 1 3
246 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
246 1 2 1 1 9 DT H5' 1 9 T H5'1 1 3
247 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
247 1 2 1 1 10 DA H5' 1 10 A H5'1 1 3
248 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
248 1 2 1 1 11 DA H5' 1 11 A H5'1 1 3
249 1 1 1 1 12 DG H1' 1 12 G H1' 1 3
249 1 2 1 1 12 DG H5' 1 12 G H5'1 1 3
250 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
250 1 2 2 2 1 DC H5' 2 1 C H5'1 1 3
251 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
251 1 2 2 2 2 DT H5' 2 2 T H5'1 1 3
252 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
252 1 2 2 2 3 DT H5' 2 3 T H5'1 1 3
253 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
253 1 2 2 2 4 DA H5' 2 4 A H5'1 1 3
254 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
254 1 2 2 2 5 DA H5' 2 5 A H5'1 1 3
255 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
255 1 2 2 2 6 DT H5' 2 6 T H5'1 1 3
256 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
256 1 2 2 2 7 DT H5' 2 7 T H5'1 1 3
257 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
257 1 2 2 2 8 DC H5' 2 8 C H5'1 1 3
258 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
258 1 2 2 2 9 DG H5' 2 9 G H5'1 1 3
259 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
259 1 2 2 2 10 DT H5' 2 10 T H5'1 1 3
260 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
260 1 2 2 2 11 DG H5' 2 11 G H5'1 1 3
261 1 1 2 2 12 DC H1' 2 12 C H1' 1 3
261 1 2 2 2 12 DC H5' 2 12 C H5'1 1 3
262 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
262 1 2 1 1 2 DC H5'' 1 2 C H5'2 1 3
263 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
263 1 2 1 1 3 DA H5'' 1 3 A H5'2 1 3
264 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
264 1 2 1 1 4 DC H5'' 1 4 C H5'2 1 3
265 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
265 1 2 1 1 5 DG H5'' 1 5 G H5'2 1 3
266 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
266 1 2 1 1 6 DA H5'' 1 6 A H5'2 1 3
267 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
267 1 2 1 1 7 DA H5'' 1 7 A H5'2 1 3
268 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
268 1 2 1 1 8 DT H5'' 1 8 T H5'2 1 3
269 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
269 1 2 1 1 9 DT H5'' 1 9 T H5'2 1 3
270 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
270 1 2 1 1 10 DA H5'' 1 10 A H5'2 1 3
271 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
271 1 2 1 1 11 DA H5'' 1 11 A H5'2 1 3
272 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
272 1 2 1 1 12 DG H5'' 1 12 G H5'2 1 3
273 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
273 1 2 2 2 2 DT H5'' 2 2 T H5'2 1 3
274 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
274 1 2 2 2 3 DT H5'' 2 3 T H5'2 1 3
275 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
275 1 2 2 2 4 DA H5'' 2 4 A H5'2 1 3
276 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
276 1 2 2 2 5 DA H5'' 2 5 A H5'2 1 3
277 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
277 1 2 2 2 6 DT H5'' 2 6 T H5'2 1 3
278 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
278 1 2 2 2 7 DT H5'' 2 7 T H5'2 1 3
279 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
279 1 2 2 2 8 DC H5'' 2 8 C H5'2 1 3
280 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
280 1 2 2 2 9 DG H5'' 2 9 G H5'2 1 3
281 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
281 1 2 2 2 10 DT H5'' 2 10 T H5'2 1 3
282 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
282 1 2 2 2 11 DG H5'' 2 11 G H5'2 1 3
283 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
283 1 2 2 2 12 DC H5'' 2 12 C H5'2 1 3
284 1 1 1 1 1 DG H1' 1 1 G H1' 1 3
284 1 2 1 1 2 DC H5' 1 2 C H5'1 1 3
285 1 1 1 1 2 DC H1' 1 2 C H1' 1 3
285 1 2 1 1 3 DA H5' 1 3 A H5'1 1 3
286 1 1 1 1 3 DA H1' 1 3 A H1' 1 3
286 1 2 1 1 4 DC H5' 1 4 C H5'1 1 3
287 1 1 1 1 4 DC H1' 1 4 C H1' 1 3
287 1 2 1 1 5 DG H5' 1 5 G H5'1 1 3
288 1 1 1 1 5 DG H1' 1 5 G H1' 1 3
288 1 2 1 1 6 DA H5' 1 6 A H5'1 1 3
289 1 1 1 1 6 DA H1' 1 6 A H1' 1 3
289 1 2 1 1 7 DA H5' 1 7 A H5'1 1 3
290 1 1 1 1 7 DA H1' 1 7 A H1' 1 3
290 1 2 1 1 8 DT H5' 1 8 T H5'1 1 3
291 1 1 1 1 8 DT H1' 1 8 T H1' 1 3
291 1 2 1 1 9 DT H5' 1 9 T H5'1 1 3
292 1 1 1 1 9 DT H1' 1 9 T H1' 1 3
292 1 2 1 1 10 DA H5' 1 10 A H5'1 1 3
293 1 1 1 1 10 DA H1' 1 10 A H1' 1 3
293 1 2 1 1 11 DA H5' 1 11 A H5'1 1 3
294 1 1 1 1 11 DA H1' 1 11 A H1' 1 3
294 1 2 1 1 12 DG H5' 1 12 G H5'1 1 3
295 1 1 2 2 1 DC H1' 2 1 C H1' 1 3
295 1 2 2 2 2 DT H5' 2 2 T H5'1 1 3
296 1 1 2 2 2 DT H1' 2 2 T H1' 1 3
296 1 2 2 2 3 DT H5' 2 3 T H5'1 1 3
297 1 1 2 2 3 DT H1' 2 3 T H1' 1 3
297 1 2 2 2 4 DA H5' 2 4 A H5'1 1 3
298 1 1 2 2 4 DA H1' 2 4 A H1' 1 3
298 1 2 2 2 5 DA H5' 2 5 A H5'1 1 3
299 1 1 2 2 5 DA H1' 2 5 A H1' 1 3
299 1 2 2 2 6 DT H5' 2 6 T H5'1 1 3
300 1 1 2 2 6 DT H1' 2 6 T H1' 1 3
300 1 2 2 2 7 DT H5' 2 7 T H5'1 1 3
301 1 1 2 2 7 DT H1' 2 7 T H1' 1 3
301 1 2 2 2 8 DC H5' 2 8 C H5'1 1 3
302 1 1 2 2 8 DC H1' 2 8 C H1' 1 3
302 1 2 2 2 9 DG H5' 2 9 G H5'1 1 3
303 1 1 2 2 9 DG H1' 2 9 G H1' 1 3
303 1 2 2 2 10 DT H5' 2 10 T H5'1 1 3
304 1 1 2 2 10 DT H1' 2 10 T H1' 1 3
304 1 2 2 2 11 DG H5' 2 11 G H5'1 1 3
305 1 1 2 2 11 DG H1' 2 11 G H1' 1 3
305 1 2 2 2 12 DC H5' 2 12 C H5'1 1 3
306 1 1 1 1 6 DA H2 1 6 A H2 1 3
306 1 2 1 1 7 DA H2 1 7 A H2 1 3
307 1 1 1 1 10 DA H2 1 10 A H2 1 3
307 1 2 1 1 11 DA H2 1 11 A H2 1 3
308 1 1 2 2 4 DA H2 2 4 A H2 1 3
308 1 2 2 2 5 DA H2 2 5 A H2 1 3
309 1 1 1 1 10 DA H2 1 10 A H2 1 3
309 1 2 2 2 4 DA H2 2 4 A H2 1 3
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 . . . . . 0.0 2.45 2.75 1 3
2 1 . . . . . 0.0 2.25 2.45 1 3
3 1 . . . . . 0.0 2.55 2.75 1 3
4 1 . . . . . 0.0 2.45 2.75 1 3
5 1 . . . . . 0.0 2.25 2.55 1 3
6 1 . . . . . 0.0 2.65 2.85 1 3
7 1 . . . . . 0.0 2.65 2.85 1 3
8 1 . . . . . 0.0 2.35 2.65 1 3
9 1 . . . . . 0.0 2.0 2.2 1 3
10 1 . . . . . 0.0 2.55 2.85 1 3
11 1 . . . . . 0.0 2.65 2.85 1 3
12 1 . . . . . 0.0 2.25 2.45 1 3
13 1 . . . . . 0.0 2.65 2.85 1 3
14 1 . . . . . 0.0 2.45 2.75 1 3
15 1 . . . . . 0.0 2.45 2.75 1 3
16 1 . . . . . 0.0 2.65 2.85 1 3
17 1 . . . . . 0.0 2.45 2.65 1 3
18 1 . . . . . 0.0 2.65 2.95 1 3
19 1 . . . . . 0.0 2.55 2.85 1 3
20 1 . . . . . 0.0 2.55 2.85 1 3
21 1 . . . . . 0.0 2.65 2.85 1 3
22 1 . . . . . 0.0 2.35 2.65 1 3
23 1 . . . . . 0.0 2.65 2.85 1 3
24 1 . . . . . 0.0 2.55 2.85 1 3
25 1 . . . . . 0.0 4.15 4.45 1 3
26 1 . . . . . 0.0 4.25 4.45 1 3
27 1 . . . . . 0.0 4.05 4.45 1 3
28 1 . . . . . 0.0 3.85 4.25 1 3
29 1 . . . . . 0.0 3.85 4.25 1 3
30 1 . . . . . 0.0 4.15 4.35 1 3
31 1 . . . . . 0.0 4.05 4.45 1 3
32 1 . . . . . 0.0 3.35 3.55 1 3
33 1 . . . . . 0.0 4.75 4.95 1 3
34 1 . . . . . 0.0 3.95 4.25 1 3
35 1 . . . . . 0.0 3.85 4.05 1 3
36 1 . . . . . 0.0 3.85 4.05 1 3
37 1 . . . . . 0.0 4.05 4.45 1 3
38 1 . . . . . 0.0 3.85 4.25 1 3
39 1 . . . . . 0.0 3.95 4.15 1 3
40 1 . . . . . 0.0 4.05 4.45 1 3
41 1 . . . . . 0.0 3.85 4.05 1 3
42 1 . . . . . 0.0 3.45 3.75 1 3
43 1 . . . . . 0.0 3.85 4.25 1 3
44 1 . . . . . 0.0 4.05 4.45 1 3
45 1 . . . . . 0.0 3.95 4.15 1 3
46 1 . . . . . 0.0 3.85 4.05 1 3
47 1 . . . . . 0.0 3.8 4.2 1 3
48 1 . . . . . 0.0 3.4 3.6 1 3
49 1 . . . . . 0.0 3.9 4.2 1 3
50 1 . . . . . 0.0 3.6 4.0 1 3
51 1 . . . . . 0.0 3.4 3.6 1 3
52 1 . . . . . 0.0 3.9 4.2 1 3
53 1 . . . . . 0.0 3.9 4.2 1 3
54 1 . . . . . 0.0 3.2 3.5 1 3
55 1 . . . . . 0.0 2.6 2.8 1 3
56 1 . . . . . 0.0 3.8 4.2 1 3
57 1 . . . . . 0.0 3.8 4.2 1 3
58 1 . . . . . 0.0 3.6 3.8 1 3
59 1 . . . . . 0.0 3.6 3.8 1 3
60 1 . . . . . 0.0 3.4 3.6 1 3
61 1 . . . . . 0.0 2.8 3.0 1 3
62 1 . . . . . 0.0 3.9 4.1 1 3
63 1 . . . . . 0.0 3.8 4.2 1 3
64 1 . . . . . 0.0 3.4 3.6 1 3
65 1 . . . . . 0.0 3.2 3.4 1 3
66 1 . . . . . 0.0 3.4 3.6 1 3
67 1 . . . . . 0.0 3.8 4.2 1 3
68 1 . . . . . 0.0 3.5 3.8 1 3
69 1 . . . . . 0.0 3.4 3.6 1 3
70 1 . . . . . 0.0 3.6 3.8 1 3
71 1 . . . . . 0.0 2.7 3.0 1 3
72 1 . . . . . 0.0 3.0 3.2 1 3
73 1 . . . . . 0.0 2.6 3.0 1 3
74 1 . . . . . 0.0 3.0 3.2 1 3
75 1 . . . . . 0.0 3.0 3.2 1 3
76 1 . . . . . 0.0 2.8 3.0 1 3
77 1 . . . . . 0.0 2.15 2.55 1 3
78 1 . . . . . 0.0 2.45 2.75 1 3
79 1 . . . . . 0.0 3.0 3.2 1 3
80 1 . . . . . 0.0 2.5 2.9 1 3
81 1 . . . . . 0.0 2.5 2.7 1 3
82 1 . . . . . 0.0 2.6 3.0 1 3
83 1 . . . . . 0.0 2.6 2.8 1 3
84 1 . . . . . 0.0 2.6 2.9 1 3
85 1 . . . . . 0.0 2.8 3.0 1 3
86 1 . . . . . 0.0 2.5 2.8 1 3
87 1 . . . . . 0.0 2.8 3.0 1 3
88 1 . . . . . 0.0 2.8 3.0 1 3
89 1 . . . . . 0.0 2.8 3.0 1 3
90 1 . . . . . 0.0 2.8 3.0 1 3
91 1 . . . . . 0.0 3.0 3.2 1 3
92 1 . . . . . 0.0 3.0 3.2 1 3
93 1 . . . . . 0.0 3.8 4.0 1 3
94 1 . . . . . 0.0 4.95 5.35 1 3
95 1 . . . . . 0.0 3.85 4.25 1 3
96 1 . . . . . 0.0 4.95 5.35 1 3
97 1 . . . . . 0.0 3.85 4.25 1 3
98 1 . . . . . 0.0 4.95 5.35 1 3
99 1 . . . . . 0.0 4.95 5.35 1 3
100 1 . . . . . 0.0 4.95 5.35 1 3
101 1 . . . . . 0.0 3.65 4.75 1 3
102 1 . . . . . 0.0 3.65 4.75 1 3
103 1 . . . . . 0.0 4.95 5.35 1 3
104 1 . . . . . 0.0 4.95 5.35 1 3
105 1 . . . . . 0.0 4.15 4.45 1 3
106 1 . . . . . 0.0 3.85 4.25 1 3
107 1 . . . . . 0.0 3.85 4.25 1 3
108 1 . . . . . 0.0 3.85 4.25 1 3
109 1 . . . . . 0.0 4.95 5.35 1 3
110 1 . . . . . 0.0 4.95 5.35 1 3
111 1 . . . . . 0.0 3.85 4.25 1 3
