Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
389616 | 1nts RC | 5776 | cing | 4-filtered-FRED | STAR | entry | full | 193 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1nts
# This FRED archive file contains, for PDB entry <1nts>:
#
# - 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_1nts
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1nts
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 5181.36
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 $5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_ A . 1 1
2 . 2 $5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_ B . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
2 2 5PC 1 5PC 1 1
2 2 5PC 2 5PC 1 1
2 2 PDU 3 PDU 1 1
2 2 5PC 4 5PC 1 1
2 2 5PC 5 5PC 1 1
2 2 PDU 6 PDU 1 1
2 2 PDU 7 PDU 1 1
stop_
save_
save_5__R__AP_AP_AP_GP_GP_AP_GP_GP_A__3_
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "5 R AP AP AP GP GP AP GP GP A 3 "
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_seq_one_letter_code AAAGGAGGA
_Entity.Number_of_monomers 9
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 A . 1 1
2 A . 1 1
3 A . 1 1
4 G . 1 1
5 G . 1 1
6 A . 1 1
7 G . 1 1
8 G . 1 1
9 A . 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
A 1 1 1 1
A 2 2 1 1
A 3 3 1 1
G 4 4 1 1
G 5 5 1 1
A 6 6 1 1
G 7 7 1 1
G 8 8 1 1
A 9 9 1 1
stop_
save_
save_5__D___5PC_P__5PC_P__PDU_P__5PC_P__5PC_P__PDU_P__PDU___3_
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "5 D 5PC P 5PC P PDU P 5PC P 5PC P PDU P PDU 3 "
_Entity.Type non-polymer
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 5PC $5PC 1 2
2 5PC $5PC 1 2
3 PDU $PDU 1 2
4 5PC $5PC 1 2
5 5PC $5PC 1 2
6 PDU $PDU 1 2
7 PDU $PDU 1 2
stop_
save_
save_PDU
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID PDU
_Chem_comp.Type non-polymer
save_
save_5PC
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID 5PC
_Chem_comp.Type non-polymer
save_
save_Discover_distance_constraints_3_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
81 1 . . . 1 1
82 1 . . . 1 1
83 1 . . . 1 1
84 1 . . . 1 1
85 1 . . . 1 1
86 1 . . . 1 1
87 1 . . . 1 1
88 1 . . . 1 1
89 1 . . . 1 1
90 1 . . . 1 1
91 1 . . . 1 1
92 1 . . . 1 1
93 1 . . . 1 1
94 1 . . . 1 1
95 1 . . . 1 1
96 1 . . . 1 1
97 1 . . . 1 1
98 1 . . . 1 1
99 1 . . . 1 1
100 1 . . . 1 1
101 1 . . . 1 1
102 1 . . . 1 1
103 1 . . . 1 1
104 1 . . . 1 1
105 1 . . . 1 1
106 1 . . . 1 1
107 1 . . . 1 1
108 1 . . . 1 1
109 1 . . . 1 1
110 1 . . . 1 1
111 1 . . . 1 1
112 1 . . . 1 1
113 1 . . . 1 1
114 1 . . . 1 1
115 1 . . . 1 1
116 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 1 A H2 1 2 A H2 1 1
1 1 2 1 1 2 A H1' 1 3 A H1' 1 1
2 1 1 2 2 1 5PC H1' B 1 C5' H1' 1 1
2 1 2 2 2 2 5PC H6 B 2 PC H6 1 1
3 1 1 2 2 1 5PC H3' B 1 C5' H3' 1 1
3 1 2 2 2 2 5PC H6 B 2 PC H6 1 1
4 1 1 2 2 2 5PC H3' B 2 PC H3' 1 1
4 1 2 2 2 2 5PC H6 B 2 PC H6 1 1
5 1 1 1 1 1 A H1' 1 2 A H1' 1 1
5 1 2 1 1 1 A H8 1 2 A H8 1 1
6 1 1 1 1 1 A H3' 1 2 A H3' 1 1
6 1 2 1 1 1 A H8 1 2 A H8 1 1
7 1 1 1 1 1 A H1' 1 2 A H1' 1 1
7 1 2 1 1 1 A H2' 1 2 A H2' 1 1
8 1 1 1 1 1 A H1' 1 2 A H1' 1 1
8 1 2 1 1 1 A H3' 1 2 A H3' 1 1
9 1 1 1 1 1 A H1' 1 2 A H1' 1 1
9 1 2 1 1 1 A H4' 1 2 A H4' 1 1
10 1 1 1 1 1 A H3' 1 2 A H3' 1 1
10 1 2 1 1 2 A H8 1 3 A H8 1 1
11 1 1 2 2 3 PDU H1' B 3 PU H1' 1 1
11 1 2 2 2 3 PDU H6 B 3 PU H6 1 1
12 1 1 1 1 2 A H1' 1 3 A H1' 1 1
12 1 2 1 1 2 A H8 1 3 A H8 1 1
13 1 1 1 1 2 A H1' 1 3 A H1' 1 1
13 1 2 1 1 2 A H2' 1 3 A H2' 1 1
14 1 1 2 2 3 PDU H1' B 3 PU H1' 1 1
14 1 2 2 2 3 PDU H3' B 3 PU H3' 1 1
15 1 1 2 2 3 PDU H1' B 3 PU H1' 1 1
15 1 2 2 2 3 PDU H4' B 3 PU H4' 1 1
16 1 1 1 1 2 A H1' 1 3 A H1' 1 1
16 1 2 1 1 2 A H4' 1 3 A H4' 1 1
17 1 1 2 2 3 PDU H1' B 3 PU H1' 1 1
17 1 2 2 2 4 5PC H6 B 4 PC H6 1 1
18 1 1 1 1 2 A H1' 1 3 A H1' 1 1
18 1 2 1 1 3 A H8 1 4 A H8 1 1
19 1 1 2 2 3 PDU H3' B 3 PU H3' 1 1
19 1 2 2 2 3 PDU H6 B 3 PU H6 1 1
20 1 1 1 1 3 A H2 1 4 A H2 1 1
20 1 2 2 2 7 PDU H1' B 7 PU3' H1' 1 1
21 1 1 2 2 3 PDU H3' B 3 PU H3' 1 1
21 1 2 2 2 4 5PC H6 B 4 PC H6 1 1
22 1 1 2 2 4 5PC H3' B 4 PC H3' 1 1
22 1 2 2 2 4 5PC H6 B 4 PC H6 1 1
23 1 1 1 1 2 A H2' 1 3 A H2' 1 1
23 1 2 1 1 3 A H8 1 4 A H8 1 1
24 1 1 1 1 3 A H1' 1 4 A H1' 1 1
24 1 2 1 1 3 A H8 1 4 A H8 1 1
25 1 1 1 1 3 A H2' 1 4 A H2' 1 1
25 1 2 1 1 3 A H8 1 4 A H8 1 1
26 1 1 1 1 3 A H3' 1 4 A H3' 1 1
26 1 2 1 1 3 A H8 1 4 A H8 1 1
27 1 1 1 1 3 A H4' 1 4 A H4' 1 1
27 1 2 1 1 3 A H8 1 4 A H8 1 1
28 1 1 1 1 2 A H2 1 3 A H2 1 1
28 1 2 1 1 3 A H1' 1 4 A H1' 1 1
29 1 1 2 2 4 5PC H1' B 4 PC H1' 1 1
29 1 2 2 2 4 5PC H6 B 4 PC H6 1 1
30 1 1 2 2 4 5PC H1' B 4 PC H1' 1 1
30 1 2 2 2 4 5PC H4' B 4 PC H4' 1 1
31 1 1 2 2 4 5PC H1' B 4 PC H1' 1 1
31 1 2 2 2 5 5PC H6 B 5 PC H6 1 1
32 1 1 1 1 3 A H1' 1 4 A H1' 1 1
32 1 2 1 1 4 G H8 1 5 G H8 1 1
33 1 1 1 1 3 A H1' 1 4 A H1' 1 1
33 1 2 1 1 3 A H2' 1 4 A H2' 1 1
34 1 1 1 1 3 A H1' 1 4 A H1' 1 1
34 1 2 1 1 3 A H3' 1 4 A H3' 1 1
35 1 1 2 2 5 5PC H4' B 5 PC H4' 1 1
35 1 2 2 2 5 5PC H6 B 5 PC H6 1 1
36 1 1 1 1 3 A H2' 1 4 A H2' 1 1