112 1 . . . . . 0.0 3.65 3.95 1 3
113 1 . . . . . 0.0 3.85 4.25 1 3
114 1 . . . . . 0.0 4.95 5.35 1 3
115 1 . . . . . 0.0 3.85 4.25 1 3
116 1 . . . . . 0.0 4.95 5.35 1 3
117 1 . . . . . 0.0 3.85 4.25 1 3
118 1 . . . . . 0.0 4.95 6.05 1 3
119 1 . . . . . 0.0 4.95 6.05 1 3
120 1 . . . . . 0.0 4.95 6.05 1 3
121 1 . . . . . 0.0 4.95 6.05 1 3
122 1 . . . . . 0.0 4.95 6.05 1 3
123 1 . . . . . 0.0 4.95 6.05 1 3
124 1 . . . . . 0.0 4.95 6.05 1 3
125 1 . . . . . 0.0 4.95 6.05 1 3
126 1 . . . . . 0.0 4.95 6.05 1 3
127 1 . . . . . 0.0 4.95 6.05 1 3
128 1 . . . . . 0.0 4.95 6.05 1 3
129 1 . . . . . 0.0 4.05 6.05 1 3
130 1 . . . . . 0.0 4.95 6.05 1 3
131 1 . . . . . 0.0 4.95 6.05 1 3
132 1 . . . . . 0.0 4.95 6.05 1 3
133 1 . . . . . 0.0 4.95 6.05 1 3
134 1 . . . . . 0.0 4.95 6.05 1 3
135 1 . . . . . 0.0 4.95 6.05 1 3
136 1 . . . . . 0.0 4.95 6.05 1 3
137 1 . . . . . 0.0 4.95 6.05 1 3
138 1 . . . . . 0.0 4.95 6.05 1 3
139 1 . . . . . 0.0 4.95 6.05 1 3
140 1 . . . . . 0.0 3.8 4.2 1 3
141 1 . . . . . 0.0 3.8 4.2 1 3
142 1 . . . . . 0.0 3.8 4.0 1 3
143 1 . . . . . 0.0 3.8 4.2 1 3
144 1 . . . . . 0.0 3.8 4.2 1 3
145 1 . . . . . 0.0 3.8 4.2 1 3
146 1 . . . . . 0.0 3.5 3.8 1 3
147 1 . . . . . 0.0 3.6 4.0 1 3
148 1 . . . . . 0.0 3.6 4.0 1 3
149 1 . . . . . 0.0 3.8 4.2 1 3
150 1 . . . . . 0.0 3.8 4.2 1 3
151 1 . . . . . 0.0 3.8 4.2 1 3
152 1 . . . . . 0.0 3.8 4.2 1 3
153 1 . . . . . 0.0 3.8 4.2 1 3
154 1 . . . . . 0.0 3.8 4.2 1 3
155 1 . . . . . 0.0 3.8 4.2 1 3
156 1 . . . . . 0.0 3.8 4.2 1 3
157 1 . . . . . 0.0 3.8 4.2 1 3
158 1 . . . . . 0.0 3.8 4.2 1 3
159 1 . . . . . 0.0 3.8 4.2 1 3
160 1 . . . . . 0.0 3.8 4.2 1 3
161 1 . . . . . 0.0 3.8 4.2 1 3
162 1 . . . . . 0.0 3.8 4.2 1 3
163 1 . . . . . 0.0 3.8 4.0 1 3
164 1 . . . . . 0.0 2.5 3.0 1 3
165 1 . . . . . 0.0 2.5 3.0 1 3
166 1 . . . . . 0.0 2.5 3.0 1 3
167 1 . . . . . 0.0 2.5 3.0 1 3
168 1 . . . . . 0.0 2.5 3.0 1 3
169 1 . . . . . 0.0 2.5 3.0 1 3
170 1 . . . . . 0.0 2.5 3.0 1 3
171 1 . . . . . 0.0 2.5 3.0 1 3
172 1 . . . . . 0.0 2.5 3.0 1 3
173 1 . . . . . 0.0 2.5 3.0 1 3
174 1 . . . . . 0.0 2.5 3.0 1 3
175 1 . . . . . 0.0 2.5 3.0 1 3
176 1 . . . . . 0.0 2.5 3.0 1 3
177 1 . . . . . 0.0 2.5 3.0 1 3
178 1 . . . . . 0.0 2.5 3.0 1 3
179 1 . . . . . 0.0 2.5 3.0 1 3
180 1 . . . . . 0.0 2.5 3.0 1 3
181 1 . . . . . 0.0 2.5 3.0 1 3
182 1 . . . . . 0.0 2.5 3.0 1 3
183 1 . . . . . 0.0 2.5 3.0 1 3
184 1 . . . . . 0.0 2.5 3.0 1 3
185 1 . . . . . 0.0 2.5 3.0 1 3
186 1 . . . . . 0.0 2.5 3.0 1 3
187 1 . . . . . 0.0 2.5 3.0 1 3
188 1 . . . . . 0.0 3.2 3.6 1 3
189 1 . . . . . 0.0 2.6 2.8 1 3
190 1 . . . . . 0.0 3.2 3.5 1 3
191 1 . . . . . 0.0 2.6 2.8 1 3
192 1 . . . . . 0.0 3.5 3.8 1 3
193 1 . . . . . 0.0 2.4 2.6 1 3
194 1 . . . . . 0.0 3.3 3.5 1 3
195 1 . . . . . 0.0 2.9 3.2 1 3
196 1 . . . . . 0.0 2.7 3.0 1 3
197 1 . . . . . 0.0 3.4 3.8 1 3
198 1 . . . . . 0.0 3.2 3.5 1 3
199 1 . . . . . 0.0 2.4 2.6 1 3
200 1 . . . . . 0.0 2.5 2.7 1 3
201 1 . . . . . 0.0 2.8 3.0 1 3
202 1 . . . . . 0.0 3.2 3.5 1 3
203 1 . . . . . 0.0 3.4 3.7 1 3
204 1 . . . . . 0.0 3.4 3.7 1 3
205 1 . . . . . 0.0 2.5 2.8 1 3
206 1 . . . . . 0.0 2.8 3.0 1 3
207 1 . . . . . 0.0 2.8 3.0 1 3
208 1 . . . . . 0.0 3.2 3.6 1 3
209 1 . . . . . 0.0 2.8 3.0 1 3
210 1 . . . . . 0.0 3.2 3.5 1 3
211 1 . . . . . 0.0 2.6 2.8 1 3
212 1 . . . . . 0.0 3.0 3.4 1 3
213 1 . . . . . 0.0 5.0 6.0 1 3
214 1 . . . . . 0.0 5.05 6.0 1 3
215 1 . . . . . 0.0 5.05 6.0 1 3
216 1 . . . . . 0.0 5.05 6.0 1 3
217 1 . . . . . 0.0 5.05 6.0 1 3
218 1 . . . . . 0.0 5.05 6.0 1 3
219 1 . . . . . 0.0 5.05 6.0 1 3
220 1 . . . . . 0.0 5.0 6.0 1 3
221 1 . . . . . 0.0 4.25 4.45 1 3
222 1 . . . . . 0.0 4.25 4.55 1 3
223 1 . . . . . 0.0 5.05 6.0 1 3
224 1 . . . . . 0.0 5.05 6.0 1 3
225 1 . . . . . 0.0 5.05 6.0 1 3
226 1 . . . . . 0.0 5.05 6.0 1 3
227 1 . . . . . 0.0 5.05 6.0 1 3
228 1 . . . . . 0.0 5.05 6.0 1 3
229 1 . . . . . 0.0 5.05 6.0 1 3
230 1 . . . . . 0.0 5.05 6.0 1 3
231 1 . . . . . 0.0 5.05 6.0 1 3
232 1 . . . . . 0.0 5.05 6.0 1 3
233 1 . . . . . 0.0 5.05 6.0 1 3
234 1 . . . . . 0.0 5.05 6.0 1 3
235 1 . . . . . 0.0 5.05 6.0 1 3
236 1 . . . . . 0.0 5.05 6.0 1 3
237 1 . . . . . 0.0 5.05 6.0 1 3
238 1 . . . . . 0.0 4.55 5.0 1 3
239 1 . . . . . 0.0 4.55 5.0 1 3
240 1 . . . . . 0.0 4.55 5.0 1 3
241 1 . . . . . 0.0 4.55 5.0 1 3
242 1 . . . . . 0.0 4.55 5.0 1 3
243 1 . . . . . 0.0 4.55 5.0 1 3
244 1 . . . . . 0.0 4.55 5.0 1 3
245 1 . . . . . 0.0 4.55 5.0 1 3
246 1 . . . . . 0.0 4.05 4.25 1 3
247 1 . . . . . 0.0 4.55 5.0 1 3
248 1 . . . . . 0.0 4.55 5.0 1 3
249 1 . . . . . 0.0 4.55 5.0 1 3
250 1 . . . . . 0.0 4.55 5.0 1 3
251 1 . . . . . 0.0 4.55 5.0 1 3
252 1 . . . . . 0.0 4.55 5.0 1 3
253 1 . . . . . 0.0 4.55 5.0 1 3
254 1 . . . . . 0.0 4.55 5.0 1 3
255 1 . . . . . 0.0 4.55 5.0 1 3
256 1 . . . . . 0.0 4.55 5.0 1 3
257 1 . . . . . 0.0 4.55 5.0 1 3
258 1 . . . . . 0.0 4.55 5.0 1 3
259 1 . . . . . 0.0 4.55 5.0 1 3
260 1 . . . . . 0.0 4.55 5.0 1 3
261 1 . . . . . 0.0 4.55 5.0 1 3
262 1 . . . . . 0.0 4.05 5.0 1 3
263 1 . . . . . 0.0 4.05 5.0 1 3
264 1 . . . . . 0.0 4.05 5.0 1 3
265 1 . . . . . 0.0 4.05 5.0 1 3
266 1 . . . . . 0.0 4.05 5.0 1 3
267 1 . . . . . 0.0 4.05 5.0 1 3
268 1 . . . . . 0.0 5.0 6.0 1 3
269 1 . . . . . 0.0 4.05 4.55 1 3
270 1 . . . . . 0.0 4.05 5.0 1 3
271 1 . . . . . 0.0 4.05 5.0 1 3
272 1 . . . . . 0.0 4.05 5.0 1 3
273 1 . . . . . 0.0 4.05 5.0 1 3
274 1 . . . . . 0.0 4.05 5.0 1 3
275 1 . . . . . 0.0 4.05 5.0 1 3
276 1 . . . . . 0.0 4.05 5.0 1 3
277 1 . . . . . 0.0 4.05 5.0 1 3
278 1 . . . . . 0.0 4.05 5.0 1 3
279 1 . . . . . 0.0 4.05 5.0 1 3
280 1 . . . . . 0.0 4.05 5.0 1 3
281 1 . . . . . 0.0 4.05 5.0 1 3
282 1 . . . . . 0.0 4.05 5.0 1 3
283 1 . . . . . 0.0 4.05 5.0 1 3
284 1 . . . . . 0.0 2.5 3.0 1 3
285 1 . . . . . 0.0 2.5 3.0 1 3
286 1 . . . . . 0.0 2.5 3.0 1 3
287 1 . . . . . 0.0 2.5 3.0 1 3
288 1 . . . . . 0.0 2.5 3.0 1 3
289 1 . . . . . 0.0 2.5 3.0 1 3
290 1 . . . . . 0.0 2.5 3.0 1 3
291 1 . . . . . 0.0 2.75 3.05 1 3
292 1 . . . . . 0.0 2.5 3.0 1 3
293 1 . . . . . 0.0 2.5 3.0 1 3
294 1 . . . . . 0.0 2.5 3.0 1 3
295 1 . . . . . 0.0 2.5 3.0 1 3
296 1 . . . . . 0.0 2.5 3.0 1 3
297 1 . . . . . 0.0 2.5 3.0 1 3
298 1 . . . . . 0.0 2.5 3.0 1 3
299 1 . . . . . 0.0 2.5 3.0 1 3
300 1 . . . . . 0.0 2.5 3.0 1 3
301 1 . . . . . 0.0 2.5 3.0 1 3
302 1 . . . . . 0.0 2.5 3.0 1 3
303 1 . . . . . 0.0 2.5 3.0 1 3
304 1 . . . . . 0.0 2.5 3.0 1 3
305 1 . . . . . 0.0 2.5 3.0 1 3
306 1 . . . . . 0.0 3.2 3.5 1 3
307 1 . . . . . 0.0 3.2 3.4 1 3
308 1 . . . . . 0.0 3.5 4.5 1 3
309 1 . . . . . 0.0 3.5 4.0 1 3
stop_
save_
save_Discover_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 4
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
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 . . . 1 4
2 1 . . . 1 4
3 1 . . . 1 4
4 1 . . . 1 4
5 1 . . . 1 4
6 1 . . . 1 4
7 1 . . . 1 4
8 1 . . . 1 4
9 1 . . . 1 4
10 1 . . . 1 4
11 1 . . . 1 4
12 1 . . . 1 4
13 1 . . . 1 4
14 1 . . . 1 4
15 1 . . . 1 4
16 1 . . . 1 4
17 1 . . . 1 4
18 1 . . . 1 4
19 1 . . . 1 4
20 1 . . . 1 4
21 1 . . . 1 4
22 1 . . . 1 4
23 1 . . . 1 4
24 1 . . . 1 4
25 1 . . . 1 4
26 1 . . . 1 4
27 1 . . . 1 4
28 1 . . . 1 4
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.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_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 1 1 DG O6 1 1 G O6 1 4
1 1 2 2 2 12 DC H41 2 12 C H42 1 4
2 1 1 1 1 1 DG H1 1 1 G H1 1 4
2 1 2 2 2 12 DC N3 2 12 C N3 1 4
3 1 1 1 1 1 DG H21 1 1 G H22 1 4
3 1 2 2 2 12 DC O2 2 12 C O2 1 4
4 1 1 1 1 2 DC H41 1 2 C H42 1 4
4 1 2 2 2 11 DG O6 2 11 G O6 1 4
5 1 1 1 1 2 DC N3 1 2 C N3 1 4
5 1 2 2 2 11 DG H1 2 11 G H1 1 4
6 1 1 1 1 2 DC O2 1 2 C O2 1 4
6 1 2 2 2 11 DG H21 2 11 G H22 1 4
7 1 1 1 1 3 DA H61 1 3 A H61 1 4
7 1 2 2 2 10 DT O4 2 10 T O4 1 4
8 1 1 1 1 3 DA N1 1 3 A N1 1 4
8 1 2 2 2 10 DT H3 2 10 T H3 1 4
9 1 1 1 1 4 DC H41 1 4 C H42 1 4
9 1 2 2 2 9 DG O6 2 9 G O6 1 4
10 1 1 1 1 4 DC N3 1 4 C N3 1 4
10 1 2 2 2 9 DG H1 2 9 G H1 1 4
11 1 1 1 1 4 DC O2 1 4 C O2 1 4
11 1 2 2 2 9 DG H21 2 9 G H22 1 4
12 1 1 1 1 5 DG O6 1 5 G O6 1 4
12 1 2 2 2 8 DC H41 2 8 C H42 1 4
13 1 1 1 1 5 DG H1 1 5 G H1 1 4
13 1 2 2 2 8 DC N3 2 8 C N3 1 4
14 1 1 1 1 5 DG H21 1 5 G H22 1 4
14 1 2 2 2 8 DC O2 2 8 C O2 1 4
15 1 1 1 1 6 DA H61 1 6 A H61 1 4
15 1 2 2 2 7 DT O4 2 7 T O4 1 4
16 1 1 1 1 6 DA N1 1 6 A N1 1 4
16 1 2 2 2 7 DT H3 2 7 T H3 1 4
17 1 1 1 1 7 DA H61 1 7 A H61 1 4
17 1 2 2 2 6 DT O4 2 6 T O4 1 4
18 1 1 1 1 7 DA N1 1 7 A N1 1 4
18 1 2 2 2 6 DT H3 2 6 T H3 1 4
19 1 1 1 1 8 DT O4 1 8 T O4 1 4
19 1 2 2 2 5 DA H61 2 5 A H61 1 4
20 1 1 1 1 8 DT H3 1 8 T H3 1 4
20 1 2 2 2 5 DA N1 2 5 A N1 1 4
21 1 1 1 1 9 DT O4 1 9 T O4 1 4
21 1 2 2 2 4 DA H61 2 4 A H61 1 4
22 1 1 1 1 9 DT H3 1 9 T H3 1 4
22 1 2 2 2 4 DA N1 2 4 A N1 1 4
23 1 1 1 1 10 DA H61 1 10 A H61 1 4
23 1 2 2 2 3 DT O4 2 3 T O4 1 4
24 1 1 1 1 10 DA N1 1 10 A N1 1 4
24 1 2 2 2 3 DT H3 2 3 T H3 1 4
25 1 1 1 1 11 DA H61 1 11 A H61 1 4
25 1 2 2 2 2 DT O4 2 2 T O4 1 4
26 1 1 1 1 11 DA N1 1 11 A N1 1 4
26 1 2 2 2 2 DT H3 2 2 T H3 1 4
27 1 1 1 1 12 DG O6 1 12 G O6 1 4
27 1 2 2 2 1 DC H41 2 1 C H42 1 4
28 1 1 1 1 12 DG H1 1 12 G H1 1 4
28 1 2 2 2 1 DC N3 2 1 C N3 1 4