36 1 2 1 1 4 G H8 1 5 G H8 1 1
37 1 1 1 1 3 A H3' 1 4 A H3' 1 1
37 1 2 1 1 4 G H8 1 5 G H8 1 1
38 1 1 1 1 4 G H1' 1 5 G H1' 1 1
38 1 2 1 1 4 G H8 1 5 G H8 1 1
39 1 1 1 1 4 G H2' 1 5 G H2' 1 1
39 1 2 1 1 4 G H8 1 5 G H8 1 1
40 1 1 1 1 4 G H3' 1 5 G H3' 1 1
40 1 2 1 1 4 G H8 1 5 G H8 1 1
41 1 1 1 1 4 G H4' 1 5 G H4' 1 1
41 1 2 1 1 4 G H8 1 5 G H8 1 1
42 1 1 1 1 3 A H2 1 4 A H2 1 1
42 1 2 1 1 4 G H1' 1 5 G H1' 1 1
43 1 1 1 1 3 A H2' 1 4 A H2' 1 1
43 1 2 1 1 4 G H1' 1 5 G H1' 1 1
44 1 1 2 2 5 5PC H1' B 5 PC H1' 1 1
44 1 2 2 2 5 5PC H6 B 5 PC H6 1 1
45 1 1 1 1 4 G H1' 1 5 G H1' 1 1
45 1 2 1 1 4 G H3' 1 5 G H3' 1 1
46 1 1 2 2 5 5PC H1' B 5 PC H1' 1 1
46 1 2 2 2 5 5PC H3' B 5 PC H3' 1 1
47 1 1 2 2 5 5PC H1' B 5 PC H1' 1 1
47 1 2 2 2 5 5PC H4' B 5 PC H4' 1 1
48 1 1 1 1 4 G H1' 1 5 G H1' 1 1
48 1 2 1 1 4 G H4' 1 5 G H4' 1 1
49 1 1 1 1 4 G H1' 1 5 G H1' 1 1
49 1 2 1 1 4 G H2' 1 5 G H2' 1 1
50 1 1 2 2 5 5PC H3' B 5 PC H3' 1 1
50 1 2 2 2 5 5PC H6 B 5 PC H6 1 1
51 1 1 2 2 5 5PC H1' B 5 PC H1' 1 1
51 1 2 2 2 6 PDU H6 B 6 PU H6 1 1
52 1 1 1 1 4 G H1' 1 5 G H1' 1 1
52 1 2 1 1 5 G H8 1 6 G H8 1 1
53 1 1 1 1 4 G H2' 1 5 G H2' 1 1
53 1 2 1 1 5 G H8 1 6 G H8 1 1
54 1 1 1 1 4 G H3' 1 5 G H3' 1 1
54 1 2 1 1 5 G H8 1 6 G H8 1 1
55 1 1 1 1 5 G H1' 1 6 G H1' 1 1
55 1 2 1 1 5 G H8 1 6 G H8 1 1
56 1 1 1 1 5 G H2' 1 6 G H2' 1 1
56 1 2 1 1 5 G H8 1 6 G H8 1 1
57 1 1 1 1 5 G H3' 1 6 G H3' 1 1
57 1 2 1 1 5 G H8 1 6 G H8 1 1
58 1 1 1 1 5 G H4' 1 6 G H4' 1 1
58 1 2 1 1 5 G H8 1 6 G H8 1 1
59 1 1 1 1 4 G H2' 1 5 G H2' 1 1
59 1 2 1 1 5 G H1' 1 6 G H1' 1 1
60 1 1 2 2 6 PDU H1' B 6 PU H1' 1 1
60 1 2 2 2 6 PDU H6 B 6 PU H6 1 1
61 1 1 1 1 5 G H1' 1 6 G H1' 1 1
61 1 2 1 1 5 G H2' 1 6 G H2' 1 1
62 1 1 1 1 5 G H1' 1 6 G H1' 1 1
62 1 2 1 1 5 G H3' 1 6 G H3' 1 1
63 1 1 2 2 6 PDU H1' B 6 PU H1' 1 1
63 1 2 2 2 6 PDU H3' B 6 PU H3' 1 1
64 1 1 1 1 5 G H1' 1 6 G H1' 1 1
64 1 2 1 1 5 G H4' 1 6 G H4' 1 1
65 1 1 2 2 6 PDU H1' B 6 PU H1' 1 1
65 1 2 2 2 6 PDU H4' B 6 PU H4' 1 1
66 1 1 2 2 6 PDU H1' B 6 PU H1' 1 1
66 1 2 2 2 7 PDU H6 B 7 PU3' H6 1 1
67 1 1 1 1 5 G H1' 1 6 G H1' 1 1
67 1 2 1 1 6 A H8 1 7 A H8 1 1
68 1 1 2 2 6 PDU H3' B 6 PU H3' 1 1
68 1 2 2 2 6 PDU H6 B 6 PU H6 1 1
69 1 1 1 1 6 A H2 1 7 A H2 1 1
69 1 2 2 2 4 5PC H1' B 4 PC H1' 1 1
70 1 1 2 2 6 PDU H3' B 6 PU H3' 1 1
70 1 2 2 2 7 PDU H6 B 7 PU3' H6 1 1
71 1 1 2 2 7 PDU H4' B 7 PU3' H4' 1 1
71 1 2 2 2 7 PDU H6 B 7 PU3' H6 1 1
72 1 1 1 1 5 G H2' 1 6 G H2' 1 1
72 1 2 1 1 6 A H8 1 7 A H8 1 1
73 1 1 1 1 5 G H3' 1 6 G H3' 1 1
73 1 2 1 1 6 A H8 1 7 A H8 1 1
74 1 1 1 1 6 A H1' 1 7 A H1' 1 1
74 1 2 1 1 6 A H8 1 7 A H8 1 1
75 1 1 1 1 6 A H4' 1 7 A H4' 1 1
75 1 2 1 1 6 A H8 1 7 A H8 1 1
76 1 1 1 1 6 A H1' 1 7 A H1' 1 1
76 1 2 1 1 6 A H4' 1 7 A H4' 1 1
77 1 1 1 1 5 G H2' 1 6 G H2' 1 1
77 1 2 1 1 6 A H1' 1 7 A H1' 1 1
78 1 1 2 2 7 PDU H1' B 7 PU3' H1' 1 1
78 1 2 2 2 7 PDU H6 B 7 PU3' H6 1 1
79 1 1 1 1 6 A H1' 1 7 A H1' 1 1
79 1 2 1 1 6 A H2' 1 7 A H2' 1 1
80 1 1 1 1 6 A H1' 1 7 A H1' 1 1
80 1 2 1 1 6 A H3' 1 7 A H3' 1 1
81 1 1 2 2 7 PDU H1' B 7 PU3' H1' 1 1
81 1 2 2 2 7 PDU H4' B 7 PU3' H4' 1 1
82 1 1 1 1 6 A H1' 1 7 A H1' 1 1
82 1 2 1 1 7 G H8 1 8 G H8 1 1
83 1 1 2 2 7 PDU H3' B 7 PU3' H3' 1 1
83 1 2 2 2 7 PDU H6 B 7 PU3' H6 1 1
84 1 1 1 1 6 A H3' 1 7 A H3' 1 1
84 1 2 1 1 6 A H8 1 7 A H8 1 1
85 1 1 1 1 6 A H2' 1 7 A H2' 1 1
85 1 2 1 1 7 G H8 1 8 G H8 1 1
86 1 1 1 1 6 A H3' 1 7 A H3' 1 1
86 1 2 1 1 7 G H8 1 8 G H8 1 1
87 1 1 1 1 7 G H1' 1 8 G H1' 1 1
87 1 2 1 1 7 G H8 1 8 G H8 1 1
88 1 1 1 1 7 G H2' 1 8 G H2' 1 1
88 1 2 1 1 7 G H8 1 8 G H8 1 1
89 1 1 1 1 7 G H3' 1 8 G H3' 1 1
89 1 2 1 1 7 G H8 1 8 G H8 1 1
90 1 1 1 1 6 A H2 1 7 A H2 1 1
90 1 2 1 1 7 G H1' 1 8 G H1' 1 1
91 1 1 1 1 7 G H1' 1 8 G H1' 1 1
91 1 2 1 1 7 G H4' 1 8 G H4' 1 1
92 1 1 1 1 7 G H1' 1 8 G H1' 1 1
92 1 2 1 1 7 G H2' 1 8 G H2' 1 1
93 1 1 1 1 7 G H1' 1 8 G H1' 1 1
93 1 2 1 1 8 G H8 1 9 G H8 1 1
94 1 1 1 1 7 G H2' 1 8 G H2' 1 1
94 1 2 1 1 8 G H8 1 9 G H8 1 1
95 1 1 1 1 7 G H3' 1 8 G H3' 1 1
95 1 2 1 1 8 G H8 1 9 G H8 1 1
96 1 1 1 1 8 G H3' 1 9 G H3' 1 1
96 1 2 1 1 8 G H8 1 9 G H8 1 1
97 1 1 1 1 8 G H4' 1 9 G H4' 1 1
97 1 2 1 1 8 G H8 1 9 G H8 1 1
98 1 1 1 1 8 G H1' 1 9 G H1' 1 1
98 1 2 1 1 8 G H8 1 9 G H8 1 1
99 1 1 1 1 8 G H1' 1 9 G H1' 1 1
99 1 2 1 1 8 G H3' 1 9 G H3' 1 1
100 1 1 1 1 8 G H1' 1 9 G H1' 1 1
100 1 2 1 1 8 G H4' 1 9 G H4' 1 1
101 1 1 1 1 8 G H1' 1 9 G H1' 1 1
101 1 2 1 1 9 A H8 1 10 A H8 1 1
102 1 1 1 1 8 G H1' 1 9 G H1' 1 1
102 1 2 1 1 8 G H2' 1 9 G H2' 1 1
103 1 1 1 1 8 G H2' 1 9 G H2' 1 1
103 1 2 1 1 9 A H8 1 10 A H8 1 1
104 1 1 1 1 8 G H3' 1 9 G H3' 1 1
104 1 2 1 1 9 A H8 1 10 A H8 1 1
105 1 1 1 1 9 A H1' 1 10 A H1' 1 1
105 1 2 1 1 9 A H8 1 10 A H8 1 1
106 1 1 1 1 9 A H3' 1 10 A H3' 1 1
106 1 2 1 1 9 A H8 1 10 A H8 1 1
107 1 1 1 1 9 A H1' 1 10 A H1' 1 1
107 1 2 1 1 9 A H3' 1 10 A H3' 1 1
108 1 1 1 1 9 A H1' 1 10 A H1' 1 1
108 1 2 1 1 9 A H2' 1 10 A H2' 1 1
109 1 1 1 1 1 A H2' 1 2 A H2' 1 1
109 1 2 1 1 2 A H8 1 3 A H8 1 1
110 1 1 1 1 2 A H3' 1 3 A H3' 1 1
110 1 2 1 1 2 A H8 1 3 A H8 1 1