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 . . . . . 0.0 1.7 2.1 1 4
2 1 . . . . . 0.0 1.7 2.1 1 4
3 1 . . . . . 0.0 1.7 2.1 1 4
4 1 . . . . . 0.0 1.7 2.1 1 4
5 1 . . . . . 0.0 1.7 2.1 1 4
6 1 . . . . . 0.0 1.7 2.1 1 4
7 1 . . . . . 0.0 1.7 2.1 1 4
8 1 . . . . . 0.0 1.7 2.1 1 4
9 1 . . . . . 0.0 1.7 2.1 1 4
10 1 . . . . . 0.0 1.7 2.1 1 4
11 1 . . . . . 0.0 1.7 2.1 1 4
12 1 . . . . . 0.0 1.7 2.1 1 4
13 1 . . . . . 0.0 1.7 2.1 1 4
14 1 . . . . . 0.0 1.7 2.1 1 4
15 1 . . . . . 0.0 1.7 2.1 1 4
16 1 . . . . . 0.0 1.7 2.1 1 4
17 1 . . . . . 0.0 1.7 2.1 1 4
18 1 . . . . . 0.0 1.7 2.1 1 4
19 1 . . . . . 0.0 1.7 2.1 1 4
20 1 . . . . . 0.0 1.7 2.1 1 4
21 1 . . . . . 0.0 1.7 2.1 1 4
22 1 . . . . . 0.0 1.7 2.1 1 4
23 1 . . . . . 0.0 1.7 2.1 1 4
24 1 . . . . . 0.0 1.7 2.1 1 4
25 1 . . . . . 0.0 1.7 2.1 1 4
26 1 . . . . . 0.0 1.7 2.1 1 4
27 1 . . . . . 0.0 1.7 2.1 1 4
28 1 . . . . . 0.0 1.7 2.1 1 4
stop_
save_
save_Discover_dihedral_7
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_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 . 1 1 1 DG C4' 1 1 1 DG C3' 1 1 1 DG O3' 1 1 2 DC P -179.0 -150.0 1 1 G C4' 1 1 G C3' 1 1 G O3' 1 2 C P 1 1
2 . 1 1 2 DC C4' 1 1 2 DC C3' 1 1 2 DC O3' 1 1 3 DA P -179.0 -150.0 1 2 C C4' 1 2 C C3' 1 2 C O3' 1 3 A P 1 1
3 . 1 1 3 DA C4' 1 1 3 DA C3' 1 1 3 DA O3' 1 1 4 DC P -179.0 -150.0 1 3 A C4' 1 3 A C3' 1 3 A O3' 1 4 C P 1 1
4 . 1 1 4 DC C4' 1 1 4 DC C3' 1 1 4 DC O3' 1 1 5 DG P -179.0 -150.0 1 4 C C4' 1 4 C C3' 1 4 C O3' 1 5 G P 1 1
5 . 1 1 5 DG C4' 1 1 5 DG C3' 1 1 5 DG O3' 1 1 6 DA P -179.0 -150.0 1 5 G C4' 1 5 G C3' 1 5 G O3' 1 6 A P 1 1
6 . 1 1 6 DA C4' 1 1 6 DA C3' 1 1 6 DA O3' 1 1 7 DA P -179.0 -150.0 1 6 A C4' 1 6 A C3' 1 6 A O3' 1 7 A P 1 1
7 . 1 1 7 DA C4' 1 1 7 DA C3' 1 1 7 DA O3' 1 1 8 DT P -179.0 -150.0 1 7 A C4' 1 7 A C3' 1 7 A O3' 1 8 T P 1 1
8 . 1 1 8 DT C4' 1 1 8 DT C3' 1 1 8 DT O3' 1 1 9 DT P -179.0 -150.0 1 8 T C4' 1 8 T C3' 1 8 T O3' 1 9 T P 1 1
9 . 1 1 9 DT C4' 1 1 9 DT C3' 1 1 9 DT O3' 1 1 10 DA P -100.0 -70.0 1 9 T C4' 1 9 T C3' 1 9 T O3' 1 10 A P 1 1
10 . 1 1 10 DA C4' 1 1 10 DA C3' 1 1 10 DA O3' 1 1 11 DA P -179.0 -150.0 1 10 A C4' 1 10 A C3' 1 10 A O3' 1 11 A P 1 1
11 . 1 1 11 DA C4' 1 1 11 DA C3' 1 1 11 DA O3' 1 1 12 DG P -179.0 -150.0 1 11 A C4' 1 11 A C3' 1 11 A O3' 1 12 G P 1 1
12 . 2 2 1 DC C4' 2 2 1 DC C3' 2 2 1 DC O3' 2 2 2 DT P -179.0 -150.0 2 1 C C4' 2 1 C C3' 2 1 C O3' 2 2 T P 1 1
13 . 2 2 2 DT C4' 2 2 2 DT C3' 2 2 2 DT O3' 2 2 3 DT P -179.0 -150.0 2 2 T C4' 2 2 T C3' 2 2 T O3' 2 3 T P 1 1
14 . 2 2 3 DT C4' 2 2 3 DT C3' 2 2 3 DT O3' 2 2 4 DA P -179.0 -150.0 2 3 T C4' 2 3 T C3' 2 3 T O3' 2 4 A P 1 1
15 . 2 2 4 DA C4' 2 2 4 DA C3' 2 2 4 DA O3' 2 2 5 DA P -179.0 -150.0 2 4 A C4' 2 4 A C3' 2 4 A O3' 2 5 A P 1 1
16 . 2 2 5 DA C4' 2 2 5 DA C3' 2 2 5 DA O3' 2 2 6 DT P -179.0 -150.0 2 5 A C4' 2 5 A C3' 2 5 A O3' 2 6 T P 1 1
17 . 2 2 6 DT C4' 2 2 6 DT C3' 2 2 6 DT O3' 2 2 7 DT P -179.0 -150.0 2 6 T C4' 2 6 T C3' 2 6 T O3' 2 7 T P 1 1
18 . 2 2 7 DT C4' 2 2 7 DT C3' 2 2 7 DT O3' 2 2 8 DC P -179.0 -150.0 2 7 T C4' 2 7 T C3' 2 7 T O3' 2 8 C P 1 1
19 . 2 2 8 DC C4' 2 2 8 DC C3' 2 2 8 DC O3' 2 2 9 DG P -179.0 -150.0 2 8 C C4' 2 8 C C3' 2 8 C O3' 2 9 G P 1 1
20 . 2 2 9 DG C4' 2 2 9 DG C3' 2 2 9 DG O3' 2 2 10 DT P -179.0 -150.0 2 9 G C4' 2 9 G C3' 2 9 G O3' 2 10 T P 1 1
21 . 2 2 10 DT C4' 2 2 10 DT C3' 2 2 10 DT O3' 2 2 11 DG P -179.0 -150.0 2 10 T C4' 2 10 T C3' 2 10 T O3' 2 11 G P 1 1
22 . 2 2 11 DG C4' 2 2 11 DG C3' 2 2 11 DG O3' 2 2 12 DC P -179.0 -150.0 2 11 G C4' 2 11 G C3' 2 11 G O3' 2 12 C P 1 1
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 DG C1' C 7.118 -8.331 0.046 1.00 . A A . 1 DG C1' 1 1
1 2 1 1 1 DG C2 C 7.520 -4.118 1.362 1.00 . A A . 1 DG C2 1 1
1 3 1 1 1 DG C2' C 6.985 -9.780 0.540 1.00 . A A . 1 DG C2' 1 1
1 4 1 1 1 DG C3' C 7.952 -10.487 -0.433 1.00 . A A . 1 DG C3' 1 1
1 5 1 1 1 DG C4 C 6.383 -5.988 0.772 1.00 . A A . 1 DG C4 1 1
1 6 1 1 1 DG C4' C 7.654 -9.738 -1.739 1.00 . A A . 1 DG C4' 1 1
1 7 1 1 1 DG C5 C 5.193 -5.315 0.613 1.00 . A A . 1 DG C5 1 1
1 8 1 1 1 DG C5' C 6.613 -10.410 -2.659 1.00 . A A . 1 DG C5' 1 1
1 9 1 1 1 DG C6 C 5.152 -3.899 0.762 1.00 . A A . 1 DG C6 1 1
1 10 1 1 1 DG C8 C 4.792 -7.328 0.166 1.00 . A A . 1 DG C8 1 1
1 11 1 1 1 DG H1 H 6.409 -2.369 1.331 1.00 . A A . 1 DG H1 1 1
1 12 1 1 1 DG H1' H 7.993 -7.931 0.507 1.00 . A A . 1 DG H1' 1 1
1 13 1 1 1 DG H2' H 5.968 -10.147 0.409 1.00 . A A . 1 DG H2' 1 1
1 14 1 1 1 DG H2'' H 7.294 -9.890 1.581 1.00 . A A . 1 DG H2'' 1 1
1 15 1 1 1 DG H21 H 8.572 -2.452 1.917 1.00 . A A . 1 DG H21 1 1
1 16 1 1 1 DG H22 H 9.469 -3.955 1.930 1.00 . A A . 1 DG H22 1 1
1 17 1 1 1 DG H3' H 7.877 -11.583 -0.530 1.00 . A A . 1 DG H3' 1 1
1 18 1 1 1 DG H4' H 8.575 -9.654 -2.317 1.00 . A A . 1 DG H4' 1 1
1 19 1 1 1 DG H5' H 6.504 -9.800 -3.556 1.00 . A A . 1 DG H5' 1 1
1 20 1 1 1 DG H5'' H 6.922 -11.416 -2.971 1.00 . A A . 1 DG H5'' 1 1
1 21 1 1 1 DG H8 H 4.338 -8.233 -0.137 1.00 . A A . 1 DG H8 1 1
1 22 1 1 1 DG HO5' H 5.073 -9.604 -1.805 1.00 . A A . 1 DG HO5' 1 1
1 23 1 1 1 DG N1 N 6.374 -3.368 1.167 1.00 . A A . 1 DG N1 1 1
1 24 1 1 1 DG N2 N 8.609 -3.452 1.764 1.00 . A A . 1 DG N2 1 1
1 25 1 1 1 DG N3 N 7.579 -5.444 1.141 1.00 . A A . 1 DG N3 1 1
1 26 1 1 1 DG N7 N 4.178 -6.187 0.251 1.00 . A A . 1 DG N7 1 1
1 27 1 1 1 DG N9 N 6.124 -7.302 0.420 1.00 . A A . 1 DG N9 1 1
1 28 1 1 1 DG O3' O 9.293 -10.173 -0.114 1.00 . A A . 1 DG O3' 1 1
1 29 1 1 1 DG O4' O 7.230 -8.427 -1.371 1.00 . A A . 1 DG O4' 1 1
1 30 1 1 1 DG O5' O 5.351 -10.493 -2.034 1.00 . A A . 1 DG O5' 1 1
1 31 1 1 1 DG O6 O 4.196 -3.157 0.563 1.00 . A A . 1 DG O6 1 1
1 32 1 1 2 DC C1' C 10.234 -6.837 4.200 1.00 . A A . 2 DC C1' 1 1
1 33 1 1 2 DC C2 C 8.338 -5.286 4.685 1.00 . A A . 2 DC C2 1 1
1 34 1 1 2 DC C2' C 10.838 -8.137 4.769 1.00 . A A . 2 DC C2' 1 1
1 35 1 1 2 DC C3' C 12.114 -8.242 3.958 1.00 . A A . 2 DC C3' 1 1
1 36 1 1 2 DC C4 C 6.133 -6.092 4.817 1.00 . A A . 2 DC C4 1 1
1 37 1 1 2 DC C4' C 11.653 -7.697 2.597 1.00 . A A . 2 DC C4' 1 1
1 38 1 1 2 DC C5 C 6.545 -7.379 4.357 1.00 . A A . 2 DC C5 1 1
1 39 1 1 2 DC C5' C 11.490 -8.755 1.472 1.00 . A A . 2 DC C5' 1 1
1 40 1 1 2 DC C6 C 7.873 -7.586 4.193 1.00 . A A . 2 DC C6 1 1
1 41 1 1 2 DC H1' H 10.803 -5.975 4.574 1.00 . A A . 2 DC H1' 1 1
1 42 1 1 2 DC H2' H 10.287 -9.049 4.563 1.00 . A A . 2 DC H2' 1 1
1 43 1 1 2 DC H2'' H 11.073 -8.128 5.817 1.00 . A A . 2 DC H2'' 1 1
1 44 1 1 2 DC H3' H 12.450 -9.285 3.891 1.00 . A A . 2 DC H3' 1 1
1 45 1 1 2 DC H4' H 12.292 -6.855 2.352 1.00 . A A . 2 DC H4' 1 1
1 46 1 1 2 DC H41 H 4.537 -4.920 5.261 1.00 . A A . 2 DC H41 1 1
1 47 1 1 2 DC H42 H 4.169 -6.614 5.015 1.00 . A A . 2 DC H42 1 1
1 48 1 1 2 DC H5 H 5.825 -8.131 4.110 1.00 . A A . 2 DC H5 1 1
1 49 1 1 2 DC H5' H 10.985 -8.266 0.636 1.00 . A A . 2 DC H5' 1 1
1 50 1 1 2 DC H5'' H 12.427 -9.208 1.088 1.00 . A A . 2 DC H5'' 1 1
1 51 1 1 2 DC H6 H 8.232 -8.535 3.831 1.00 . A A . 2 DC H6 1 1
1 52 1 1 2 DC N1 N 8.786 -6.594 4.444 1.00 . A A . 2 DC N1 1 1
1 53 1 1 2 DC N3 N 7.012 -5.091 4.918 1.00 . A A . 2 DC N3 1 1
1 54 1 1 2 DC N4 N 4.844 -5.867 5.088 1.00 . A A . 2 DC N4 1 1
1 55 1 1 2 DC O2 O 9.092 -4.314 4.671 1.00 . A A . 2 DC O2 1 1
1 56 1 1 2 DC O3' O 13.104 -7.346 4.454 1.00 . A A . 2 DC O3' 1 1
1 57 1 1 2 DC O4' O 10.413 -7.039 2.811 1.00 . A A . 2 DC O4' 1 1
1 58 1 1 2 DC O5' O 10.642 -9.788 1.948 1.00 . A A . 2 DC O5' 1 1
1 59 1 1 2 DC OP1 O 11.322 -11.560 0.293 1.00 . A A . 2 DC OP1 1 1
1 60 1 1 2 DC OP2 O 9.234 -11.860 1.755 1.00 . A A . 2 DC OP2 1 1
1 61 1 1 2 DC P P 10.145 -10.982 0.987 1.00 . A A . 2 DC P 1 1
1 62 1 1 3 DA C1' C 10.269 -3.999 7.669 1.00 . A A . 3 DA C1' 1 1
1 63 1 1 3 DA C2 C 5.843 -3.360 7.659 1.00 . A A . 3 DA C2 1 1
1 64 1 1 3 DA C2' C 11.310 -3.727 8.772 1.00 . A A . 3 DA C2' 1 1
1 65 1 1 3 DA C3' C 12.467 -3.094 7.972 1.00 . A A . 3 DA C3' 1 1
1 66 1 1 3 DA C4 C 7.733 -4.490 7.958 1.00 . A A . 3 DA C4 1 1
1 67 1 1 3 DA C4' C 12.380 -3.867 6.637 1.00 . A A . 3 DA C4' 1 1
1 68 1 1 3 DA C5 C 7.045 -5.639 8.281 1.00 . A A . 3 DA C5 1 1
1 69 1 1 3 DA C5' C 13.485 -4.904 6.303 1.00 . A A . 3 DA C5' 1 1
1 70 1 1 3 DA C6 C 5.636 -5.548 8.325 1.00 . A A . 3 DA C6 1 1
1 71 1 1 3 DA C8 C 9.073 -6.144 8.206 1.00 . A A . 3 DA C8 1 1
1 72 1 1 3 DA H1' H 9.723 -3.137 7.397 1.00 . A A . 3 DA H1' 1 1
1 73 1 1 3 DA H2 H 5.315 -2.489 7.333 1.00 . A A . 3 DA H2 1 1
1 74 1 1 3 DA H2' H 11.652 -4.674 9.194 1.00 . A A . 3 DA H2' 1 1
1 75 1 1 3 DA H2'' H 10.944 -3.064 9.559 1.00 . A A . 3 DA H2'' 1 1
1 76 1 1 3 DA H3' H 13.473 -3.131 8.424 1.00 . A A . 3 DA H3' 1 1
1 77 1 1 3 DA H4' H 12.502 -3.134 5.829 1.00 . A A . 3 DA H4' 1 1
1 78 1 1 3 DA H5' H 13.535 -4.902 5.213 1.00 . A A . 3 DA H5' 1 1
1 79 1 1 3 DA H5'' H 14.482 -4.618 6.666 1.00 . A A . 3 DA H5'' 1 1
1 80 1 1 3 DA H61 H 3.843 -6.453 8.664 1.00 . A A . 3 DA H61 1 1
1 81 1 1 3 DA H62 H 5.256 -7.473 8.873 1.00 . A A . 3 DA H62 1 1
1 82 1 1 3 DA H8 H 10.021 -6.576 8.149 1.00 . A A . 3 DA H8 1 1
1 83 1 1 3 DA N1 N 5.060 -4.381 7.988 1.00 . A A . 3 DA N1 1 1
1 84 1 1 3 DA N3 N 7.172 -3.294 7.631 1.00 . A A . 3 DA N3 1 1
1 85 1 1 3 DA N6 N 4.846 -6.581 8.639 1.00 . A A . 3 DA N6 1 1
1 86 1 1 3 DA N7 N 7.921 -6.704 8.430 1.00 . A A . 3 DA N7 1 1
1 87 1 1 3 DA N9 N 9.077 -4.820 7.992 1.00 . A A . 3 DA N9 1 1
1 88 1 1 3 DA O3' O 12.183 -1.721 7.731 1.00 . A A . 3 DA O3' 1 1
1 89 1 1 3 DA O4' O 11.076 -4.468 6.590 1.00 . A A . 3 DA O4' 1 1
1 90 1 1 3 DA O5' O 13.191 -6.241 6.694 1.00 . A A . 3 DA O5' 1 1
1 91 1 1 3 DA OP1 O 15.293 -7.212 5.688 1.00 . A A . 3 DA OP1 1 1
1 92 1 1 3 DA OP2 O 13.441 -8.760 6.529 1.00 . A A . 3 DA OP2 1 1
1 93 1 1 3 DA P P 13.855 -7.496 5.887 1.00 . A A . 3 DA P 1 1
1 94 1 1 4 DC C1' C 7.188 -0.461 10.519 1.00 . A A . 4 DC C1' 1 1
1 95 1 1 4 DC C2 C 5.536 -2.168 11.352 1.00 . A A . 4 DC C2 1 1
1 96 1 1 4 DC C2' C 8.088 0.415 11.396 1.00 . A A . 4 DC C2' 1 1
1 97 1 1 4 DC C3' C 8.548 1.474 10.396 1.00 . A A . 4 DC C3' 1 1
1 98 1 1 4 DC C4 C 6.249 -4.415 11.505 1.00 . A A . 4 DC C4 1 1
1 99 1 1 4 DC C4' C 8.558 0.711 9.056 1.00 . A A . 4 DC C4' 1 1
1 100 1 1 4 DC C5 C 7.603 -4.046 11.196 1.00 . A A . 4 DC C5 1 1
1 101 1 1 4 DC C5' C 9.954 0.497 8.390 1.00 . A A . 4 DC C5' 1 1
1 102 1 1 4 DC C6 C 7.824 -2.730 10.997 1.00 . A A . 4 DC C6 1 1
1 103 1 1 4 DC H1' H 6.244 -0.001 10.338 1.00 . A A . 4 DC H1' 1 1
1 104 1 1 4 DC H2' H 8.971 -0.100 11.770 1.00 . A A . 4 DC H2' 1 1
1 105 1 1 4 DC H2'' H 7.568 0.850 12.237 1.00 . A A . 4 DC H2'' 1 1
1 106 1 1 4 DC H3' H 9.539 1.861 10.643 1.00 . A A . 4 DC H3' 1 1
1 107 1 1 4 DC H4' H 7.862 1.212 8.388 1.00 . A A . 4 DC H4' 1 1
1 108 1 1 4 DC H41 H 4.970 -5.936 11.919 1.00 . A A . 4 DC H41 1 1
1 109 1 1 4 DC H42 H 6.634 -6.417 11.637 1.00 . A A . 4 DC H42 1 1
1 110 1 1 4 DC H5 H 8.424 -4.736 11.064 1.00 . A A . 4 DC H5 1 1
1 111 1 1 4 DC H5' H 9.805 -0.134 7.511 1.00 . A A . 4 DC H5' 1 1
1 112 1 1 4 DC H5'' H 10.483 1.415 8.054 1.00 . A A . 4 DC H5'' 1 1
1 113 1 1 4 DC H6 H 8.753 -2.300 10.728 1.00 . A A . 4 DC H6 1 1
1 114 1 1 4 DC N1 N 6.852 -1.798 11.060 1.00 . A A . 4 DC N1 1 1
1 115 1 1 4 DC N3 N 5.278 -3.490 11.572 1.00 . A A . 4 DC N3 1 1
1 116 1 1 4 DC N4 N 5.930 -5.698 11.704 1.00 . A A . 4 DC N4 1 1
1 117 1 1 4 DC O2 O 4.626 -1.343 11.411 1.00 . A A . 4 DC O2 1 1
1 118 1 1 4 DC O3' O 7.599 2.533 10.337 1.00 . A A . 4 DC O3' 1 1
1 119 1 1 4 DC O4' O 7.924 -0.539 9.303 1.00 . A A . 4 DC O4' 1 1
1 120 1 1 4 DC O5' O 10.805 -0.205 9.281 1.00 . A A . 4 DC O5' 1 1
1 121 1 1 4 DC OP1 O 12.961 0.604 8.272 1.00 . A A . 4 DC OP1 1 1
1 122 1 1 4 DC OP2 O 12.955 -1.204 10.074 1.00 . A A . 4 DC OP2 1 1
1 123 1 1 4 DC P P 12.331 -0.585 8.885 1.00 . A A . 4 DC P 1 1
1 124 1 1 5 DG C1' C 3.110 1.298 14.086 1.00 . A A . 5 DG C1' 1 1
1 125 1 1 5 DG C2 C 0.699 -2.121 15.630 1.00 . A A . 5 DG C2 1 1
1 126 1 1 5 DG C2' C 3.945 2.468 14.616 1.00 . A A . 5 DG C2' 1 1
1 127 1 1 5 DG C3' C 3.488 3.607 13.671 1.00 . A A . 5 DG C3' 1 1
1 128 1 1 5 DG C4 C 2.604 -1.060 15.009 1.00 . A A . 5 DG C4 1 1
1 129 1 1 5 DG C4' C 3.446 2.848 12.334 1.00 . A A . 5 DG C4' 1 1
1 130 1 1 5 DG C5 C 3.374 -2.194 15.143 1.00 . A A . 5 DG C5 1 1
1 131 1 1 5 DG C5' C 4.741 2.986 11.505 1.00 . A A . 5 DG C5' 1 1
1 132 1 1 5 DG C6 C 2.774 -3.422 15.540 1.00 . A A . 5 DG C6 1 1
1 133 1 1 5 DG C8 C 4.667 -0.679 14.488 1.00 . A A . 5 DG C8 1 1
1 134 1 1 5 DG H1 H 0.922 -4.141 16.057 1.00 . A A . 5 DG H1 1 1
1 135 1 1 5 DG H1' H 2.129 1.381 14.516 1.00 . A A . 5 DG H1' 1 1
1 136 1 1 5 DG H2' H 5.005 2.259 14.490 1.00 . A A . 5 DG H2' 1 1
1 137 1 1 5 DG H2'' H 3.748 2.643 15.669 1.00 . A A . 5 DG H2'' 1 1
1 138 1 1 5 DG H21 H -1.042 -3.063 16.132 1.00 . A A . 5 DG H21 1 1
1 139 1 1 5 DG H22 H -1.181 -1.353 15.773 1.00 . A A . 5 DG H22 1 1
1 140 1 1 5 DG H3' H 4.110 4.518 13.615 1.00 . A A . 5 DG H3' 1 1
1 141 1 1 5 DG H4' H 2.697 3.285 11.651 1.00 . A A . 5 DG H4' 1 1
1 142 1 1 5 DG H5' H 4.779 2.191 10.759 1.00 . A A . 5 DG H5' 1 1
1 143 1 1 5 DG H5'' H 4.671 3.943 10.985 1.00 . A A . 5 DG H5'' 1 1
1 144 1 1 5 DG H8 H 5.503 -0.126 14.170 1.00 . A A . 5 DG H8 1 1
1 145 1 1 5 DG N1 N 1.408 -3.299 15.771 1.00 . A A . 5 DG N1 1 1
1 146 1 1 5 DG N2 N -0.615 -2.182 15.872 1.00 . A A . 5 DG N2 1 1
1 147 1 1 5 DG N3 N 1.263 -0.961 15.242 1.00 . A A . 5 DG N3 1 1
1 148 1 1 5 DG N7 N 4.695 -1.933 14.822 1.00 . A A . 5 DG N7 1 1
1 149 1 1 5 DG N9 N 3.455 -0.074 14.537 1.00 . A A . 5 DG N9 1 1
1 150 1 1 5 DG O3' O 2.177 4.043 13.988 1.00 . A A . 5 DG O3' 1 1
1 151 1 1 5 DG O4' O 3.149 1.480 12.664 1.00 . A A . 5 DG O4' 1 1
1 152 1 1 5 DG O5' O 5.951 2.992 12.244 1.00 . A A . 5 DG O5' 1 1
1 153 1 1 5 DG O6 O 3.323 -4.511 15.675 1.00 . A A . 5 DG O6 1 1
1 154 1 1 5 DG OP1 O 7.053 4.891 11.035 1.00 . A A . 5 DG OP1 1 1
1 155 1 1 5 DG OP2 O 8.413 3.375 12.573 1.00 . A A . 5 DG OP2 1 1
1 156 1 1 5 DG P P 7.330 3.542 11.579 1.00 . A A . 5 DG P 1 1
1 157 1 1 6 DA C1' C 0.294 0.945 18.502 1.00 . A A . 6 DA C1' 1 1
1 158 1 1 6 DA C2 C 0.000 -3.438 19.246 1.00 . A A . 6 DA C2 1 1
1 159 1 1 6 DA C2' C 0.461 2.242 19.314 1.00 . A A . 6 DA C2' 1 1
1 160 1 1 6 DA C3' C -0.567 3.186 18.654 1.00 . A A . 6 DA C3' 1 1
1 161 1 1 6 DA C4 C 1.048 -1.496 18.880 1.00 . A A . 6 DA C4 1 1
1 162 1 1 6 DA C4' C -0.576 2.641 17.209 1.00 . A A . 6 DA C4' 1 1
1 163 1 1 6 DA C5 C 2.263 -2.126 18.746 1.00 . A A . 6 DA C5 1 1
1 164 1 1 6 DA C5' C -0.201 3.660 16.082 1.00 . A A . 6 DA C5' 1 1
1 165 1 1 6 DA C6 C 2.279 -3.525 18.906 1.00 . A A . 6 DA C6 1 1
1 166 1 1 6 DA C8 C 2.597 -0.105 18.293 1.00 . A A . 6 DA C8 1 1
1 167 1 1 6 DA H1' H -0.610 0.440 18.784 1.00 . A A . 6 DA H1' 1 1
1 168 1 1 6 DA H2 H -0.901 -4.010 19.436 1.00 . A A . 6 DA H2 1 1
1 169 1 1 6 DA H2' H 1.470 2.622 19.197 1.00 . A A . 6 DA H2' 1 1
1 170 1 1 6 DA H2'' H 0.262 2.149 20.368 1.00 . A A . 6 DA H2'' 1 1
1 171 1 1 6 DA H3' H -0.366 4.266 18.724 1.00 . A A . 6 DA H3' 1 1
1 172 1 1 6 DA H4' H -1.547 2.169 17.061 1.00 . A A . 6 DA H4' 1 1
1 173 1 1 6 DA H5' H -0.235 3.123 15.132 1.00 . A A . 6 DA H5' 1 1
1 174 1 1 6 DA H5'' H -0.833 4.573 15.958 1.00 . A A . 6 DA H5'' 1 1
1 175 1 1 6 DA H61 H 3.395 -5.245 18.875 1.00 . A A . 6 DA H61 1 1
1 176 1 1 6 DA H62 H 4.265 -3.762 18.563 1.00 . A A . 6 DA H62 1 1
1 177 1 1 6 DA H8 H 3.004 0.806 17.949 1.00 . A A . 6 DA H8 1 1
1 178 1 1 6 DA N1 N 1.116 -4.159 19.150 1.00 . A A . 6 DA N1 1 1
1 179 1 1 6 DA N3 N -0.141 -2.114 19.141 1.00 . A A . 6 DA N3 1 1
1 180 1 1 6 DA N6 N 3.402 -4.240 18.778 1.00 . A A . 6 DA N6 1 1
1 181 1 1 6 DA N7 N 3.248 -1.228 18.369 1.00 . A A . 6 DA N7 1 1
1 182 1 1 6 DA N9 N 1.286 -0.151 18.639 1.00 . A A . 6 DA N9 1 1
1 183 1 1 6 DA O3' O -1.868 2.978 19.183 1.00 . A A . 6 DA O3' 1 1
1 184 1 1 6 DA O4' O 0.260 1.485 17.188 1.00 . A A . 6 DA O4' 1 1
1 185 1 1 6 DA O5' O 1.129 4.096 16.294 1.00 . A A . 6 DA O5' 1 1
1 186 1 1 6 DA OP1 O 0.929 6.078 14.761 1.00 . A A . 6 DA OP1 1 1
1 187 1 1 6 DA OP2 O 3.176 5.460 15.812 1.00 . A A . 6 DA OP2 1 1
1 188 1 1 6 DA P P 1.882 5.045 15.225 1.00 . A A . 6 DA P 1 1
1 189 1 1 7 DA C1' C -2.494 -1.361 22.366 1.00 . A A . 7 DA C1' 1 1
1 190 1 1 7 DA C2 C 0.103 -4.849 22.363 1.00 . A A . 7 DA C2 1 1
1 191 1 1 7 DA C2' C -3.394 -0.623 23.366 1.00 . A A . 7 DA C2' 1 1
1 192 1 1 7 DA C3' C -4.630 -0.364 22.465 1.00 . A A . 7 DA C3' 1 1
1 193 1 1 7 DA C4 C -0.339 -2.683 22.540 1.00 . A A . 7 DA C4 1 1
1 194 1 1 7 DA C4' C -4.010 -0.181 21.067 1.00 . A A . 7 DA C4' 1 1
1 195 1 1 7 DA C5 C 0.988 -2.341 22.457 1.00 . A A . 7 DA C5 1 1
1 196 1 1 7 DA C5' C -3.818 1.248 20.543 1.00 . A A . 7 DA C5' 1 1
1 197 1 1 7 DA C6 C 1.898 -3.402 22.292 1.00 . A A . 7 DA C6 1 1
1 198 1 1 7 DA C8 C -0.090 -0.543 22.534 1.00 . A A . 7 DA C8 1 1
1 199 1 1 7 DA H1' H -2.787 -2.377 22.405 1.00 . A A . 7 DA H1' 1 1
1 200 1 1 7 DA H2 H -0.249 -5.865 22.334 1.00 . A A . 7 DA H2 1 1
1 201 1 1 7 DA H2' H -2.939 0.329 23.637 1.00 . A A . 7 DA H2' 1 1
1 202 1 1 7 DA H2'' H -3.591 -1.234 24.270 1.00 . A A . 7 DA H2'' 1 1
1 203 1 1 7 DA H3' H -5.278 0.476 22.746 1.00 . A A . 7 DA H3' 1 1
1 204 1 1 7 DA H4' H -4.663 -0.647 20.320 1.00 . A A . 7 DA H4' 1 1
1 205 1 1 7 DA H5' H -3.458 1.124 19.517 1.00 . A A . 7 DA H5' 1 1
1 206 1 1 7 DA H5'' H -4.764 1.801 20.519 1.00 . A A . 7 DA H5'' 1 1
1 207 1 1 7 DA H61 H 3.825 -3.983 21.947 1.00 . A A . 7 DA H61 1 1
1 208 1 1 7 DA H62 H 3.567 -2.258 22.098 1.00 . A A . 7 DA H62 1 1
1 209 1 1 7 DA H8 H -0.390 0.466 22.493 1.00 . A A . 7 DA H8 1 1
1 210 1 1 7 DA N1 N 1.416 -4.658 22.259 1.00 . A A . 7 DA N1 1 1
1 211 1 1 7 DA N3 N -0.853 -3.939 22.493 1.00 . A A . 7 DA N3 1 1
1 212 1 1 7 DA N6 N 3.206 -3.201 22.102 1.00 . A A . 7 DA N6 1 1
1 213 1 1 7 DA N7 N 1.140 -0.964 22.464 1.00 . A A . 7 DA N7 1 1
1 214 1 1 7 DA N9 N -1.045 -1.505 22.603 1.00 . A A . 7 DA N9 1 1
1 215 1 1 7 DA O3' O -5.464 -1.503 22.345 1.00 . A A . 7 DA O3' 1 1
1 216 1 1 7 DA O4' O -2.749 -0.833 21.076 1.00 . A A . 7 DA O4' 1 1
1 217 1 1 7 DA O5' O -2.839 1.984 21.253 1.00 . A A . 7 DA O5' 1 1
1 218 1 1 7 DA OP1 O -3.517 4.295 20.558 1.00 . A A . 7 DA OP1 1 1
1 219 1 1 7 DA OP2 O -1.171 3.852 21.468 1.00 . A A . 7 DA OP2 1 1
1 220 1 1 7 DA P P -2.338 3.407 20.675 1.00 . A A . 7 DA P 1 1
1 221 1 1 8 DT C1' C -3.545 -5.109 25.591 1.00 . A A . 8 DT C1' 1 1
1 222 1 1 8 DT C2 C -1.120 -4.719 25.495 1.00 . A A . 8 DT C2 1 1