111 1 1 1 1 7 G H4' 1 8 G H4' 1 1
111 1 2 1 1 7 G H8 1 8 G H8 1 1
112 1 1 1 1 7 G H2' 1 8 G H2' 1 1
112 1 2 1 1 8 G H1' 1 9 G H1' 1 1
113 1 1 2 2 2 5PC H1' B 2 PC H1' 1 1
113 1 2 2 2 3 PDU H6 B 3 PU H6 1 1
114 1 1 2 2 2 5PC H1' B 2 PC H1' 1 1
114 1 2 2 2 2 5PC H6 B 2 PC H6 1 1
115 1 1 2 2 5 5PC H3' B 5 PC H3' 1 1
115 1 2 2 2 6 PDU H6 B 6 PU H6 1 1
116 1 1 2 2 6 PDU H4' B 6 PU H4' 1 1
116 1 2 2 2 6 PDU H6 B 6 PU 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 . . . . . . 2.296 4.263 1 1
2 1 . . . . . . 2.917 5.417 1 1
3 1 . . . . . . 2.924 5.43 1 1
4 1 . . . . . . 1.778 3.302 1 1
5 1 . . . . . . 2.211 4.107 1 1
6 1 . . . . . . 2.636 4.895 1 1
7 1 . . . . . . 2.16 4.012 1 1
8 1 . . . . . . 2.988 5.549 1 1
9 1 . . . . . . 2.788 5.177 1 1
10 1 . . . . . . 2.351 4.366 1 1
11 1 . . . . . . 2.556 4.747 1 1
12 1 . . . . . . 2.965 5.506 1 1
13 1 . . . . . . 2.093 3.887 1 1
14 1 . . . . . . 2.8 5.201 1 1
15 1 . . . . . . 2.459 4.567 1 1
16 1 . . . . . . 2.489 4.623 1 1
17 1 . . . . . . 2.866 5.322 1 1
18 1 . . . . . . 2.545 4.726 1 1
19 1 . . . . . . 2.213 4.111 1 1
20 1 . . . . . . 2.667 4.954 1 1
21 1 . . . . . . 2.486 4.616 1 1
22 1 . . . . . . 2.546 4.728 1 1
23 1 . . . . . . 1.728 3.209 1 1
24 1 . . . . . . 2.715 5.041 1 1
25 1 . . . . . . 2.674 4.965 1 1
26 1 . . . . . . 1.809 3.359 1 1
27 1 . . . . . . 2.718 5.048 1 1
28 1 . . . . . . 2.109 3.916 1 1
29 1 . . . . . . 2.952 5.483 1 1
30 1 . . . . . . 2.67 4.959 1 1
31 1 . . . . . . 3.02 5.608 1 1
32 1 . . . . . . 3.343 6.0 1 1
33 1 . . . . . . 1.747 3.245 1 1
34 1 . . . . . . 2.514 4.669 1 1
35 1 . . . . . . 2.724 5.059 1 1
36 1 . . . . . . 1.631 3.03 1 1
37 1 . . . . . . 2.28 4.234 1 1
38 1 . . . . . . 2.685 4.986 1 1
39 1 . . . . . . 2.402 4.461 1 1
40 1 . . . . . . 1.917 3.56 1 1
41 1 . . . . . . 2.315 4.299 1 1
42 1 . . . . . . 2.298 4.268 1 1
43 1 . . . . . . 2.71 5.033 1 1
44 1 . . . . . . 2.681 4.978 1 1
45 1 . . . . . . 2.546 4.729 1 1
46 1 . . . . . . 3.036 5.639 1 1
47 1 . . . . . . 2.211 4.107 1 1
48 1 . . . . . . 2.296 4.263 1 1
49 1 . . . . . . 1.74 3.232 1 1
50 1 . . . . . . 1.979 3.676 1 1
51 1 . . . . . . 2.237 4.154 1 1
52 1 . . . . . . 2.876 5.341 1 1
53 1 . . . . . . 1.652 3.068 1 1
54 1 . . . . . . 1.873 3.479 1 1
55 1 . . . . . . 2.682 4.981 1 1
56 1 . . . . . . 2.413 4.481 1 1
57 1 . . . . . . 1.903 3.534 1 1
58 1 . . . . . . 2.413 4.481 1 1
59 1 . . . . . . 2.439 4.53 1 1
60 1 . . . . . . 2.787 5.175 1 1
61 1 . . . . . . 1.839 3.415 1 1
62 1 . . . . . . 2.421 4.496 1 1
63 1 . . . . . . 2.884 5.355 1 1
64 1 . . . . . . 2.46 4.569 1 1
65 1 . . . . . . 2.699 5.013 1 1
66 1 . . . . . . 3.553 6.0 1 1
67 1 . . . . . . 3.35 6.0 1 1
68 1 . . . . . . 2.631 4.886 1 1
69 1 . . . . . . 2.312 4.294 1 1
70 1 . . . . . . 2.84 5.274 1 1
71 1 . . . . . . 3.168 5.884 1 1
72 1 . . . . . . 1.679 3.118 1 1
73 1 . . . . . . 2.464 4.575 1 1
74 1 . . . . . . 3.029 5.625 1 1
75 1 . . . . . . 3.373 6.0 1 1
76 1 . . . . . . 2.729 5.068 1 1
77 1 . . . . . . 3.536 6.0 1 1
78 1 . . . . . . 2.504 4.65 1 1
79 1 . . . . . . 2.083 3.869 1 1
80 1 . . . . . . 2.56 4.755 1 1
81 1 . . . . . . 2.84 5.274 1 1
82 1 . . . . . . 3.2 5.942 1 1
83 1 . . . . . . 1.97 3.659 1 1
84 1 . . . . . . 2.296 4.263 1 1
85 1 . . . . . . 1.703 3.162 1 1
86 1 . . . . . . 3.016 5.601 1 1
87 1 . . . . . . 3.222 5.984 1 1
88 1 . . . . . . 2.395 4.447 1 1
89 1 . . . . . . 2.109 3.916 1 1
90 1 . . . . . . 1.999 3.712 1 1
91 1 . . . . . . 2.425 4.503 1 1
92 1 . . . . . . 1.74 3.231 1 1
93 1 . . . . . . 3.138 5.829 1 1
94 1 . . . . . . 1.627 3.021 1 1
95 1 . . . . . . 2.592 4.814 1 1
96 1 . . . . . . 1.971 3.66 1 1
97 1 . . . . . . 2.233 4.146 1 1
98 1 . . . . . . 2.992 5.556 1 1
99 1 . . . . . . 2.504 4.651 1 1
100 1 . . . . . . 2.318 4.304 1 1
101 1 . . . . . . 3.155 5.86 1 1
102 1 . . . . . . 1.706 3.168 1 1
103 1 . . . . . . 1.719 3.192 1 1
104 1 . . . . . . 1.887 3.504 1 1
105 1 . . . . . . 2.992 5.556 1 1
106 1 . . . . . . 1.919 3.564 1 1
107 1 . . . . . . 3.014 5.598 1 1
108 1 . . . . . . 1.786 3.317 1 1
109 1 . . . . . . 0.0 5.0 1 1
110 1 . . . . . . 0.0 5.0 1 1
111 1 . . . . . . 0.0 5.0 1 1
112 1 . . . . . . 0.0 5.0 1 1
113 1 . . . . . . 0.0 5.0 1 1
114 1 . . . . . . 0.0 5.0 1 1
115 1 . . . . . . 0.0 5.0 1 1
116 1 . . . . . . 0.0 5.0 1 1
stop_
save_
save_Discover_distance_constraints_2_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_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 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 2 A N1 1 3 A N1 1 2
1 1 2 2 2 7 PDU H3 B 7 PU3' H3 1 2
2 1 1 1 1 2 A H61 1 3 A H61 1 2
2 1 2 2 2 7 PDU O4 B 7 PU3' O4 1 2
3 1 1 1 1 3 A N1 1 4 A N1 1 2
3 1 2 2 2 6 PDU H3 B 6 PU H3 1 2
4 1 1 1 1 3 A H61 1 4 A H61 1 2
4 1 2 2 2 6 PDU O4 B 6 PU O4 1 2
5 1 1 1 1 4 G H1 1 5 G H1 1 2
5 1 2 2 2 5 5PC N3 B 5 PC N3 1 2
6 1 1 1 1 4 G O6 1 5 G O6 1 2
6 1 2 2 2 5 5PC H42 B 5 PC H42 1 2
7 1 1 1 1 4 G H21 1 5 G H22 1 2
7 1 2 2 2 5 5PC O2 B 5 PC O2 1 2
8 1 1 1 1 5 G H1 1 6 G H1 1 2
8 1 2 2 2 4 5PC N3 B 4 PC N3 1 2
9 1 1 1 1 5 G O6 1 6 G O6 1 2
9 1 2 2 2 4 5PC H42 B 4 PC H42 1 2
10 1 1 1 1 5 G H21 1 6 G H22 1 2
10 1 2 2 2 4 5PC O2 B 4 PC O2 1 2
11 1 1 1 1 6 A N1 1 7 A N1 1 2
11 1 2 2 2 3 PDU H3 B 3 PU H3 1 2
12 1 1 1 1 6 A H61 1 7 A H61 1 2
12 1 2 2 2 3 PDU O4 B 3 PU O4 1 2
13 1 1 1 1 7 G H1 1 8 G H1 1 2
13 1 2 2 2 2 5PC N3 B 2 PC N3 1 2
14 1 1 1 1 7 G O6 1 8 G O6 1 2
14 1 2 2 2 2 5PC H42 B 2 PC H42 1 2
15 1 1 1 1 7 G H21 1 8 G H22 1 2
15 1 2 2 2 2 5PC O2 B 2 PC O2 1 2
16 1 1 1 1 8 G H1 1 9 G H1 1 2
16 1 2 2 2 1 5PC N3 B 1 C5' N3 1 2
17 1 1 1 1 8 G O6 1 9 G O6 1 2
17 1 2 2 2 1 5PC H42 B 1 C5' H42 1 2
18 1 1 1 1 8 G H21 1 9 G H22 1 2
18 1 2 2 2 1 5PC O2 B 1 C5' O2 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 . . . . . . 1.8 2.5 1 2
2 1 . . . . . . 1.8 2.5 1 2
3 1 . . . . . . 1.8 2.5 1 2
4 1 . . . . . . 1.8 2.5 1 2
5 1 . . . . . . 1.8 2.5 1 2
6 1 . . . . . . 1.8 2.5 1 2
7 1 . . . . . . 1.8 2.5 1 2
8 1 . . . . . . 1.8 2.5 1 2
9 1 . . . . . . 1.8 2.5 1 2
10 1 . . . . . . 1.8 2.5 1 2
11 1 . . . . . . 1.8 2.5 1 2
12 1 . . . . . . 1.8 2.5 1 2
13 1 . . . . . . 1.8 2.5 1 2
14 1 . . . . . . 1.8 2.5 1 2
15 1 . . . . . . 1.8 2.5 1 2
16 1 . . . . . . 1.8 2.5 1 2
17 1 . . . . . . 1.8 2.5 1 2
18 1 . . . . . . 1.8 2.5 1 2
stop_
save_
save_Discover_dihedral_4
_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 A O3' 1 1 2 A P 1 1 2 A O5' 1 1 2 A C5' -150.0 150.0 1 2 A O3' 1 3 A P 1 3 A O5' 1 3 A C5' 1 1
2 . 1 1 2 A O3' 1 1 3 A P 1 1 3 A O5' 1 1 3 A C5' -150.0 150.0 1 3 A O3' 1 4 A P 1 4 A O5' 1 4 A C5' 1 1
3 . 1 1 3 A O3' 1 1 4 G P 1 1 4 G O5' 1 1 4 G C5' -150.0 150.0 1 4 A O3' 1 5 G P 1 5 G O5' 1 5 G C5' 1 1
4 . 1 1 4 G O3' 1 1 5 G P 1 1 5 G O5' 1 1 5 G C5' -150.0 150.0 1 5 G O3' 1 6 G P 1 6 G O5' 1 6 G C5' 1 1
5 . 1 1 5 G O3' 1 1 6 A P 1 1 6 A O5' 1 1 6 A C5' -150.0 150.0 1 6 G O3' 1 7 A P 1 7 A O5' 1 7 A C5' 1 1
6 . 1 1 6 A O3' 1 1 7 G P 1 1 7 G O5' 1 1 7 G C5' -150.0 150.0 1 7 A O3' 1 8 G P 1 8 G O5' 1 8 G C5' 1 1
7 . 1 1 7 G O3' 1 1 8 G P 1 1 8 G O5' 1 1 8 G C5' -150.0 150.0 1 8 G O3' 1 9 G P 1 9 G O5' 1 9 G C5' 1 1
8 . 1 1 8 G O3' 1 1 9 A P 1 1 9 A O5' 1 1 9 A C5' -150.0 150.0 1 9 G O3' 1 10 A P 1 10 A O5' 1 10 A C5' 1 1
9 . 1 1 2 A P 1 1 2 A O5' 1 1 2 A C5' 1 1 2 A C4' 150.0 210.0 1 3 A P 1 3 A O5' 1 3 A C5' 1 3 A C4' 1 1
10 . 1 1 3 A P 1 1 3 A O5' 1 1 3 A C5' 1 1 3 A C4' 150.0 210.0 1 4 A P 1 4 A O5' 1 4 A C5' 1 4 A C4' 1 1
11 . 1 1 4 G P 1 1 4 G O5' 1 1 4 G C5' 1 1 4 G C4' 150.0 210.0 1 5 G P 1 5 G O5' 1 5 G C5' 1 5 G C4' 1 1
12 . 1 1 5 G P 1 1 5 G O5' 1 1 5 G C5' 1 1 5 G C4' 150.0 210.0 1 6 G P 1 6 G O5' 1 6 G C5' 1 6 G C4' 1 1
13 . 1 1 6 A P 1 1 6 A O5' 1 1 6 A C5' 1 1 6 A C4' 150.0 210.0 1 7 A P 1 7 A O5' 1 7 A C5' 1 7 A C4' 1 1
14 . 1 1 7 G P 1 1 7 G O5' 1 1 7 G C5' 1 1 7 G C4' 150.0 210.0 1 8 G P 1 8 G O5' 1 8 G C5' 1 8 G C4' 1 1
15 . 1 1 8 G P 1 1 8 G O5' 1 1 8 G C5' 1 1 8 G C4' 150.0 210.0 1 9 G P 1 9 G O5' 1 9 G C5' 1 9 G C4' 1 1
16 . 1 1 9 A P 1 1 9 A O5' 1 1 9 A C5' 1 1 9 A C4' 150.0 210.0 1 10 A P 1 10 A O5' 1 10 A C5' 1 10 A C4' 1 1
17 . 1 1 1 A O5' 1 1 1 A C5' 1 1 1 A C4' 1 1 1 A C3' 30.0 89.99999 1 2 A O5' 1 2 A C5' 1 2 A C4' 1 2 A C3' 1 1
18 . 1 1 2 A O5' 1 1 2 A C5' 1 1 2 A C4' 1 1 2 A C3' 30.0 89.99999 1 3 A O5' 1 3 A C5' 1 3 A C4' 1 3 A C3' 1 1
19 . 1 1 3 A O5' 1 1 3 A C5' 1 1 3 A C4' 1 1 3 A C3' 30.0 89.99999 1 4 A O5' 1 4 A C5' 1 4 A C4' 1 4 A C3' 1 1
20 . 1 1 4 G O5' 1 1 4 G C5' 1 1 4 G C4' 1 1 4 G C3' 30.0 89.99999 1 5 G O5' 1 5 G C5' 1 5 G C4' 1 5 G C3' 1 1
21 . 1 1 5 G O5' 1 1 5 G C5' 1 1 5 G C4' 1 1 5 G C3' 30.0 89.99999 1 6 G O5' 1 6 G C5' 1 6 G C4' 1 6 G C3' 1 1
22 . 1 1 6 A O5' 1 1 6 A C5' 1 1 6 A C4' 1 1 6 A C3' 30.0 89.99999 1 7 A O5' 1 7 A C5' 1 7 A C4' 1 7 A C3' 1 1
23 . 1 1 7 G O5' 1 1 7 G C5' 1 1 7 G C4' 1 1 7 G C3' 30.0 89.99999 1 8 G O5' 1 8 G C5' 1 8 G C4' 1 8 G C3' 1 1
24 . 1 1 8 G O5' 1 1 8 G C5' 1 1 8 G C4' 1 1 8 G C3' 30.0 89.99999 1 9 G O5' 1 9 G C5' 1 9 G C4' 1 9 G C3' 1 1
25 . 1 1 9 A O5' 1 1 9 A C5' 1 1 9 A C4' 1 1 9 A C3' 30.0 89.99999 1 10 A O5' 1 10 A C5' 1 10 A C4' 1 10 A C3' 1 1
26 . 1 1 1 A C5' 1 1 1 A C4' 1 1 1 A C3' 1 1 1 A O3' 70.0 110.0 1 2 A C5' 1 2 A C4' 1 2 A C3' 1 2 A O3' 1 1
27 . 1 1 2 A C5' 1 1 2 A C4' 1 1 2 A C3' 1 1 2 A O3' 70.0 110.0 1 3 A C5' 1 3 A C4' 1 3 A C3' 1 3 A O3' 1 1
28 . 1 1 3 A C5' 1 1 3 A C4' 1 1 3 A C3' 1 1 3 A O3' 70.0 110.0 1 4 A C5' 1 4 A C4' 1 4 A C3' 1 4 A O3' 1 1
29 . 1 1 4 G C5' 1 1 4 G C4' 1 1 4 G C3' 1 1 4 G O3' 70.0 110.0 1 5 G C5' 1 5 G C4' 1 5 G C3' 1 5 G O3' 1 1
30 . 1 1 5 G C5' 1 1 5 G C4' 1 1 5 G C3' 1 1 5 G O3' 70.0 110.0 1 6 G C5' 1 6 G C4' 1 6 G C3' 1 6 G O3' 1 1
31 . 1 1 6 A C5' 1 1 6 A C4' 1 1 6 A C3' 1 1 6 A O3' 70.0 110.0 1 7 A C5' 1 7 A C4' 1 7 A C3' 1 7 A O3' 1 1
32 . 1 1 7 G C5' 1 1 7 G C4' 1 1 7 G C3' 1 1 7 G O3' 70.0 110.0 1 8 G C5' 1 8 G C4' 1 8 G C3' 1 8 G O3' 1 1
33 . 1 1 8 G C5' 1 1 8 G C4' 1 1 8 G C3' 1 1 8 G O3' 70.0 110.0 1 9 G C5' 1 9 G C4' 1 9 G C3' 1 9 G O3' 1 1
34 . 1 1 9 A C5' 1 1 9 A C4' 1 1 9 A C3' 1 1 9 A O3' 70.0 110.0 1 10 A C5' 1 10 A C4' 1 10 A C3' 1 10 A O3' 1 1