1 223 1 1 8 DT C2' C -4.924 -4.937 26.271 1.00 . A A . 8 DT C2' 1 1
1 224 1 1 8 DT C3' C -5.795 -5.702 25.270 1.00 . A A . 8 DT C3' 1 1
1 225 1 1 8 DT C4 C -0.075 -2.608 26.261 1.00 . A A . 8 DT C4 1 1
1 226 1 1 8 DT C4' C -5.069 -5.428 23.944 1.00 . A A . 8 DT C4' 1 1
1 227 1 1 8 DT C5 C -1.355 -2.145 26.835 1.00 . A A . 8 DT C5 1 1
1 228 1 1 8 DT C5' C -5.886 -4.410 23.179 1.00 . A A . 8 DT C5' 1 1
1 229 1 1 8 DT C6 C -2.410 -3.079 26.696 1.00 . A A . 8 DT C6 1 1
1 230 1 1 8 DT C7 C -1.348 -0.613 26.425 1.00 . A A . 8 DT C7 1 1
1 231 1 1 8 DT H1' H -3.353 -6.187 25.730 1.00 . A A . 8 DT H1' 1 1
1 232 1 1 8 DT H2' H -5.385 -3.952 26.128 1.00 . A A . 8 DT H2' 1 1
1 233 1 1 8 DT H2'' H -4.968 -5.288 27.329 1.00 . A A . 8 DT H2'' 1 1
1 234 1 1 8 DT H3 H 0.843 -4.188 25.334 1.00 . A A . 8 DT H3 1 1
1 235 1 1 8 DT H3' H -6.806 -5.288 25.272 1.00 . A A . 8 DT H3' 1 1
1 236 1 1 8 DT H4' H -4.984 -6.334 23.339 1.00 . A A . 8 DT H4' 1 1
1 237 1 1 8 DT H5' H -5.364 -4.091 22.248 1.00 . A A . 8 DT H5' 1 1
1 238 1 1 8 DT H5'' H -6.807 -5.025 23.097 1.00 . A A . 8 DT H5'' 1 1
1 239 1 1 8 DT H6 H -3.415 -2.696 26.369 1.00 . A A . 8 DT H6 1 1
1 240 1 1 8 DT H71 H -2.345 -0.180 26.512 1.00 . A A . 8 DT H71 1 1
1 241 1 1 8 DT H72 H -0.641 -0.034 27.022 1.00 . A A . 8 DT H72 1 1
1 242 1 1 8 DT H73 H -1.062 -0.513 25.377 1.00 . A A . 8 DT H73 1 1
1 243 1 1 8 DT N1 N -2.347 -4.246 25.939 1.00 . A A . 8 DT N1 1 1
1 244 1 1 8 DT N3 N -0.056 -3.855 25.655 1.00 . A A . 8 DT N3 1 1
1 245 1 1 8 DT O2 O -0.961 -5.835 25.008 1.00 . A A . 8 DT O2 1 1
1 246 1 1 8 DT O3' O -5.908 -7.094 25.430 1.00 . A A . 8 DT O3' 1 1
1 247 1 1 8 DT O4 O 0.970 -1.959 26.271 1.00 . A A . 8 DT O4 1 1
1 248 1 1 8 DT O4' O -3.793 -4.905 24.222 1.00 . A A . 8 DT O4' 1 1
1 249 1 1 8 DT O5' O -6.063 -3.264 23.992 1.00 . A A . 8 DT O5' 1 1
1 250 1 1 8 DT OP1 O -7.879 -2.133 22.705 1.00 . A A . 8 DT OP1 1 1
1 251 1 1 8 DT OP2 O -6.581 -0.888 24.523 1.00 . A A . 8 DT OP2 1 1
1 252 1 1 8 DT P P -6.613 -1.872 23.421 1.00 . A A . 8 DT P 1 1
1 253 1 1 9 DT C1' C -2.347 -5.749 28.893 1.00 . A A . 9 DT C1' 1 1
1 254 1 1 9 DT C2 C -0.181 -4.637 28.657 1.00 . A A . 9 DT C2 1 1
1 255 1 1 9 DT C2' C -3.527 -5.667 29.865 1.00 . A A . 9 DT C2' 1 1
1 256 1 1 9 DT C3' C -3.881 -7.170 29.955 1.00 . A A . 9 DT C3' 1 1
1 257 1 1 9 DT C4 C -0.231 -2.239 28.944 1.00 . A A . 9 DT C4 1 1
1 258 1 1 9 DT C4' C -3.508 -7.637 28.525 1.00 . A A . 9 DT C4' 1 1
1 259 1 1 9 DT C5 C -1.509 -2.227 28.216 1.00 . A A . 9 DT C5 1 1
1 260 1 1 9 DT C5' C -4.653 -8.320 27.828 1.00 . A A . 9 DT C5' 1 1
1 261 1 1 9 DT C6 C -2.217 -3.390 28.040 1.00 . A A . 9 DT C6 1 1
1 262 1 1 9 DT C7 C -2.378 -1.135 28.882 1.00 . A A . 9 DT C7 1 1
1 263 1 1 9 DT H1' H -1.622 -6.285 29.452 1.00 . A A . 9 DT H1' 1 1
1 264 1 1 9 DT H2' H -4.361 -5.112 29.434 1.00 . A A . 9 DT H2' 1 1
1 265 1 1 9 DT H2'' H -3.242 -5.238 30.826 1.00 . A A . 9 DT H2'' 1 1
1 266 1 1 9 DT H3 H 1.417 -3.446 29.236 1.00 . A A . 9 DT H3 1 1
1 267 1 1 9 DT H3' H -4.951 -7.331 30.181 1.00 . A A . 9 DT H3' 1 1
1 268 1 1 9 DT H4' H -2.779 -8.404 28.287 1.00 . A A . 9 DT H4' 1 1
1 269 1 1 9 DT H5' H -4.214 -8.498 26.859 1.00 . A A . 9 DT H5' 1 1
1 270 1 1 9 DT H5'' H -4.857 -9.277 28.305 1.00 . A A . 9 DT H5'' 1 1
1 271 1 1 9 DT H6 H -3.144 -3.594 28.560 1.00 . A A . 9 DT H6 1 1
1 272 1 1 9 DT H71 H -1.893 -0.159 28.902 1.00 . A A . 9 DT H71 1 1
1 273 1 1 9 DT H72 H -3.344 -1.036 28.383 1.00 . A A . 9 DT H72 1 1
1 274 1 1 9 DT H73 H -2.572 -1.426 29.916 1.00 . A A . 9 DT H73 1 1
1 275 1 1 9 DT N1 N -1.568 -4.563 28.421 1.00 . A A . 9 DT N1 1 1
1 276 1 1 9 DT N3 N 0.433 -3.446 28.969 1.00 . A A . 9 DT N3 1 1
1 277 1 1 9 DT O2 O 0.468 -5.683 28.639 1.00 . A A . 9 DT O2 1 1
1 278 1 1 9 DT O3' O -3.050 -7.728 30.960 1.00 . A A . 9 DT O3' 1 1
1 279 1 1 9 DT O4 O 0.282 -1.265 29.490 1.00 . A A . 9 DT O4 1 1
1 280 1 1 9 DT O4' O -2.874 -6.558 27.881 1.00 . A A . 9 DT O4' 1 1
1 281 1 1 9 DT O5' O -5.838 -7.566 27.801 1.00 . A A . 9 DT O5' 1 1
1 282 1 1 9 DT OP1 O -7.011 -9.166 26.257 1.00 . A A . 9 DT OP1 1 1
1 283 1 1 9 DT OP2 O -8.023 -6.874 26.786 1.00 . A A . 9 DT OP2 1 1
1 284 1 1 9 DT P P -6.836 -7.730 26.572 1.00 . A A . 9 DT P 1 1
1 285 1 1 10 DA C1' C 1.393 -7.565 32.897 1.00 . A A . 10 DA C1' 1 1
1 286 1 1 10 DA C2 C 3.796 -3.874 33.475 1.00 . A A . 10 DA C2 1 1
1 287 1 1 10 DA C2' C 0.754 -8.597 33.837 1.00 . A A . 10 DA C2' 1 1
1 288 1 1 10 DA C3' C 1.028 -9.918 33.082 1.00 . A A . 10 DA C3' 1 1
1 289 1 1 10 DA C4 C 1.933 -5.064 33.239 1.00 . A A . 10 DA C4 1 1
1 290 1 1 10 DA C4' C 0.844 -9.454 31.623 1.00 . A A . 10 DA C4' 1 1
1 291 1 1 10 DA C5 C 1.149 -3.938 33.337 1.00 . A A . 10 DA C5 1 1
1 292 1 1 10 DA C5' C -0.554 -9.705 31.030 1.00 . A A . 10 DA C5' 1 1
1 293 1 1 10 DA C6 C 1.814 -2.711 33.534 1.00 . A A . 10 DA C6 1 1
1 294 1 1 10 DA C8 C -0.164 -5.549 33.049 1.00 . A A . 10 DA C8 1 1
1 295 1 1 10 DA H1' H 2.438 -7.543 33.107 1.00 . A A . 10 DA H1' 1 1
1 296 1 1 10 DA H2 H 4.864 -3.815 33.580 1.00 . A A . 10 DA H2 1 1
1 297 1 1 10 DA H2' H -0.315 -8.419 33.925 1.00 . A A . 10 DA H2' 1 1
1 298 1 1 10 DA H2'' H 1.207 -8.566 34.828 1.00 . A A . 10 DA H2'' 1 1
1 299 1 1 10 DA H3' H 0.420 -10.801 33.346 1.00 . A A . 10 DA H3' 1 1
1 300 1 1 10 DA H4' H 1.522 -10.007 30.961 1.00 . A A . 10 DA H4' 1 1
1 301 1 1 10 DA H5' H -0.675 -9.057 30.156 1.00 . A A . 10 DA H5' 1 1
1 302 1 1 10 DA H5'' H -0.634 -10.745 30.703 1.00 . A A . 10 DA H5'' 1 1
1 303 1 1 10 DA H61 H 1.668 -0.704 33.864 1.00 . A A . 10 DA H61 1 1
1 304 1 1 10 DA H62 H 0.146 -1.552 33.661 1.00 . A A . 10 DA H62 1 1
1 305 1 1 10 DA H8 H -1.010 -6.155 32.900 1.00 . A A . 10 DA H8 1 1
1 306 1 1 10 DA N1 N 3.159 -2.711 33.594 1.00 . A A . 10 DA N1 1 1
1 307 1 1 10 DA N3 N 3.292 -5.094 33.302 1.00 . A A . 10 DA N3 1 1
1 308 1 1 10 DA N6 N 1.154 -1.560 33.697 1.00 . A A . 10 DA N6 1 1
1 309 1 1 10 DA N7 N -0.192 -4.259 33.207 1.00 . A A . 10 DA N7 1 1
1 310 1 1 10 DA N9 N 1.063 -6.129 33.079 1.00 . A A . 10 DA N9 1 1
1 311 1 1 10 DA O3' O 2.375 -10.319 33.233 1.00 . A A . 10 DA O3' 1 1
1 312 1 1 10 DA O4' O 1.137 -8.051 31.583 1.00 . A A . 10 DA O4' 1 1
1 313 1 1 10 DA O5' O -1.600 -9.458 31.947 1.00 . A A . 10 DA O5' 1 1
1 314 1 1 10 DA OP1 O -3.308 -10.137 30.239 1.00 . A A . 10 DA OP1 1 1
1 315 1 1 10 DA OP2 O -4.035 -9.404 32.578 1.00 . A A . 10 DA OP2 1 1
1 316 1 1 10 DA P P -3.119 -9.278 31.426 1.00 . A A . 10 DA P 1 1
1 317 1 1 11 DA C1' C 5.497 -6.884 36.104 1.00 . A A . 11 DA C1' 1 1
1 318 1 1 11 DA C2 C 5.198 -2.526 36.322 1.00 . A A . 11 DA C2 1 1
1 319 1 1 11 DA C2' C 5.796 -8.111 36.976 1.00 . A A . 11 DA C2' 1 1
1 320 1 1 11 DA C3' C 6.693 -8.941 36.033 1.00 . A A . 11 DA C3' 1 1
1 321 1 1 11 DA C4 C 4.434 -4.604 36.521 1.00 . A A . 11 DA C4 1 1
1 322 1 1 11 DA C4' C 6.097 -8.609 34.655 1.00 . A A . 11 DA C4' 1 1
1 323 1 1 11 DA C5 C 3.156 -4.168 36.776 1.00 . A A . 11 DA C5 1 1
1 324 1 1 11 DA C5' C 5.188 -9.707 34.079 1.00 . A A . 11 DA C5' 1 1
1 325 1 1 11 DA C6 C 2.958 -2.773 36.788 1.00 . A A . 11 DA C6 1 1
1 326 1 1 11 DA C8 C 3.065 -6.271 36.704 1.00 . A A . 11 DA C8 1 1
1 327 1 1 11 DA H1' H 6.345 -6.224 36.174 1.00 . A A . 11 DA H1' 1 1
1 328 1 1 11 DA H2 H 5.997 -1.842 36.109 1.00 . A A . 11 DA H2 1 1
1 329 1 1 11 DA H2' H 4.892 -8.679 37.187 1.00 . A A . 11 DA H2' 1 1
1 330 1 1 11 DA H2'' H 6.277 -7.820 37.913 1.00 . A A . 11 DA H2'' 1 1
1 331 1 1 11 DA H3' H 6.730 -10.024 36.221 1.00 . A A . 11 DA H3' 1 1
1 332 1 1 11 DA H4' H 6.901 -8.455 33.935 1.00 . A A . 11 DA H4' 1 1
1 333 1 1 11 DA H5' H 4.788 -9.333 33.135 1.00 . A A . 11 DA H5' 1 1
1 334 1 1 11 DA H5'' H 5.715 -10.653 33.868 1.00 . A A . 11 DA H5'' 1 1
1 335 1 1 11 DA H61 H 1.653 -1.215 36.880 1.00 . A A . 11 DA H61 1 1
1 336 1 1 11 DA H62 H 0.948 -2.804 37.116 1.00 . A A . 11 DA H62 1 1
1 337 1 1 11 DA H8 H 2.708 -7.270 36.685 1.00 . A A . 11 DA H8 1 1
1 338 1 1 11 DA N1 N 4.013 -1.970 36.556 1.00 . A A . 11 DA N1 1 1
1 339 1 1 11 DA N3 N 5.517 -3.815 36.282 1.00 . A A . 11 DA N3 1 1
1 340 1 1 11 DA N6 N 1.755 -2.217 36.965 1.00 . A A . 11 DA N6 1 1
1 341 1 1 11 DA N7 N 2.290 -5.243 36.903 1.00 . A A . 11 DA N7 1 1
1 342 1 1 11 DA N9 N 4.382 -5.982 36.487 1.00 . A A . 11 DA N9 1 1
1 343 1 1 11 DA O3' O 8.033 -8.486 36.035 1.00 . A A . 11 DA O3' 1 1
1 344 1 1 11 DA O4' O 5.353 -7.396 34.787 1.00 . A A . 11 DA O4' 1 1
1 345 1 1 11 DA O5' O 4.122 -9.944 34.971 1.00 . A A . 11 DA O5' 1 1
1 346 1 1 11 DA OP1 O 3.589 -12.271 34.262 1.00 . A A . 11 DA OP1 1 1
1 347 1 1 11 DA OP2 O 1.947 -10.913 35.676 1.00 . A A . 11 DA OP2 1 1
1 348 1 1 11 DA P P 2.958 -10.980 34.599 1.00 . A A . 11 DA P 1 1
1 349 1 1 12 DG C1' C 7.908 -3.772 39.198 1.00 . A A . 12 DG C1' 1 1
1 350 1 1 12 DG C2 C 5.051 -0.422 39.530 1.00 . A A . 12 DG C2 1 1
1 351 1 1 12 DG C2' C 8.746 -4.448 40.282 1.00 . A A . 12 DG C2' 1 1
1 352 1 1 12 DG C3' C 9.982 -4.912 39.507 1.00 . A A . 12 DG C3' 1 1
1 353 1 1 12 DG C4 C 5.677 -2.590 39.595 1.00 . A A . 12 DG C4 1 1
1 354 1 1 12 DG C4' C 9.517 -4.920 38.041 1.00 . A A . 12 DG C4' 1 1
1 355 1 1 12 DG C5 C 4.407 -3.055 39.851 1.00 . A A . 12 DG C5 1 1