35 . 1 1 1 A C4' 1 1 1 A C3' 1 1 1 A O3' 1 1 2 A P -170.0 -100.0 1 2 A C4' 1 2 A C3' 1 2 A O3' 1 3 A P 1 1
36 . 1 1 2 A C4' 1 1 2 A C3' 1 1 2 A O3' 1 1 3 A P -170.0 -100.0 1 3 A C4' 1 3 A C3' 1 3 A O3' 1 4 A P 1 1
37 . 1 1 3 A C4' 1 1 3 A C3' 1 1 3 A O3' 1 1 4 G P -170.0 -100.0 1 4 A C4' 1 4 A C3' 1 4 A O3' 1 5 G P 1 1
38 . 1 1 4 G C4' 1 1 4 G C3' 1 1 4 G O3' 1 1 5 G P -170.0 -100.0 1 5 G C4' 1 5 G C3' 1 5 G O3' 1 6 G P 1 1
39 . 1 1 5 G C4' 1 1 5 G C3' 1 1 5 G O3' 1 1 6 A P -170.0 -100.0 1 6 G C4' 1 6 G C3' 1 6 G O3' 1 7 A P 1 1
40 . 1 1 6 A C4' 1 1 6 A C3' 1 1 6 A O3' 1 1 7 G P -170.0 -100.0 1 7 A C4' 1 7 A C3' 1 7 A O3' 1 8 G P 1 1
41 . 1 1 7 G C4' 1 1 7 G C3' 1 1 7 G O3' 1 1 8 G P -170.0 -100.0 1 8 G C4' 1 8 G C3' 1 8 G O3' 1 9 G P 1 1
42 . 1 1 8 G C4' 1 1 8 G C3' 1 1 8 G O3' 1 1 9 A P -170.0 -100.0 1 9 G C4' 1 9 G C3' 1 9 G O3' 1 10 A P 1 1
43 . 1 1 1 A C3' 1 1 1 A O3' 1 1 2 A P 1 1 2 A O5' -150.0 150.0 1 2 A C3' 1 2 A O3' 1 3 A P 1 3 A O5' 1 1
44 . 1 1 2 A C3' 1 1 2 A O3' 1 1 3 A P 1 1 3 A O5' -150.0 150.0 1 3 A C3' 1 3 A O3' 1 4 A P 1 4 A O5' 1 1
45 . 1 1 3 A C3' 1 1 3 A O3' 1 1 4 G P 1 1 4 G O5' -150.0 150.0 1 4 A C3' 1 4 A O3' 1 5 G P 1 5 G O5' 1 1
46 . 1 1 4 G C3' 1 1 4 G O3' 1 1 5 G P 1 1 5 G O5' -150.0 150.0 1 5 G C3' 1 5 G O3' 1 6 G P 1 6 G O5' 1 1
47 . 1 1 5 G C3' 1 1 5 G O3' 1 1 6 A P 1 1 6 A O5' -150.0 150.0 1 6 G C3' 1 6 G O3' 1 7 A P 1 7 A O5' 1 1
48 . 1 1 6 A C3' 1 1 6 A O3' 1 1 7 G P 1 1 7 G O5' -150.0 150.0 1 7 A C3' 1 7 A O3' 1 8 G P 1 8 G O5' 1 1
49 . 1 1 7 G C3' 1 1 7 G O3' 1 1 8 G P 1 1 8 G O5' -150.0 150.0 1 8 G C3' 1 8 G O3' 1 9 G P 1 9 G O5' 1 1
50 . 1 1 8 G C3' 1 1 8 G O3' 1 1 9 A P 1 1 9 A O5' -150.0 150.0 1 9 G C3' 1 9 G O3' 1 10 A P 1 10 A O5' 1 1
51 . 1 1 1 A O4' 1 1 1 A C1' 1 1 1 A N9 1 1 1 A C4 150.0 210.0 1 2 A O4' 1 2 A C1' 1 2 A N9 1 2 A C4 1 1
52 . 1 1 2 A O4' 1 1 2 A C1' 1 1 2 A N9 1 1 2 A C4 150.0 210.0 1 3 A O4' 1 3 A C1' 1 3 A N9 1 3 A C4 1 1
53 . 1 1 3 A O4' 1 1 3 A C1' 1 1 3 A N9 1 1 3 A C4 150.0 210.0 1 4 A O4' 1 4 A C1' 1 4 A N9 1 4 A C4 1 1
54 . 1 1 4 G O4' 1 1 4 G C1' 1 1 4 G N9 1 1 4 G C4 150.0 210.0 1 5 G O4' 1 5 G C1' 1 5 G N9 1 5 G C4 1 1
55 . 1 1 5 G O4' 1 1 5 G C1' 1 1 5 G N9 1 1 5 G C4 150.0 210.0 1 6 G O4' 1 6 G C1' 1 6 G N9 1 6 G C4 1 1
56 . 1 1 6 A O4' 1 1 6 A C1' 1 1 6 A N9 1 1 6 A C4 150.0 210.0 1 7 A O4' 1 7 A C1' 1 7 A N9 1 7 A C4 1 1
57 . 1 1 7 G O4' 1 1 7 G C1' 1 1 7 G N9 1 1 7 G C4 150.0 210.0 1 8 G O4' 1 8 G C1' 1 8 G N9 1 8 G C4 1 1
58 . 1 1 8 G O4' 1 1 8 G C1' 1 1 8 G N9 1 1 8 G C4 150.0 210.0 1 9 G O4' 1 9 G C1' 1 9 G N9 1 9 G C4 1 1
59 . 1 1 9 A O4' 1 1 9 A C1' 1 1 9 A N9 1 1 9 A C4 150.0 210.0 1 10 A O4' 1 10 A C1' 1 10 A N9 1 10 A C4 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 A C1' C 4.750 -6.776 14.103 1.00 . A A . 2 A C1' 1 1
1 2 1 1 1 A C2 C 0.429 -8.201 13.126 1.00 . A A . 2 A C2 1 1
1 3 1 1 1 A C2' C 5.356 -7.831 13.146 1.00 . A A . 2 A C2' 1 1
1 4 1 1 1 A C3' C 6.544 -7.083 12.554 1.00 . A A . 2 A C3' 1 1
1 5 1 1 1 A C4 C 2.234 -6.712 13.362 1.00 . A A . 2 A C4 1 1
1 6 1 1 1 A C4' C 6.998 -6.190 13.711 1.00 . A A . 2 A C4' 1 1
1 7 1 1 1 A C5 C 1.281 -5.629 13.133 1.00 . A A . 2 A C5 1 1
1 8 1 1 1 A C5' C 7.904 -5.000 13.324 1.00 . A A . 2 A C5' 1 1
1 9 1 1 1 A C6 C -0.107 -5.992 12.928 1.00 . A A . 2 A C6 1 1
1 10 1 1 1 A C8 C 3.170 -4.802 13.407 1.00 . A A . 2 A C8 1 1
1 11 1 1 1 A H1' H 4.515 -7.255 15.070 1.00 . A A . 2 A H1' 1 1
1 12 1 1 1 A H2 H 0.055 -9.214 13.100 1.00 . A A . 2 A H2 1 1
1 13 1 1 1 A H2' H 4.660 -8.165 12.353 1.00 . A A . 2 A H2' 1 1
1 14 1 1 1 A H3' H 6.157 -6.447 11.734 1.00 . A A . 2 A H3' 1 1
1 15 1 1 1 A H4' H 7.546 -6.804 14.452 1.00 . A A . 2 A H4' 1 1
1 16 1 1 1 A H5' H 7.866 -4.219 14.105 1.00 . A A . 2 A H5' 1 1
1 17 1 1 1 A H5'' H 8.957 -5.339 13.287 1.00 . A A . 2 A H5'' 1 1
1 18 1 1 1 A H61 H -2.002 -5.431 12.592 1.00 . A A . 2 A H61 1 1
1 19 1 1 1 A H62 H -0.742 -4.098 12.718 1.00 . A A . 2 A H62 1 1
1 20 1 1 1 A H8 H 3.946 -4.056 13.507 1.00 . A A . 2 A H8 1 1
1 21 1 1 1 A HO2' H 6.584 -9.274 13.378 1.00 . A A . 2 A HO2' 1 1
1 22 1 1 1 A HO5' H 7.876 -5.075 11.379 1.00 . A A . 2 A HO5' 1 1
1 23 1 1 1 A N1 N -0.470 -7.260 12.930 1.00 . A A . 2 A N1 1 1
1 24 1 1 1 A N3 N 1.714 -8.082 13.345 1.00 . A A . 2 A N3 1 1
1 25 1 1 1 A N6 N -1.051 -5.077 12.736 1.00 . A A . 2 A N6 1 1
1 26 1 1 1 A N7 N 1.883 -4.378 13.154 1.00 . A A . 2 A N7 1 1
1 27 1 1 1 A N9 N 3.494 -6.147 13.571 1.00 . A A . 2 A N9 1 1
1 28 1 1 1 A O2' O 5.815 -8.970 13.871 1.00 . A A . 2 A O2' 1 1
1 29 1 1 1 A O3' O 7.605 -7.940 12.097 1.00 . A A . 2 A O3' 1 1
1 30 1 1 1 A O4' O 5.770 -5.764 14.321 1.00 . A A . 2 A O4' 1 1
1 31 1 1 1 A O5' O 7.575 -4.433 12.055 1.00 . A A . 2 A O5' 1 1
1 32 1 1 2 A C1' C 3.485 -9.349 9.359 1.00 . A A . 3 A C1' 1 1
1 33 1 1 2 A C2 C -0.327 -6.740 9.260 1.00 . A A . 3 A C2 1 1
1 34 1 1 2 A C2' C 3.650 -9.679 7.863 1.00 . A A . 3 A C2' 1 1
1 35 1 1 2 A C3' C 5.172 -9.676 7.667 1.00 . A A . 3 A C3' 1 1
1 36 1 1 2 A C4 C 1.953 -7.246 9.482 1.00 . A A . 3 A C4 1 1
1 37 1 1 2 A C4' C 5.656 -10.211 9.022 1.00 . A A . 3 A C4' 1 1
1 38 1 1 2 A C5 C 2.198 -5.811 9.582 1.00 . A A . 3 A C5 1 1
1 39 1 1 2 A C5' C 7.087 -9.825 9.431 1.00 . A A . 3 A C5' 1 1
1 40 1 1 2 A C6 C 1.049 -4.934 9.505 1.00 . A A . 3 A C6 1 1
1 41 1 1 2 A C8 C 4.018 -6.803 9.720 1.00 . A A . 3 A C8 1 1
1 42 1 1 2 A H1' H 2.667 -9.954 9.795 1.00 . A A . 3 A H1' 1 1
1 43 1 1 2 A H2 H -1.347 -7.068 9.121 1.00 . A A . 3 A H2 1 1
1 44 1 1 2 A H2' H 3.167 -8.936 7.202 1.00 . A A . 3 A H2' 1 1
1 45 1 1 2 A H3' H 5.524 -8.634 7.530 1.00 . A A . 3 A H3' 1 1
1 46 1 1 2 A H4' H 5.584 -11.316 9.011 1.00 . A A . 3 A H4' 1 1
1 47 1 1 2 A H5' H 7.334 -10.322 10.389 1.00 . A A . 3 A H5' 1 1
1 48 1 1 2 A H5'' H 7.814 -10.212 8.692 1.00 . A A . 3 A H5'' 1 1
1 49 1 1 2 A H61 H 0.296 -3.070 9.538 1.00 . A A . 3 A H61 1 1
1 50 1 1 2 A H62 H 2.114 -3.248 9.725 1.00 . A A . 3 A H62 1 1
1 51 1 1 2 A H8 H 5.081 -6.967 9.813 1.00 . A A . 3 A H8 1 1
1 52 1 1 2 A HO2' H 2.834 -10.938 6.662 1.00 . A A . 3 A HO2' 1 1
1 53 1 1 2 A N1 N -0.158 -5.438 9.347 1.00 . A A . 3 A N1 1 1
1 54 1 1 2 A N3 N 0.569 -7.690 9.305 1.00 . A A . 3 A N3 1 1
1 55 1 1 2 A N6 N 1.164 -3.615 9.603 1.00 . A A . 3 A N6 1 1
1 56 1 1 2 A N7 N 3.543 -5.510 9.746 1.00 . A A . 3 A N7 1 1
1 57 1 1 2 A N9 N 3.176 -7.899 9.569 1.00 . A A . 3 A N9 1 1
1 58 1 1 2 A O2' O 3.086 -10.961 7.592 1.00 . A A . 3 A O2' 1 1
1 59 1 1 2 A O3' O 5.617 -10.501 6.571 1.00 . A A . 3 A O3' 1 1
1 60 1 1 2 A O4' O 4.723 -9.712 10.004 1.00 . A A . 3 A O4' 1 1
1 61 1 1 2 A O5' O 7.237 -8.396 9.548 1.00 . A A . 3 A O5' 1 1
1 62 1 1 2 A OP1 O 9.614 -8.403 10.561 1.00 . A A . 3 A OP1 1 1
1 63 1 1 2 A OP2 O 8.382 -6.227 10.359 1.00 . A A . 3 A OP2 1 1
1 64 1 1 2 A P P 8.242 -7.732 10.625 1.00 . A A . 3 A P 1 1
1 65 1 1 3 A C1' C 0.169 -9.494 5.182 1.00 . A A . 4 A C1' 1 1
1 66 1 1 3 A C2 C -2.249 -5.638 6.085 1.00 . A A . 4 A C2 1 1
1 67 1 1 3 A C2' C -0.185 -9.817 3.722 1.00 . A A . 4 A C2' 1 1
1 68 1 1 3 A C3' C 1.140 -10.328 3.149 1.00 . A A . 4 A C3' 1 1
1 69 1 1 3 A C4 C -0.366 -6.976 5.645 1.00 . A A . 4 A C4 1 1
1 70 1 1 3 A C4' C 1.706 -11.092 4.356 1.00 . A A . 4 A C4' 1 1
1 71 1 1 3 A C5 C 0.434 -5.758 5.714 1.00 . A A . 4 A C5 1 1
1 72 1 1 3 A C5' C 3.230 -11.309 4.344 1.00 . A A . 4 A C5' 1 1
1 73 1 1 3 A C6 C -0.264 -4.518 5.986 1.00 . A A . 4 A C6 1 1
1 74 1 1 3 A C8 C 1.700 -7.356 5.301 1.00 . A A . 4 A C8 1 1
1 75 1 1 3 A H1' H -0.691 -9.751 5.825 1.00 . A A . 4 A H1' 1 1
1 76 1 1 3 A H2 H -3.315 -5.549 6.235 1.00 . A A . 4 A H2 1 1
1 77 1 1 3 A H2' H -0.559 -8.945 3.163 1.00 . A A . 4 A H2' 1 1
1 78 1 1 3 A H3' H 1.801 -9.473 2.900 1.00 . A A . 4 A H3' 1 1
1 79 1 1 3 A H4' H 1.221 -12.087 4.399 1.00 . A A . 4 A H4' 1 1
1 80 1 1 3 A H5' H 3.502 -12.044 5.124 1.00 . A A . 4 A H5' 1 1
1 81 1 1 3 A H5'' H 3.550 -11.758 3.384 1.00 . A A . 4 A H5'' 1 1
1 82 1 1 3 A H61 H -0.198 -2.533 6.278 1.00 . A A . 4 A H61 1 1
1 83 1 1 3 A H62 H 1.393 -3.386 5.922 1.00 . A A . 4 A H62 1 1
1 84 1 1 3 A H8 H 2.604 -7.898 5.059 1.00 . A A . 4 A H8 1 1
1 85 1 1 3 A HO2' H -1.004 -11.306 2.848 1.00 . A A . 4 A HO2' 1 1
1 86 1 1 3 A N1 N -1.571 -4.514 6.163 1.00 . A A . 4 A N1 1 1
1 87 1 1 3 A N3 N -1.812 -6.849 5.851 1.00 . A A . 4 A N3 1 1
1 88 1 1 3 A N6 N 0.379 -3.360 6.071 1.00 . A A . 4 A N6 1 1
1 89 1 1 3 A N7 N 1.785 -5.995 5.498 1.00 . A A . 4 A N7 1 1
1 90 1 1 3 A N9 N 0.491 -8.042 5.378 1.00 . A A . 4 A N9 1 1
1 91 1 1 3 A O2' O -1.171 -10.847 3.677 1.00 . A A . 4 A O2' 1 1
1 92 1 1 3 A O3' O 0.948 -11.177 2.000 1.00 . A A . 4 A O3' 1 1
1 93 1 1 3 A O4' O 1.297 -10.337 5.519 1.00 . A A . 4 A O4' 1 1
1 94 1 1 3 A O5' O 3.938 -10.075 4.564 1.00 . A A . 4 A O5' 1 1
1 95 1 1 3 A OP1 O 6.310 -10.988 4.145 1.00 . A A . 4 A OP1 1 1
1 96 1 1 3 A OP2 O 6.029 -8.613 4.868 1.00 . A A . 4 A OP2 1 1
1 97 1 1 3 A P P 5.492 -10.037 5.021 1.00 . A A . 4 A P 1 1
1 98 1 1 4 G C1' C -3.497 -7.492 1.869 1.00 . A A . 5 G C1' 1 1
1 99 1 1 4 G C2 C -3.809 -3.012 2.996 1.00 . A A . 5 G C2 1 1
1 100 1 1 4 G C2' C -4.150 -7.393 0.475 1.00 . A A . 5 G C2' 1 1
1 101 1 1 4 G C3' C -3.363 -8.415 -0.351 1.00 . A A . 5 G C3' 1 1
1 102 1 1 4 G C4 C -2.693 -5.069 2.429 1.00 . A A . 5 G C4 1 1
1 103 1 1 4 G C4' C -3.093 -9.502 0.698 1.00 . A A . 5 G C4' 1 1
1 104 1 1 4 G C5 C -1.413 -4.420 2.485 1.00 . A A . 5 G C5 1 1
1 105 1 1 4 G C5' C -1.922 -10.449 0.380 1.00 . A A . 5 G C5' 1 1
1 106 1 1 4 G C6 C -1.328 -2.918 2.866 1.00 . A A . 5 G C6 1 1
1 107 1 1 4 G C8 C -1.104 -6.401 1.975 1.00 . A A . 5 G C8 1 1
1 108 1 1 4 G H1 H -2.464 -1.318 3.340 1.00 . A A . 5 G H1 1 1
1 109 1 1 4 G H1' H -4.272 -7.421 2.656 1.00 . A A . 5 G H1' 1 1
1 110 1 1 4 G H2' H -4.088 -6.383 0.031 1.00 . A A . 5 G H2' 1 1
1 111 1 1 4 G H21 H -4.931 -1.293 3.390 1.00 . A A . 5 G H21 1 1
1 112 1 1 4 G H22 H -5.877 -2.802 3.110 1.00 . A A . 5 G H22 1 1
1 113 1 1 4 G H3' H -2.403 -7.971 -0.688 1.00 . A A . 5 G H3' 1 1
1 114 1 1 4 G H4' H -4.006 -10.119 0.806 1.00 . A A . 5 G H4' 1 1