1 356 1 1 12 DG C5' C 9.793 -6.244 37.261 1.00 . A A . 12 DG C5' 1 1
1 357 1 1 12 DG C6 C 3.333 -2.121 39.974 1.00 . A A . 12 DG C6 1 1
1 358 1 1 12 DG C8 C 5.647 -4.761 39.689 1.00 . A A . 12 DG C8 1 1
1 359 1 1 12 DG H1 H 3.044 -0.076 39.841 1.00 . A A . 12 DG H1 1 1
1 360 1 1 12 DG H1' H 8.217 -2.746 39.051 1.00 . A A . 12 DG H1' 1 1
1 361 1 1 12 DG H2' H 8.228 -5.329 40.663 1.00 . A A . 12 DG H2' 1 1
1 362 1 1 12 DG H2'' H 8.983 -3.776 41.106 1.00 . A A . 12 DG H2'' 1 1
1 363 1 1 12 DG H21 H 4.517 1.545 39.437 1.00 . A A . 12 DG H21 1 1
1 364 1 1 12 DG H22 H 6.210 1.217 39.149 1.00 . A A . 12 DG H22 1 1
1 365 1 1 12 DG H3' H 10.299 -5.899 39.847 1.00 . A A . 12 DG H3' 1 1
1 366 1 1 12 DG H4' H 9.931 -4.035 37.560 1.00 . A A . 12 DG H4' 1 1
1 367 1 1 12 DG H5' H 9.350 -6.153 36.265 1.00 . A A . 12 DG H5' 1 1
1 368 1 1 12 DG H5'' H 10.854 -6.550 37.120 1.00 . A A . 12 DG H5'' 1 1
1 369 1 1 12 DG H8 H 6.084 -5.736 39.623 1.00 . A A . 12 DG H8 1 1
1 370 1 1 12 DG HO3' H 10.746 -3.125 39.363 1.00 . A A . 12 DG HO3' 1 1
1 371 1 1 12 DG N1 N 3.748 -0.801 39.796 1.00 . A A . 12 DG N1 1 1
1 372 1 1 12 DG N2 N 5.281 0.886 39.370 1.00 . A A . 12 DG N2 1 1
1 373 1 1 12 DG N3 N 6.063 -1.296 39.424 1.00 . A A . 12 DG N3 1 1
1 374 1 1 12 DG N7 N 4.400 -4.448 39.900 1.00 . A A . 12 DG N7 1 1
1 375 1 1 12 DG N9 N 6.477 -3.705 39.518 1.00 . A A . 12 DG N9 1 1
1 376 1 1 12 DG O3' O 11.033 -3.982 39.684 1.00 . A A . 12 DG O3' 1 1
1 377 1 1 12 DG O4' O 8.135 -4.601 38.069 1.00 . A A . 12 DG O4' 1 1
1 378 1 1 12 DG O5' O 9.143 -7.305 37.933 1.00 . A A . 12 DG O5' 1 1
1 379 1 1 12 DG O6 O 2.148 -2.356 40.191 1.00 . A A . 12 DG O6 1 1
1 380 1 1 12 DG OP1 O 10.369 -9.109 36.700 1.00 . A A . 12 DG OP1 1 1
1 381 1 1 12 DG OP2 O 8.404 -9.682 38.232 1.00 . A A . 12 DG OP2 1 1
1 382 1 1 12 DG P P 9.041 -8.768 37.265 1.00 . A A . 12 DG P 1 1
1 383 2 2 1 DC C1' C 1.544 5.258 39.443 1.00 . B B . 1 DC C1' 1 1
1 384 2 2 1 DC C2 C 2.375 2.905 39.189 1.00 . B B . 1 DC C2 1 1
1 385 2 2 1 DC C2' C 1.422 6.293 38.312 1.00 . B B . 1 DC C2' 1 1
1 386 2 2 1 DC C3' C 1.240 7.597 39.084 1.00 . B B . 1 DC C3' 1 1
1 387 2 2 1 DC C4 C 0.826 1.149 38.905 1.00 . B B . 1 DC C4 1 1
1 388 2 2 1 DC C4' C 0.597 7.138 40.404 1.00 . B B . 1 DC C4' 1 1
1 389 2 2 1 DC C5 C -0.251 2.080 38.726 1.00 . B B . 1 DC C5 1 1
1 390 2 2 1 DC C5' C -0.819 7.727 40.697 1.00 . B B . 1 DC C5' 1 1
1 391 2 2 1 DC C6 C 0.060 3.394 38.825 1.00 . B B . 1 DC C6 1 1
1 392 2 2 1 DC H1' H 2.531 5.310 39.902 1.00 . B B . 1 DC H1' 1 1
1 393 2 2 1 DC H2' H 0.513 6.259 37.708 1.00 . B B . 1 DC H2' 1 1
1 394 2 2 1 DC H2'' H 2.284 6.262 37.653 1.00 . B B . 1 DC H2'' 1 1
1 395 2 2 1 DC H3' H 0.552 8.245 38.541 1.00 . B B . 1 DC H3' 1 1
1 396 2 2 1 DC H4' H 1.305 7.346 41.204 1.00 . B B . 1 DC H4' 1 1
1 397 2 2 1 DC H41 H 1.311 -0.831 39.073 1.00 . B B . 1 DC H41 1 1
1 398 2 2 1 DC H42 H -0.372 -0.491 38.751 1.00 . B B . 1 DC H42 1 1
1 399 2 2 1 DC H5 H -1.272 1.775 38.542 1.00 . B B . 1 DC H5 1 1
1 400 2 2 1 DC H5' H -1.165 7.311 41.645 1.00 . B B . 1 DC H5' 1 1
1 401 2 2 1 DC H5'' H -0.934 8.832 40.768 1.00 . B B . 1 DC H5'' 1 1
1 402 2 2 1 DC H6 H -0.687 4.153 38.744 1.00 . B B . 1 DC H6 1 1
1 403 2 2 1 DC HO5' H -1.677 6.330 39.659 1.00 . B B . 1 DC HO5' 1 1
1 404 2 2 1 DC N1 N 1.329 3.830 39.071 1.00 . B B . 1 DC N1 1 1
1 405 2 2 1 DC N3 N 2.082 1.572 39.117 1.00 . B B . 1 DC N3 1 1
1 406 2 2 1 DC N4 N 0.572 -0.164 38.896 1.00 . B B . 1 DC N4 1 1
1 407 2 2 1 DC O2 O 3.538 3.264 39.353 1.00 . B B . 1 DC O2 1 1
1 408 2 2 1 DC O3' O 2.476 8.237 39.365 1.00 . B B . 1 DC O3' 1 1
1 409 2 2 1 DC O4' O 0.557 5.715 40.358 1.00 . B B . 1 DC O4' 1 1
1 410 2 2 1 DC O5' O -1.705 7.289 39.690 1.00 . B B . 1 DC O5' 1 1
1 411 2 2 2 DT C1' C 5.835 4.376 36.551 1.00 . B B . 2 DT C1' 1 1
1 412 2 2 2 DT C2 C 5.239 1.900 36.392 1.00 . B B . 2 DT C2 1 1
1 413 2 2 2 DT C2' C 6.096 5.569 35.595 1.00 . B B . 2 DT C2' 1 1
1 414 2 2 2 DT C3' C 6.868 6.522 36.517 1.00 . B B . 2 DT C3' 1 1
1 415 2 2 2 DT C4 C 2.860 1.317 35.973 1.00 . B B . 2 DT C4 1 1
1 416 2 2 2 DT C4' C 6.311 6.198 37.920 1.00 . B B . 2 DT C4' 1 1
1 417 2 2 2 DT C5 C 2.603 2.743 35.907 1.00 . B B . 2 DT C5 1 1
1 418 2 2 2 DT C5' C 5.480 7.318 38.603 1.00 . B B . 2 DT C5' 1 1
1 419 2 2 2 DT C6 C 3.632 3.607 36.048 1.00 . B B . 2 DT C6 1 1
1 420 2 2 2 DT C7 C 1.208 3.276 35.651 1.00 . B B . 2 DT C7 1 1
1 421 2 2 2 DT H1' H 6.711 3.808 36.528 1.00 . B B . 2 DT H1' 1 1
1 422 2 2 2 DT H2' H 5.275 6.211 35.266 1.00 . B B . 2 DT H2' 1 1
1 423 2 2 2 DT H2'' H 6.656 5.249 34.717 1.00 . B B . 2 DT H2'' 1 1
1 424 2 2 2 DT H3 H 4.397 0.010 36.342 1.00 . B B . 2 DT H3 1 1
1 425 2 2 2 DT H3' H 6.695 7.575 36.260 1.00 . B B . 2 DT H3' 1 1
1 426 2 2 2 DT H4' H 7.150 5.961 38.573 1.00 . B B . 2 DT H4' 1 1
1 427 2 2 2 DT H5' H 5.046 6.900 39.513 1.00 . B B . 2 DT H5' 1 1
1 428 2 2 2 DT H5'' H 6.077 8.198 38.899 1.00 . B B . 2 DT H5'' 1 1
1 429 2 2 2 DT H6 H 3.611 4.648 36.105 1.00 . B B . 2 DT H6 1 1
1 430 2 2 2 DT H71 H 0.462 2.564 36.001 1.00 . B B . 2 DT H71 1 1
1 431 2 2 2 DT H72 H 1.065 4.225 36.167 1.00 . B B . 2 DT H72 1 1
1 432 2 2 2 DT H73 H 1.069 3.430 34.582 1.00 . B B . 2 DT H73 1 1
1 433 2 2 2 DT N1 N 4.904 3.254 36.240 1.00 . B B . 2 DT N1 1 1
1 434 2 2 2 DT N3 N 4.187 0.995 36.243 1.00 . B B . 2 DT N3 1 1
1 435 2 2 2 DT O2 O 6.373 1.497 36.644 1.00 . B B . 2 DT O2 1 1
1 436 2 2 2 DT O3' O 8.258 6.249 36.501 1.00 . B B . 2 DT O3' 1 1
1 437 2 2 2 DT O4 O 2.021 0.433 35.819 1.00 . B B . 2 DT O4 1 1
1 438 2 2 2 DT O4' O 5.561 4.990 37.804 1.00 . B B . 2 DT O4' 1 1
1 439 2 2 2 DT O5' O 4.429 7.759 37.763 1.00 . B B . 2 DT O5' 1 1
1 440 2 2 2 DT OP1 O 4.171 10.000 38.886 1.00 . B B . 2 DT OP1 1 1
1 441 2 2 2 DT OP2 O 2.552 9.263 37.065 1.00 . B B . 2 DT OP2 1 1
1 442 2 2 2 DT P P 3.400 8.922 38.230 1.00 . B B . 2 DT P 1 1
1 443 2 2 3 DT C1' C 8.414 1.435 33.594 1.00 . B B . 3 DT C1' 1 1
1 444 2 2 3 DT C2 C 6.435 -0.090 33.683 1.00 . B B . 3 DT C2 1 1
1 445 2 2 3 DT C2' C 9.069 2.393 32.582 1.00 . B B . 3 DT C2' 1 1
1 446 2 2 3 DT C3' C 10.435 2.640 33.204 1.00 . B B . 3 DT C3' 1 1
1 447 2 2 3 DT C4 C 4.166 0.683 33.080 1.00 . B B . 3 DT C4 1 1
1 448 2 2 3 DT C4' C 10.115 2.620 34.713 1.00 . B B . 3 DT C4' 1 1
1 449 2 2 3 DT C5 C 4.734 2.008 32.943 1.00 . B B . 3 DT C5 1 1
1 450 2 2 3 DT C5' C 10.130 4.016 35.382 1.00 . B B . 3 DT C5' 1 1
1 451 2 2 3 DT C6 C 6.068 2.205 33.099 1.00 . B B . 3 DT C6 1 1
1 452 2 2 3 DT C7 C 3.813 3.193 32.705 1.00 . B B . 3 DT C7 1 1
1 453 2 2 3 DT H1' H 8.846 0.432 33.430 1.00 . B B . 3 DT H1' 1 1
1 454 2 2 3 DT H2' H 8.837 3.447 32.516 1.00 . B B . 3 DT H2' 1 1
1 455 2 2 3 DT H2'' H 8.933 2.018 31.579 1.00 . B B . 3 DT H2'' 1 1
1 456 2 2 3 DT H3 H 4.688 -1.218 33.616 1.00 . B B . 3 DT H3 1 1
1 457 2 2 3 DT H3' H 10.760 3.640 32.907 1.00 . B B . 3 DT H3' 1 1
1 458 2 2 3 DT H4' H 10.887 2.065 35.260 1.00 . B B . 3 DT H4' 1 1
1 459 2 2 3 DT H5' H 9.702 3.911 36.380 1.00 . B B . 3 DT H5' 1 1
1 460 2 2 3 DT H5'' H 11.153 4.403 35.496 1.00 . B B . 3 DT H5'' 1 1
1 461 2 2 3 DT H6 H 6.466 3.166 32.883 1.00 . B B . 3 DT H6 1 1
1 462 2 2 3 DT H71 H 3.823 3.442 31.643 1.00 . B B . 3 DT H71 1 1
1 463 2 2 3 DT H72 H 2.791 2.956 32.998 1.00 . B B . 3 DT H72 1 1
1 464 2 2 3 DT H73 H 4.154 4.058 33.274 1.00 . B B . 3 DT H73 1 1
1 465 2 2 3 DT N1 N 6.934 1.201 33.451 1.00 . B B . 3 DT N1 1 1
1 466 2 2 3 DT N3 N 5.072 -0.290 33.467 1.00 . B B . 3 DT N3 1 1
1 467 2 2 3 DT O2 O 7.139 -1.023 34.053 1.00 . B B . 3 DT O2 1 1
1 468 2 2 3 DT O3' O 11.394 1.652 32.886 1.00 . B B . 3 DT O3' 1 1
1 469 2 2 3 DT O4 O 2.991 0.396 32.881 1.00 . B B . 3 DT O4 1 1
1 470 2 2 3 DT O4' O 8.829 1.985 34.847 1.00 . B B . 3 DT O4' 1 1
1 471 2 2 3 DT O5' O 9.379 4.967 34.652 1.00 . B B . 3 DT O5' 1 1
1 472 2 2 3 DT OP1 O 10.491 7.005 35.637 1.00 . B B . 3 DT OP1 1 1
1 473 2 2 3 DT OP2 O 8.415 7.224 34.170 1.00 . B B . 3 DT OP2 1 1
1 474 2 2 3 DT P P 9.185 6.482 35.191 1.00 . B B . 3 DT P 1 1
1 475 2 2 4 DA C1' C 8.703 -2.550 30.209 1.00 . B B . 4 DA C1' 1 1
1 476 2 2 4 DA C2 C 4.501 -3.924 29.681 1.00 . B B . 4 DA C2 1 1
1 477 2 2 4 DA C2' C 9.816 -2.525 29.156 1.00 . B B . 4 DA C2' 1 1
1 478 2 2 4 DA C3' C 11.071 -2.924 29.955 1.00 . B B . 4 DA C3' 1 1
1 479 2 2 4 DA C4 C 6.166 -2.431 29.737 1.00 . B B . 4 DA C4 1 1
1 480 2 2 4 DA C4' C 10.764 -2.383 31.362 1.00 . B B . 4 DA C4' 1 1
1 481 2 2 4 DA C5 C 5.304 -1.397 29.458 1.00 . B B . 4 DA C5 1 1
1 482 2 2 4 DA C5' C 11.569 -1.140 31.759 1.00 . B B . 4 DA C5' 1 1
1 483 2 2 4 DA C6 C 3.951 -1.736 29.234 1.00 . B B . 4 DA C6 1 1
1 484 2 2 4 DA C8 C 7.197 -0.526 29.795 1.00 . B B . 4 DA C8 1 1
1 485 2 2 4 DA H1' H 8.322 -3.546 30.273 1.00 . B B . 4 DA H1' 1 1
1 486 2 2 4 DA H2 H 4.150 -4.937 29.807 1.00 . B B . 4 DA H2 1 1
1 487 2 2 4 DA H2' H 9.871 -1.563 28.665 1.00 . B B . 4 DA H2' 1 1
1 488 2 2 4 DA H2'' H 9.646 -3.245 28.382 1.00 . B B . 4 DA H2'' 1 1
1 489 2 2 4 DA H3' H 12.038 -2.585 29.554 1.00 . B B . 4 DA H3' 1 1
1 490 2 2 4 DA H4' H 11.116 -3.095 32.130 1.00 . B B . 4 DA H4' 1 1
1 491 2 2 4 DA H5' H 11.336 -0.935 32.806 1.00 . B B . 4 DA H5' 1 1
1 492 2 2 4 DA H5'' H 12.640 -1.354 31.689 1.00 . B B . 4 DA H5'' 1 1