1 115 1 1 4 G H5' H -1.928 -11.285 1.104 1.00 . A A . 5 G H5' 1 1
1 116 1 1 4 G H5'' H -2.064 -10.913 -0.615 1.00 . A A . 5 G H5'' 1 1
1 117 1 1 4 G H8 H -0.589 -7.320 1.732 1.00 . A A . 5 G H8 1 1
1 118 1 1 4 G HO2' H -5.717 -8.149 -0.313 1.00 . A A . 5 G HO2' 1 1
1 119 1 1 4 G N1 N -2.524 -2.315 3.107 1.00 . A A . 5 G N1 1 1
1 120 1 1 4 G N2 N -4.989 -2.297 3.183 1.00 . A A . 5 G N2 1 1
1 121 1 1 4 G N3 N -3.865 -4.270 2.709 1.00 . A A . 5 G N3 1 1
1 122 1 1 4 G N7 N -0.359 -5.264 2.194 1.00 . A A . 5 G N7 1 1
1 123 1 1 4 G N9 N -2.489 -6.402 2.090 1.00 . A A . 5 G N9 1 1
1 124 1 1 4 G O2' O -5.522 -7.774 0.551 1.00 . A A . 5 G O2' 1 1
1 125 1 1 4 G O3' O -4.116 -8.926 -1.470 1.00 . A A . 5 G O3' 1 1
1 126 1 1 4 G O4' O -2.879 -8.798 1.939 1.00 . A A . 5 G O4' 1 1
1 127 1 1 4 G O5' O -0.652 -9.771 0.421 1.00 . A A . 5 G O5' 1 1
1 128 1 1 4 G O6 O -0.274 -2.292 2.952 1.00 . A A . 5 G O6 1 1
1 129 1 1 4 G OP1 O 0.746 -11.732 -0.498 1.00 . A A . 5 G OP1 1 1
1 130 1 1 4 G OP2 O 1.905 -9.626 0.182 1.00 . A A . 5 G OP2 1 1
1 131 1 1 4 G P P 0.753 -10.577 0.504 1.00 . A A . 5 G P 1 1
1 132 1 1 5 G C1' C -6.072 -3.552 -1.011 1.00 . A A . 6 G C1' 1 1
1 133 1 1 5 G C2 C -3.742 0.231 0.282 1.00 . A A . 6 G C2 1 1
1 134 1 1 5 G C2' C -6.790 -3.052 -2.272 1.00 . A A . 6 G C2' 1 1
1 135 1 1 5 G C3' C -6.731 -4.265 -3.201 1.00 . A A . 6 G C3' 1 1
1 136 1 1 5 G C4 C -4.014 -2.017 -0.537 1.00 . A A . 6 G C4 1 1
1 137 1 1 5 G C4' C -6.923 -5.411 -2.196 1.00 . A A . 6 G C4' 1 1
1 138 1 1 5 G C5 C -2.590 -2.197 -0.594 1.00 . A A . 6 G C5 1 1
1 139 1 1 5 G C5' C -6.415 -6.787 -2.659 1.00 . A A . 6 G C5' 1 1
1 140 1 1 5 G C6 C -1.652 -1.051 -0.133 1.00 . A A . 6 G C6 1 1
1 141 1 1 5 G C8 C -3.481 -3.924 -1.300 1.00 . A A . 6 G C8 1 1
1 142 1 1 5 G H1 H -1.659 0.848 0.553 1.00 . A A . 6 G H1 1 1
1 143 1 1 5 G H1' H -6.556 -3.094 -0.133 1.00 . A A . 6 G H1' 1 1
1 144 1 1 5 G H2' H -6.316 -2.164 -2.712 1.00 . A A . 6 G H2' 1 1
1 145 1 1 5 G H21 H -3.676 2.232 0.876 1.00 . A A . 6 G H21 1 1
1 146 1 1 5 G H22 H -5.323 1.543 0.620 1.00 . A A . 6 G H22 1 1
1 147 1 1 5 G H3' H -5.728 -4.336 -3.671 1.00 . A A . 6 G H3' 1 1
1 148 1 1 5 G H4' H -8.004 -5.507 -1.973 1.00 . A A . 6 G H4' 1 1
1 149 1 1 5 G H5' H -6.735 -7.555 -1.930 1.00 . A A . 6 G H5' 1 1
1 150 1 1 5 G H5'' H -6.887 -7.067 -3.620 1.00 . A A . 6 G H5'' 1 1
1 151 1 1 5 G H8 H -3.587 -4.911 -1.727 1.00 . A A . 6 G H8 1 1
1 152 1 1 5 G HO2' H -8.633 -2.973 -2.768 1.00 . A A . 6 G HO2' 1 1
1 153 1 1 5 G N1 N -2.284 0.081 0.284 1.00 . A A . 6 G N1 1 1
1 154 1 1 5 G N2 N -4.303 1.456 0.636 1.00 . A A . 6 G N2 1 1
1 155 1 1 5 G N3 N -4.513 -0.744 -0.069 1.00 . A A . 6 G N3 1 1
1 156 1 1 5 G N7 N -2.214 -3.430 -1.089 1.00 . A A . 6 G N7 1 1
1 157 1 1 5 G N9 N -4.617 -3.186 -0.986 1.00 . A A . 6 G N9 1 1
1 158 1 1 5 G O2' O -8.149 -2.733 -1.972 1.00 . A A . 6 G O2' 1 1
1 159 1 1 5 G O3' O -7.767 -4.231 -4.203 1.00 . A A . 6 G O3' 1 1
1 160 1 1 5 G O4' O -6.254 -4.988 -0.985 1.00 . A A . 6 G O4' 1 1
1 161 1 1 5 G O5' O -4.983 -6.807 -2.799 1.00 . A A . 6 G O5' 1 1
1 162 1 1 5 G O6 O -0.426 -1.132 -0.133 1.00 . A A . 6 G O6 1 1
1 163 1 1 5 G OP1 O -4.819 -9.113 -3.931 1.00 . A A . 6 G OP1 1 1
1 164 1 1 5 G OP2 O -2.719 -7.882 -3.367 1.00 . A A . 6 G OP2 1 1
1 165 1 1 5 G P P -4.147 -8.188 -2.914 1.00 . A A . 6 G P 1 1
1 166 1 1 6 A C1' C -6.188 1.284 -3.362 1.00 . A A . 7 A C1' 1 1
1 167 1 1 6 A C2 C -1.918 2.874 -2.494 1.00 . A A . 7 A C2 1 1
1 168 1 1 6 A C2' C -6.560 2.186 -4.554 1.00 . A A . 7 A C2' 1 1
1 169 1 1 6 A C3' C -7.315 1.232 -5.485 1.00 . A A . 7 A C3' 1 1
1 170 1 1 6 A C4 C -3.580 1.363 -3.186 1.00 . A A . 7 A C4 1 1
1 171 1 1 6 A C4' C -8.058 0.353 -4.468 1.00 . A A . 7 A C4' 1 1
1 172 1 1 6 A C5 C -2.509 0.408 -3.450 1.00 . A A . 7 A C5 1 1
1 173 1 1 6 A C5' C -8.516 -1.021 -4.989 1.00 . A A . 7 A C5' 1 1
1 174 1 1 6 A C6 C -1.154 0.829 -3.164 1.00 . A A . 7 A C6 1 1
1 175 1 1 6 A C8 C -4.327 -0.502 -3.885 1.00 . A A . 7 A C8 1 1
1 176 1 1 6 A H1' H -6.264 1.861 -2.422 1.00 . A A . 7 A H1' 1 1
1 177 1 1 6 A H2 H -1.640 3.859 -2.146 1.00 . A A . 7 A H2 1 1
1 178 1 1 6 A H2' H -5.684 2.632 -5.053 1.00 . A A . 7 A H2' 1 1
1 179 1 1 6 A H3' H -6.594 0.615 -6.059 1.00 . A A . 7 A H3' 1 1
1 180 1 1 6 A H4' H -8.958 0.899 -4.122 1.00 . A A . 7 A H4' 1 1
1 181 1 1 6 A H5' H -9.132 -1.515 -4.215 1.00 . A A . 7 A H5' 1 1
1 182 1 1 6 A H5'' H -9.178 -0.893 -5.867 1.00 . A A . 7 A H5'' 1 1
1 183 1 1 6 A H61 H 0.808 0.368 -3.075 1.00 . A A . 7 A H61 1 1
1 184 1 1 6 A H62 H -0.339 -0.925 -3.688 1.00 . A A . 7 A H62 1 1
1 185 1 1 6 A H8 H -5.036 -1.284 -4.118 1.00 . A A . 7 A H8 1 1
1 186 1 1 6 A HO2' H -7.987 3.413 -4.883 1.00 . A A . 7 A HO2' 1 1
1 187 1 1 6 A N1 N -0.921 2.040 -2.696 1.00 . A A . 7 A N1 1 1
1 188 1 1 6 A N3 N -3.199 2.684 -2.677 1.00 . A A . 7 A N3 1 1
1 189 1 1 6 A N6 N -0.119 0.017 -3.344 1.00 . A A . 7 A N6 1 1
1 190 1 1 6 A N7 N -2.985 -0.812 -3.911 1.00 . A A . 7 A N7 1 1
1 191 1 1 6 A N9 N -4.793 0.746 -3.481 1.00 . A A . 7 A N9 1 1