1 493 2 2 4 DA H61 H 2.073 -1.085 28.768 1.00 . B B . 4 DA H61 1 1
1 494 2 2 4 DA H62 H 3.312 0.150 28.825 1.00 . B B . 4 DA H62 1 1
1 495 2 2 4 DA H8 H 7.997 0.150 29.962 1.00 . B B . 4 DA H8 1 1
1 496 2 2 4 DA N1 N 3.567 -3.024 29.367 1.00 . B B . 4 DA N1 1 1
1 497 2 2 4 DA N3 N 5.808 -3.741 29.872 1.00 . B B . 4 DA N3 1 1
1 498 2 2 4 DA N6 N 3.036 -0.817 28.912 1.00 . B B . 4 DA N6 1 1
1 499 2 2 4 DA N7 N 5.972 -0.181 29.514 1.00 . B B . 4 DA N7 1 1
1 500 2 2 4 DA N9 N 7.423 -1.863 29.885 1.00 . B B . 4 DA N9 1 1
1 501 2 2 4 DA O3' O 11.145 -4.335 30.051 1.00 . B B . 4 DA O3' 1 1
1 502 2 2 4 DA O4' O 9.346 -2.134 31.421 1.00 . B B . 4 DA O4' 1 1
1 503 2 2 4 DA O5' O 11.270 0.008 30.993 1.00 . B B . 4 DA O5' 1 1
1 504 2 2 4 DA OP1 O 13.413 1.232 31.469 1.00 . B B . 4 DA OP1 1 1
1 505 2 2 4 DA OP2 O 11.398 2.464 30.490 1.00 . B B . 4 DA OP2 1 1
1 506 2 2 4 DA P P 11.947 1.422 31.380 1.00 . B B . 4 DA P 1 1
1 507 2 2 5 DA C1' C 6.881 -7.048 27.720 1.00 . B B . 5 DA C1' 1 1
1 508 2 2 5 DA C2 C 2.789 -5.979 26.419 1.00 . B B . 5 DA C2 1 1
1 509 2 2 5 DA C2' C 7.983 -7.848 27.014 1.00 . B B . 5 DA C2' 1 1
1 510 2 2 5 DA C3' C 8.515 -8.708 28.175 1.00 . B B . 5 DA C3' 1 1
1 511 2 2 5 DA C4 C 4.981 -5.682 26.658 1.00 . B B . 5 DA C4 1 1
1 512 2 2 5 DA C4' C 8.440 -7.707 29.346 1.00 . B B . 5 DA C4' 1 1
1 513 2 2 5 DA C5 C 4.930 -4.439 26.071 1.00 . B B . 5 DA C5 1 1
1 514 2 2 5 DA C5' C 9.752 -6.968 29.675 1.00 . B B . 5 DA C5' 1 1
1 515 2 2 5 DA C6 C 3.661 -3.981 25.669 1.00 . B B . 5 DA C6 1 1
1 516 2 2 5 DA C8 C 6.941 -4.776 26.559 1.00 . B B . 5 DA C8 1 1
1 517 2 2 5 DA H1' H 5.998 -7.648 27.794 1.00 . B B . 5 DA H1' 1 1
1 518 2 2 5 DA H2 H 1.899 -6.575 26.548 1.00 . B B . 5 DA H2 1 1
1 519 2 2 5 DA H2' H 8.767 -7.183 26.652 1.00 . B B . 5 DA H2' 1 1
1 520 2 2 5 DA H2'' H 7.584 -8.445 26.193 1.00 . B B . 5 DA H2'' 1 1
1 521 2 2 5 DA H3' H 9.521 -9.140 28.056 1.00 . B B . 5 DA H3' 1 1
1 522 2 2 5 DA H4' H 8.222 -8.238 30.284 1.00 . B B . 5 DA H4' 1 1
1 523 2 2 5 DA H5' H 9.526 -6.294 30.505 1.00 . B B . 5 DA H5' 1 1
1 524 2 2 5 DA H5'' H 10.525 -7.671 30.011 1.00 . B B . 5 DA H5'' 1 1
1 525 2 2 5 DA H61 H 2.523 -2.442 24.968 1.00 . B B . 5 DA H61 1 1
1 526 2 2 5 DA H62 H 4.251 -2.149 25.007 1.00 . B B . 5 DA H62 1 1
1 527 2 2 5 DA H8 H 7.983 -4.698 26.682 1.00 . B B . 5 DA H8 1 1
1 528 2 2 5 DA N1 N 2.605 -4.793 25.850 1.00 . B B . 5 DA N1 1 1
1 529 2 2 5 DA N3 N 3.921 -6.514 26.872 1.00 . B B . 5 DA N3 1 1
1 530 2 2 5 DA N6 N 3.463 -2.765 25.148 1.00 . B B . 5 DA N6 1 1
1 531 2 2 5 DA N7 N 6.190 -3.868 26.010 1.00 . B B . 5 DA N7 1 1
1 532 2 2 5 DA N9 N 6.304 -5.892 26.995 1.00 . B B . 5 DA N9 1 1
1 533 2 2 5 DA O3' O 7.617 -9.778 28.424 1.00 . B B . 5 DA O3' 1 1
1 534 2 2 5 DA O4' O 7.415 -6.757 29.012 1.00 . B B . 5 DA O4' 1 1
1 535 2 2 5 DA O5' O 10.257 -6.192 28.603 1.00 . B B . 5 DA O5' 1 1
1 536 2 2 5 DA OP1 O 12.683 -6.149 29.283 1.00 . B B . 5 DA OP1 1 1
1 537 2 2 5 DA OP2 O 11.783 -4.446 27.605 1.00 . B B . 5 DA OP2 1 1
1 538 2 2 5 DA P P 11.584 -5.283 28.813 1.00 . B B . 5 DA P 1 1
1 539 2 2 6 DT C1' C 3.307 -9.834 24.782 1.00 . B B . 6 DT C1' 1 1
1 540 2 2 6 DT C2 C 2.866 -7.732 23.476 1.00 . B B . 6 DT C2 1 1
1 541 2 2 6 DT C2' C 3.587 -11.284 24.338 1.00 . B B . 6 DT C2' 1 1
1 542 2 2 6 DT C3' C 3.370 -12.048 25.650 1.00 . B B . 6 DT C3' 1 1
1 543 2 2 6 DT C4 C 4.798 -6.338 22.791 1.00 . B B . 6 DT C4 1 1
1 544 2 2 6 DT C4' C 3.710 -11.001 26.738 1.00 . B B . 6 DT C4' 1 1
1 545 2 2 6 DT C5 C 5.646 -7.366 23.351 1.00 . B B . 6 DT C5 1 1
1 546 2 2 6 DT C5' C 4.954 -11.253 27.649 1.00 . B B . 6 DT C5' 1 1
1 547 2 2 6 DT C6 C 5.091 -8.481 23.884 1.00 . B B . 6 DT C6 1 1
1 548 2 2 6 DT C7 C 7.147 -7.175 23.334 1.00 . B B . 6 DT C7 1 1
1 549 2 2 6 DT H1' H 2.244 -9.711 24.828 1.00 . B B . 6 DT H1' 1 1
1 550 2 2 6 DT H2' H 4.553 -11.627 23.967 1.00 . B B . 6 DT H2' 1 1
1 551 2 2 6 DT H2'' H 2.902 -11.497 23.542 1.00 . B B . 6 DT H2'' 1 1
1 552 2 2 6 DT H3 H 2.802 -5.900 22.561 1.00 . B B . 6 DT H3 1 1
1 553 2 2 6 DT H3' H 4.023 -12.925 25.732 1.00 . B B . 6 DT H3' 1 1
1 554 2 2 6 DT H4' H 2.810 -10.857 27.330 1.00 . B B . 6 DT H4' 1 1
1 555 2 2 6 DT H5' H 4.997 -10.432 28.373 1.00 . B B . 6 DT H5' 1 1
1 556 2 2 6 DT H5'' H 4.975 -12.203 28.225 1.00 . B B . 6 DT H5'' 1 1
1 557 2 2 6 DT H6 H 5.610 -9.256 24.379 1.00 . B B . 6 DT H6 1 1
1 558 2 2 6 DT H71 H 7.391 -6.246 23.848 1.00 . B B . 6 DT H71 1 1
1 559 2 2 6 DT H72 H 7.650 -8.004 23.832 1.00 . B B . 6 DT H72 1 1
1 560 2 2 6 DT H73 H 7.485 -7.120 22.299 1.00 . B B . 6 DT H73 1 1
1 561 2 2 6 DT N1 N 3.759 -8.705 23.932 1.00 . B B . 6 DT N1 1 1
1 562 2 2 6 DT N3 N 3.440 -6.597 22.917 1.00 . B B . 6 DT N3 1 1
1 563 2 2 6 DT O2 O 1.643 -7.833 23.549 1.00 . B B . 6 DT O2 1 1
1 564 2 2 6 DT O3' O 2.005 -12.431 25.784 1.00 . B B . 6 DT O3' 1 1
1 565 2 2 6 DT O4 O 5.191 -5.307 22.253 1.00 . B B . 6 DT O4 1 1
1 566 2 2 6 DT O4' O 3.868 -9.752 26.081 1.00 . B B . 6 DT O4' 1 1
1 567 2 2 6 DT O5' O 6.130 -11.164 26.864 1.00 . B B . 6 DT O5' 1 1
1 568 2 2 6 DT OP1 O 7.710 -12.277 28.474 1.00 . B B . 6 DT OP1 1 1
1 569 2 2 6 DT OP2 O 8.590 -11.007 26.443 1.00 . B B . 6 DT OP2 1 1
1 570 2 2 6 DT P P 7.605 -11.141 27.537 1.00 . B B . 6 DT P 1 1
1 571 2 2 7 DT C1' C -0.294 -9.750 21.105 1.00 . B B . 7 DT C1' 1 1
1 572 2 2 7 DT C2 C 0.743 -7.626 20.214 1.00 . B B . 7 DT C2 1 1
1 573 2 2 7 DT C2' C -0.623 -11.106 20.467 1.00 . B B . 7 DT C2' 1 1
1 574 2 2 7 DT C3' C -1.512 -11.778 21.510 1.00 . B B . 7 DT C3' 1 1
1 575 2 2 7 DT C4 C 3.209 -7.549 19.992 1.00 . B B . 7 DT C4 1 1
1 576 2 2 7 DT C4' C -1.163 -11.059 22.832 1.00 . B B . 7 DT C4' 1 1
1 577 2 2 7 DT C5 C 3.224 -8.929 20.445 1.00 . B B . 7 DT C5 1 1
1 578 2 2 7 DT C5' C -0.633 -11.913 24.016 1.00 . B B . 7 DT C5' 1 1
1 579 2 2 7 DT C6 C 2.055 -9.548 20.731 1.00 . B B . 7 DT C6 1 1
1 580 2 2 7 DT C7 C 4.535 -9.676 20.598 1.00 . B B . 7 DT C7 1 1
1 581 2 2 7 DT H1' H -1.100 -9.122 20.813 1.00 . B B . 7 DT H1' 1 1
1 582 2 2 7 DT H2' H 0.051 -11.811 19.979 1.00 . B B . 7 DT H2' 1 1
1 583 2 2 7 DT H2'' H -1.169 -10.805 19.636 1.00 . B B . 7 DT H2'' 1 1
1 584 2 2 7 DT H3 H 1.862 -6.003 19.678 1.00 . B B . 7 DT H3 1 1
1 585 2 2 7 DT H3' H -1.282 -12.841 21.574 1.00 . B B . 7 DT H3' 1 1
1 586 2 2 7 DT H4' H -2.064 -10.557 23.189 1.00 . B B . 7 DT H4' 1 1
1 587 2 2 7 DT H5' H -0.365 -11.214 24.812 1.00 . B B . 7 DT H5' 1 1
1 588 2 2 7 DT H5'' H -1.382 -12.617 24.418 1.00 . B B . 7 DT H5'' 1 1
1 589 2 2 7 DT H6 H 1.891 -10.516 21.124 1.00 . B B . 7 DT H6 1 1
1 590 2 2 7 DT H71 H 5.344 -8.980 20.819 1.00 . B B . 7 DT H71 1 1
1 591 2 2 7 DT H72 H 4.463 -10.402 21.408 1.00 . B B . 7 DT H72 1 1
1 592 2 2 7 DT H73 H 4.761 -10.199 19.668 1.00 . B B . 7 DT H73 1 1
1 593 2 2 7 DT N1 N 0.856 -8.962 20.611 1.00 . B B . 7 DT N1 1 1
1 594 2 2 7 DT N3 N 1.942 -6.974 19.950 1.00 . B B . 7 DT N3 1 1
1 595 2 2 7 DT O2 O -0.328 -7.039 20.070 1.00 . B B . 7 DT O2 1 1
1 596 2 2 7 DT O3' O -2.887 -11.555 21.201 1.00 . B B . 7 DT O3' 1 1
1 597 2 2 7 DT O4 O 4.197 -6.892 19.671 1.00 . B B . 7 DT O4 1 1
1 598 2 2 7 DT O4' O -0.237 -10.024 22.501 1.00 . B B . 7 DT O4' 1 1
1 599 2 2 7 DT O5' O 0.534 -12.647 23.691 1.00 . B B . 7 DT O5' 1 1
1 600 2 2 7 DT OP1 O 0.271 -14.233 25.628 1.00 . B B . 7 DT OP1 1 1
1 601 2 2 7 DT OP2 O 2.356 -14.322 24.163 1.00 . B B . 7 DT OP2 1 1
1 602 2 2 7 DT P P 1.297 -13.530 24.822 1.00 . B B . 7 DT P 1 1
1 603 2 2 8 DC C1' C -2.611 -7.442 17.087 1.00 . B B . 8 DC C1' 1 1
1 604 2 2 8 DC C2 C -0.506 -6.164 16.583 1.00 . B B . 8 DC C2 1 1
1 605 2 2 8 DC C2' C -3.418 -8.382 16.174 1.00 . B B . 8 DC C2' 1 1
1 606 2 2 8 DC C3' C -4.723 -8.564 16.947 1.00 . B B . 8 DC C3' 1 1
1 607 2 2 8 DC C4 C 1.595 -7.199 16.872 1.00 . B B . 8 DC C4 1 1
1 608 2 2 8 DC C4' C -4.275 -8.415 18.414 1.00 . B B . 8 DC C4' 1 1
1 609 2 2 8 DC C5 C 0.980 -8.459 17.171 1.00 . B B . 8 DC C5 1 1
1 610 2 2 8 DC C5' C -4.441 -9.655 19.343 1.00 . B B . 8 DC C5' 1 1
1 611 2 2 8 DC C6 C -0.374 -8.500 17.104 1.00 . B B . 8 DC C6 1 1
1 612 2 2 8 DC H1' H -2.985 -6.412 16.974 1.00 . B B . 8 DC H1' 1 1
1 613 2 2 8 DC H2' H -3.094 -9.401 15.991 1.00 . B B . 8 DC H2' 1 1
1 614 2 2 8 DC H2'' H -3.490 -7.945 15.203 1.00 . B B . 8 DC H2'' 1 1
1 615 2 2 8 DC H3' H -5.126 -9.562 16.777 1.00 . B B . 8 DC H3' 1 1
1 616 2 2 8 DC H4' H -4.861 -7.610 18.859 1.00 . B B . 8 DC H4' 1 1
1 617 2 2 8 DC H41 H 3.348 -6.212 16.602 1.00 . B B . 8 DC H41 1 1
1 618 2 2 8 DC H42 H 3.507 -7.895 17.059 1.00 . B B . 8 DC H42 1 1
1 619 2 2 8 DC H5 H 1.536 -9.318 17.533 1.00 . B B . 8 DC H5 1 1
1 620 2 2 8 DC H5' H -4.058 -9.349 20.319 1.00 . B B . 8 DC H5' 1 1
1 621 2 2 8 DC H5'' H -5.489 -9.976 19.485 1.00 . B B . 8 DC H5'' 1 1
1 622 2 2 8 DC H6 H -0.892 -9.423 17.235 1.00 . B B . 8 DC H6 1 1
1 623 2 2 8 DC N1 N -1.135 -7.394 16.836 1.00 . B B . 8 DC N1 1 1
1 624 2 2 8 DC N3 N 0.857 -6.117 16.588 1.00 . B B . 8 DC N3 1 1
1 625 2 2 8 DC N4 N 2.927 -7.097 16.848 1.00 . B B . 8 DC N4 1 1
1 626 2 2 8 DC O2 O -1.138 -5.134 16.354 1.00 . B B . 8 DC O2 1 1
1 627 2 2 8 DC O3' O -5.679 -7.567 16.605 1.00 . B B . 8 DC O3' 1 1
1 628 2 2 8 DC O4' O -2.916 -7.965 18.378 1.00 . B B . 8 DC O4' 1 1
1 629 2 2 8 DC O5' O -3.692 -10.790 18.928 1.00 . B B . 8 DC O5' 1 1
1 630 2 2 8 DC OP1 O -5.001 -12.513 20.218 1.00 . B B . 8 DC OP1 1 1
1 631 2 2 8 DC OP2 O -2.732 -13.110 19.202 1.00 . B B . 8 DC OP2 1 1
1 632 2 2 8 DC P P -3.618 -12.125 19.859 1.00 . B B . 8 DC P 1 1
1 633 2 2 9 DG C1' C -2.668 -3.904 13.188 1.00 . B B . 9 DG C1' 1 1
1 634 2 2 9 DG C2 C 1.416 -2.388 12.291 1.00 . B B . 9 DG C2 1 1
1 635 2 2 9 DG C2' C -3.732 -4.334 12.172 1.00 . B B . 9 DG C2' 1 1
1 636 2 2 9 DG C3' C -4.989 -3.670 12.760 1.00 . B B . 9 DG C3' 1 1
1 637 2 2 9 DG C4 C -0.117 -3.964 12.816 1.00 . B B . 9 DG C4 1 1
1 638 2 2 9 DG C4' C -4.746 -3.854 14.272 1.00 . B B . 9 DG C4' 1 1
1 639 2 2 9 DG C5 C 0.807 -4.984 12.800 1.00 . B B . 9 DG C5 1 1
1 640 2 2 9 DG C5' C -5.612 -4.927 14.978 1.00 . B B . 9 DG C5' 1 1
1 641 2 2 9 DG C6 C 2.172 -4.710 12.494 1.00 . B B . 9 DG C6 1 1
1 642 2 2 9 DG C8 C -1.052 -5.866 13.233 1.00 . B B . 9 DG C8 1 1
1 643 2 2 9 DG H1 H 3.345 -3.096 12.006 1.00 . B B . 9 DG H1 1 1
1 644 2 2 9 DG H1' H -2.383 -2.887 12.999 1.00 . B B . 9 DG H1' 1 1
1 645 2 2 9 DG H2' H -3.867 -5.416 12.182 1.00 . B B . 9 DG H2' 1 1
1 646 2 2 9 DG H2'' H -3.493 -3.997 11.165 1.00 . B B . 9 DG H2'' 1 1
1 647 2 2 9 DG H21 H 2.756 -0.927 11.793 1.00 . B B . 9 DG H21 1 1
1 648 2 2 9 DG H22 H 1.114 -0.389 12.067 1.00 . B B . 9 DG H22 1 1
1 649 2 2 9 DG H3' H -5.952 -4.083 12.429 1.00 . B B . 9 DG H3' 1 1
1 650 2 2 9 DG H4' H -5.027 -2.930 14.790 1.00 . B B . 9 DG H4' 1 1
1 651 2 2 9 DG H5' H -5.299 -4.949 16.023 1.00 . B B . 9 DG H5' 1 1
1 652 2 2 9 DG H5'' H -6.675 -4.646 14.962 1.00 . B B . 9 DG H5'' 1 1
1 653 2 2 9 DG H8 H -1.830 -6.538 13.450 1.00 . B B . 9 DG H8 1 1
1 654 2 2 9 DG N1 N 2.395 -3.361 12.237 1.00 . B B . 9 DG N1 1 1
1 655 2 2 9 DG N2 N 1.794 -1.135 12.024 1.00 . B B . 9 DG N2 1 1
1 656 2 2 9 DG N3 N 0.131 -2.648 12.582 1.00 . B B . 9 DG N3 1 1
1 657 2 2 9 DG N7 N 0.196 -6.195 13.079 1.00 . B B . 9 DG N7 1 1
1 658 2 2 9 DG N9 N -1.339 -4.552 13.088 1.00 . B B . 9 DG N9 1 1
1 659 2 2 9 DG O3' O -4.998 -2.279 12.475 1.00 . B B . 9 DG O3' 1 1
1 660 2 2 9 DG O4' O -3.337 -4.086 14.437 1.00 . B B . 9 DG O4' 1 1
1 661 2 2 9 DG O5' O -5.497 -6.242 14.454 1.00 . B B . 9 DG O5' 1 1
1 662 2 2 9 DG O6 O 3.106 -5.506 12.433 1.00 . B B . 9 DG O6 1 1
1 663 2 2 9 DG OP1 O -7.749 -7.027 15.264 1.00 . B B . 9 DG OP1 1 1
1 664 2 2 9 DG OP2 O -6.041 -8.711 14.390 1.00 . B B . 9 DG OP2 1 1
1 665 2 2 9 DG P P -6.341 -7.462 15.124 1.00 . B B . 9 DG P 1 1
1 666 2 2 10 DT C1' C -0.144 -0.586 9.594 1.00 . B B . 10 DT C1' 1 1
1 667 2 2 10 DT C2 C 1.790 -2.052 8.907 1.00 . B B . 10 DT C2 1 1
1 668 2 2 10 DT C2' C -1.117 -0.035 8.559 1.00 . B B . 10 DT C2' 1 1
1 669 2 2 10 DT C3' C -1.920 0.993 9.355 1.00 . B B . 10 DT C3' 1 1
1 670 2 2 10 DT C4 C 1.521 -4.510 9.065 1.00 . B B . 10 DT C4 1 1
1 671 2 2 10 DT C4' C -1.886 0.442 10.786 1.00 . B B . 10 DT C4' 1 1
1 672 2 2 10 DT C5 C 0.130 -4.266 9.412 1.00 . B B . 10 DT C5 1 1
1 673 2 2 10 DT C5' C -3.250 -0.008 11.362 1.00 . B B . 10 DT C5' 1 1
1 674 2 2 10 DT C6 C -0.338 -2.993 9.472 1.00 . B B . 10 DT C6 1 1
1 675 2 2 10 DT C7 C -0.783 -5.438 9.728 1.00 . B B . 10 DT C7 1 1
1 676 2 2 10 DT H1' H 0.690 0.063 9.732 1.00 . B B . 10 DT H1' 1 1
1 677 2 2 10 DT H2' H -1.727 -0.830 8.143 1.00 . B B . 10 DT H2' 1 1
1 678 2 2 10 DT H2'' H -0.642 0.460 7.740 1.00 . B B . 10 DT H2'' 1 1
1 679 2 2 10 DT H3 H 3.237 -3.492 8.576 1.00 . B B . 10 DT H3 1 1
1 680 2 2 10 DT H3' H -2.938 1.098 8.977 1.00 . B B . 10 DT H3' 1 1
1 681 2 2 10 DT H4' H -1.488 1.212 11.448 1.00 . B B . 10 DT H4' 1 1
1 682 2 2 10 DT H5' H -3.072 -0.365 12.378 1.00 . B B . 10 DT H5' 1 1
1 683 2 2 10 DT H5'' H -3.989 0.810 11.423 1.00 . B B . 10 DT H5'' 1 1
1 684 2 2 10 DT H6 H -1.326 -2.694 9.751 1.00 . B B . 10 DT H6 1 1
1 685 2 2 10 DT H71 H -1.637 -5.112 10.319 1.00 . B B . 10 DT H71 1 1
1 686 2 2 10 DT H72 H -1.144 -5.869 8.794 1.00 . B B . 10 DT H72 1 1
1 687 2 2 10 DT H73 H -0.236 -6.201 10.281 1.00 . B B . 10 DT H73 1 1
1 688 2 2 10 DT N1 N 0.440 -1.909 9.246 1.00 . B B . 10 DT N1 1 1
1 689 2 2 10 DT N3 N 2.263 -3.359 8.821 1.00 . B B . 10 DT N3 1 1
1 690 2 2 10 DT O2 O 2.543 -1.103 8.702 1.00 . B B . 10 DT O2 1 1
1 691 2 2 10 DT O3' O -1.256 2.251 9.386 1.00 . B B . 10 DT O3' 1 1
1 692 2 2 10 DT O4 O 2.052 -5.615 8.982 1.00 . B B . 10 DT O4 1 1
1 693 2 2 10 DT O4' O -0.930 -0.614 10.787 1.00 . B B . 10 DT O4' 1 1
1 694 2 2 10 DT O5' O -3.802 -1.070 10.606 1.00 . B B . 10 DT O5' 1 1
1 695 2 2 10 DT OP1 O -6.215 -0.574 11.094 1.00 . B B . 10 DT OP1 1 1
1 696 2 2 10 DT OP2 O -5.525 -2.813 10.064 1.00 . B B . 10 DT OP2 1 1
1 697 2 2 10 DT P P -5.247 -1.689 10.986 1.00 . B B . 10 DT P 1 1
1 698 2 2 11 DG C1' C 3.908 1.584 6.567 1.00 . B B . 11 DG C1' 1 1
1 699 2 2 11 DG C2 C 6.846 -1.375 5.022 1.00 . B B . 11 DG C2 1 1
1 700 2 2 11 DG C2' C 3.306 2.819 5.898 1.00 . B B . 11 DG C2' 1 1
1 701 2 2 11 DG C3' C 3.313 3.886 6.992 1.00 . B B . 11 DG C3' 1 1
1 702 2 2 11 DG C4 C 4.780 -0.519 5.378 1.00 . B B . 11 DG C4 1 1
1 703 2 2 11 DG C4' C 2.954 2.996 8.195 1.00 . B B . 11 DG C4' 1 1
1 704 2 2 11 DG C5 C 4.144 -1.572 4.760 1.00 . B B . 11 DG C5 1 1
1 705 2 2 11 DG C5' C 1.515 3.176 8.722 1.00 . B B . 11 DG C5' 1 1
1 706 2 2 11 DG C6 C 4.909 -2.613 4.169 1.00 . B B . 11 DG C6 1 1
1 707 2 2 11 DG C8 C 2.632 -0.385 5.596 1.00 . B B . 11 DG C8 1 1
1 708 2 2 11 DG H1 H 6.867 -3.204 4.060 1.00 . B B . 11 DG H1 1 1
1 709 2 2 11 DG H1' H 4.967 1.646 6.678 1.00 . B B . 11 DG H1' 1 1
1 710 2 2 11 DG H2' H 2.356 2.529 5.631 1.00 . B B . 11 DG H2' 1 1
1 711 2 2 11 DG H2'' H 3.268 3.077 4.877 1.00 . B B . 11 DG H2'' 1 1
1 712 2 2 11 DG H21 H 8.692 -2.236 4.878 1.00 . B B . 11 DG H21 1 1
1 713 2 2 11 DG H22 H 8.642 -0.674 5.677 1.00 . B B . 11 DG H22 1 1
1 714 2 2 11 DG H3' H 2.625 4.728 6.837 1.00 . B B . 11 DG H3' 1 1
1 715 2 2 11 DG H4' H 3.578 3.289 9.040 1.00 . B B . 11 DG H4' 1 1
1 716 2 2 11 DG H5' H 1.377 2.473 9.544 1.00 . B B . 11 DG H5' 1 1
1 717 2 2 11 DG H5'' H 1.371 4.189 9.124 1.00 . B B . 11 DG H5'' 1 1
1 718 2 2 11 DG H8 H 1.717 -0.010 5.962 1.00 . B B . 11 DG H8 1 1
1 719 2 2 11 DG N1 N 6.276 -2.435 4.347 1.00 . B B . 11 DG N1 1 1
1 720 2 2 11 DG N2 N 8.173 -1.419 5.183 1.00 . B B . 11 DG N2 1 1
1 721 2 2 11 DG N3 N 6.126 -0.360 5.533 1.00 . B B . 11 DG N3 1 1
1 722 2 2 11 DG N7 N 2.771 -1.489 4.927 1.00 . B B . 11 DG N7 1 1
1 723 2 2 11 DG N9 N 3.772 0.303 5.844 1.00 . B B . 11 DG N9 1 1
1 724 2 2 11 DG O3' O 4.623 4.382 7.218 1.00 . B B . 11 DG O3' 1 1
1 725 2 2 11 DG O4' O 3.248 1.632 7.835 1.00 . B B . 11 DG O4' 1 1
1 726 2 2 11 DG O5' O 0.519 2.934 7.743 1.00 . B B . 11 DG O5' 1 1
1 727 2 2 11 DG O6 O 4.490 -3.606 3.586 1.00 . B B . 11 DG O6 1 1
1 728 2 2 11 DG OP1 O -1.190 4.607 8.514 1.00 . B B . 11 DG OP1 1 1
1 729 2 2 11 DG OP2 O -1.864 2.677 6.971 1.00 . B B . 11 DG OP2 1 1
1 730 2 2 11 DG P P -1.044 3.197 8.088 1.00 . B B . 11 DG P 1 1
1 731 2 2 12 DC C1' C 8.396 1.911 3.824 1.00 . B B . 12 DC C1' 1 1
1 732 2 2 12 DC C2 C 7.477 0.140 2.291 1.00 . B B . 12 DC C2 1 1
1 733 2 2 12 DC C2' C 8.821 3.277 3.269 1.00 . B B . 12 DC C2' 1 1
1 734 2 2 12 DC C3' C 9.265 4.069 4.500 1.00 . B B . 12 DC C3' 1 1
1 735 2 2 12 DC C4 C 5.183 0.169 1.730 1.00 . B B . 12 DC C4 1 1
1 736 2 2 12 DC C4' C 8.640 3.290 5.668 1.00 . B B . 12 DC C4' 1 1
1 737 2 2 12 DC C5 C 4.969 1.367 2.486 1.00 . B B . 12 DC C5 1 1
1 738 2 2 12 DC C5' C 7.669 4.135 6.532 1.00 . B B . 12 DC C5' 1 1
1 739 2 2 12 DC C6 C 6.049 1.890 3.107 1.00 . B B . 12 DC C6 1 1
1 740 2 2 12 DC H1' H 9.264 1.243 3.907 1.00 . B B . 12 DC H1' 1 1
1 741 2 2 12 DC H2' H 8.059 3.857 2.753 1.00 . B B . 12 DC H2' 1 1
1 742 2 2 12 DC H2'' H 9.585 3.107 2.540 1.00 . B B . 12 DC H2'' 1 1
1 743 2 2 12 DC H3' H 8.920 5.105 4.458 1.00 . B B . 12 DC H3' 1 1
1 744 2 2 12 DC H4' H 9.439 2.814 6.230 1.00 . B B . 12 DC H4' 1 1
1 745 2 2 12 DC H41 H 4.289 -1.240 0.563 1.00 . B B . 12 DC H41 1 1
1 746 2 2 12 DC H42 H 3.237 0.031 1.142 1.00 . B B . 12 DC H42 1 1
1 747 2 2 12 DC H5 H 4.004 1.847 2.578 1.00 . B B . 12 DC H5 1 1
1 748 2 2 12 DC H5' H 7.252 3.493 7.310 1.00 . B B . 12 DC H5' 1 1
1 749 2 2 12 DC H5'' H 8.120 5.019 7.022 1.00 . B B . 12 DC H5'' 1 1
1 750 2 2 12 DC H6 H 5.966 2.779 3.701 1.00 . B B . 12 DC H6 1 1
1 751 2 2 12 DC HO3' H 11.024 4.539 3.826 1.00 . B B . 12 DC HO3' 1 1
1 752 2 2 12 DC N1 N 7.288 1.314 3.029 1.00 . B B . 12 DC N1 1 1
1 753 2 2 12 DC N3 N 6.397 -0.404 1.654 1.00 . B B . 12 DC N3 1 1
1 754 2 2 12 DC N4 N 4.155 -0.385 1.084 1.00 . B B . 12 DC N4 1 1
1 755 2 2 12 DC O2 O 8.577 -0.406 2.219 1.00 . B B . 12 DC O2 1 1
1 756 2 2 12 DC O3' O 10.674 4.087 4.596 1.00 . B B . 12 DC O3' 1 1
1 757 2 2 12 DC O4' O 7.923 2.196 5.126 1.00 . B B . 12 DC O4' 1 1
1 758 2 2 12 DC O5' O 6.617 4.553 5.678 1.00 . B B . 12 DC O5' 1 1
1 759 2 2 12 DC OP1 O 5.888 6.539 7.015 1.00 . B B . 12 DC OP1 1 1
1 760 2 2 12 DC OP2 O 4.473 5.674 5.063 1.00 . B B . 12 DC OP2 1 1
1 761 2 2 12 DC P P 5.363 5.409 6.216 1.00 . B B . 12 DC P 1 1
stop_
save_
Contact the webmaster for help, if required. Saturday, June 1, 2024 3:55:55 AM GMT (wattos1)