1 192 1 1 6 A O2' O -7.423 3.238 -4.124 1.00 . A A . 7 A O2' 1 1
1 193 1 1 6 A O3' O -8.220 1.924 -6.370 1.00 . A A . 7 A O3' 1 1
1 194 1 1 6 A O4' O -7.162 0.214 -3.344 1.00 . A A . 7 A O4' 1 1
1 195 1 1 6 A O5' O -7.403 -1.863 -5.344 1.00 . A A . 7 A O5' 1 1
1 196 1 1 6 A OP1 O -8.807 -3.698 -6.489 1.00 . A A . 7 A OP1 1 1
1 197 1 1 6 A OP2 O -6.331 -3.985 -6.326 1.00 . A A . 7 A OP2 1 1
1 198 1 1 6 A P P -7.575 -3.453 -5.615 1.00 . A A . 7 A P 1 1
1 199 1 1 7 G C1' C -3.921 5.722 -5.701 1.00 . A A . 8 G C1' 1 1
1 200 1 1 7 G C2 C 0.636 5.007 -5.328 1.00 . A A . 8 G C2 1 1
1 201 1 1 7 G C2' C -3.868 6.769 -6.831 1.00 . A A . 8 G C2' 1 1
1 202 1 1 7 G C3' C -5.082 6.406 -7.690 1.00 . A A . 8 G C3' 1 1
1 203 1 1 7 G C4 C -1.654 4.430 -5.799 1.00 . A A . 8 G C4 1 1
1 204 1 1 7 G C4' C -6.086 5.968 -6.613 1.00 . A A . 8 G C4' 1 1
1 205 1 1 7 G C5 C -1.271 3.095 -6.163 1.00 . A A . 8 G C5 1 1
1 206 1 1 7 G C5' C -7.231 5.065 -7.102 1.00 . A A . 8 G C5' 1 1
1 207 1 1 7 G C6 C 0.215 2.667 -6.056 1.00 . A A . 8 G C6 1 1
1 208 1 1 7 G C8 C -3.306 3.281 -6.470 1.00 . A A . 8 G C8 1 1
1 209 1 1 7 G H1 H 2.056 3.365 -5.602 1.00 . A A . 8 G H1 1 1
1 210 1 1 7 G H1' H -3.606 6.183 -4.745 1.00 . A A . 8 G H1' 1 1
1 211 1 1 7 G H2' H -2.931 6.735 -7.411 1.00 . A A . 8 G H2' 1 1
1 212 1 1 7 G H21 H 2.581 5.696 -4.989 1.00 . A A . 8 G H21 1 1
1 213 1 1 7 G H22 H 1.269 6.916 -4.787 1.00 . A A . 8 G H22 1 1
1 214 1 1 7 G H3' H -4.837 5.546 -8.348 1.00 . A A . 8 G H3' 1 1
1 215 1 1 7 G H4' H -6.538 6.874 -6.164 1.00 . A A . 8 G H4' 1 1
1 216 1 1 7 G H5' H -7.958 4.926 -6.280 1.00 . A A . 8 G H5' 1 1
1 217 1 1 7 G H5'' H -7.788 5.562 -7.919 1.00 . A A . 8 G H5'' 1 1
1 218 1 1 7 G H8 H -4.318 3.029 -6.756 1.00 . A A . 8 G H8 1 1
1 219 1 1 7 G HO2' H -4.519 8.559 -6.968 1.00 . A A . 8 G HO2' 1 1
1 220 1 1 7 G N1 N 1.069 3.641 -5.639 1.00 . A A . 8 G N1 1 1
1 221 1 1 7 G N2 N 1.592 5.970 -5.010 1.00 . A A . 8 G N2 1 1
1 222 1 1 7 G N3 N -0.611 5.339 -5.375 1.00 . A A . 8 G N3 1 1
1 223 1 1 7 G N7 N -2.326 2.324 -6.607 1.00 . A A . 8 G N7 1 1
1 224 1 1 7 G N9 N -3.026 4.551 -5.980 1.00 . A A . 8 G N9 1 1
1 225 1 1 7 G O2' O -4.022 8.082 -6.296 1.00 . A A . 8 G O2' 1 1
1 226 1 1 7 G O3' O -5.563 7.526 -8.462 1.00 . A A . 8 G O3' 1 1
1 227 1 1 7 G O4' O -5.303 5.308 -5.595 1.00 . A A . 8 G O4' 1 1
1 228 1 1 7 G O5' O -6.750 3.785 -7.552 1.00 . A A . 8 G O5' 1 1
1 229 1 1 7 G O6 O 0.622 1.541 -6.334 1.00 . A A . 8 G O6 1 1
1 230 1 1 7 G OP1 O -8.977 2.995 -8.577 1.00 . A A . 8 G OP1 1 1
1 231 1 1 7 G OP2 O -7.013 1.452 -8.598 1.00 . A A . 8 G OP2 1 1
1 232 1 1 7 G P P -7.744 2.530 -7.799 1.00 . A A . 8 G P 1 1
1 233 1 1 8 G C1' C 0.114 8.127 -8.487 1.00 . A A . 9 G C1' 1 1
1 234 1 1 8 G C2 C 3.356 4.844 -8.770 1.00 . A A . 9 G C2 1 1
1 235 1 1 8 G C2' C 0.643 9.018 -9.621 1.00 . A A . 9 G C2' 1 1
1 236 1 1 8 G C3' C -0.636 9.510 -10.302 1.00 . A A . 9 G C3' 1 1
1 237 1 1 8 G C4 C 1.132 5.758 -8.875 1.00 . A A . 9 G C4 1 1
1 238 1 1 8 G C4' C -1.576 9.663 -9.094 1.00 . A A . 9 G C4' 1 1
1 239 1 1 8 G C5 C 0.590 4.472 -9.205 1.00 . A A . 9 G C5 1 1
1 240 1 1 8 G C5' C -3.081 9.609 -9.409 1.00 . A A . 9 G C5' 1 1
1 241 1 1 8 G C6 C 1.527 3.241 -9.277 1.00 . A A . 9 G C6 1 1
1 242 1 1 8 G C8 C -0.956 5.843 -9.241 1.00 . A A . 9 G C8 1 1
1 243 1 1 8 G H1 H 3.461 2.685 -9.117 1.00 . A A . 9 G H1 1 1
1 244 1 1 8 G H1' H 0.764 8.243 -7.603 1.00 . A A . 9 G H1' 1 1
1 245 1 1 8 G H2' H 1.302 8.481 -10.323 1.00 . A A . 9 G H2' 1 1
1 246 1 1 8 G H21 H 5.360 4.240 -8.810 1.00 . A A . 9 G H21 1 1
1 247 1 1 8 G H22 H 5.067 5.989 -8.484 1.00 . A A . 9 G H22 1 1
1 248 1 1 8 G H3' H -1.025 8.730 -10.989 1.00 . A A . 9 G H3' 1 1
1 249 1 1 8 G H4' H -1.366 10.634 -8.605 1.00 . A A . 9 G H4' 1 1
1 250 1 1 8 G H5' H -3.650 9.856 -8.494 1.00 . A A . 9 G H5' 1 1
1 251 1 1 8 G H5'' H -3.346 10.384 -10.153 1.00 . A A . 9 G H5'' 1 1
1 252 1 1 8 G H8 H -1.949 6.251 -9.362 1.00 . A A . 9 G H8 1 1
1 253 1 1 8 G HO2' H 1.077 10.877 -9.609 1.00 . A A . 9 G HO2' 1 1
1 254 1 1 8 G N1 N 2.842 3.497 -9.038 1.00 . A A . 9 G N1 1 1
1 255 1 1 8 G N2 N 4.733 5.042 -8.681 1.00 . A A . 9 G N2 1 1
1 256 1 1 8 G N3 N 2.559 5.853 -8.659 1.00 . A A . 9 G N3 1 1
1 257 1 1 8 G N7 N -0.768 4.497 -9.458 1.00 . A A . 9 G N7 1 1
1 258 1 1 8 G N9 N 0.091 6.678 -8.868 1.00 . A A . 9 G N9 1 1
1 259 1 1 8 G O2' O 1.359 10.126 -9.077 1.00 . A A . 9 G O2' 1 1
1 260 1 1 8 G O3' O -0.424 10.755 -11.000 1.00 . A A . 9 G O3' 1 1
1 261 1 1 8 G O4' O -1.211 8.611 -8.174 1.00 . A A . 9 G O4' 1 1
1 262 1 1 8 G O5' O -3.475 8.314 -9.897 1.00 . A A . 9 G O5' 1 1
1 263 1 1 8 G O6 O 1.141 2.105 -9.540 1.00 . A A . 9 G O6 1 1
1 264 1 1 8 G OP1 O -5.875 8.970 -10.563 1.00 . A A . 9 G OP1 1 1
1 265 1 1 8 G OP2 O -5.143 6.597 -10.829 1.00 . A A . 9 G OP2 1 1
1 266 1 1 8 G P P -5.026 7.848 -9.959 1.00 . A A . 9 G P 1 1
1 267 1 1 9 A C1' C 4.165 7.314 -11.970 1.00 . A A . 10 A C1' 1 1
1 268 1 1 9 A C2 C 3.962 2.713 -12.510 1.00 . A A . 10 A C2 1 1
1 269 1 1 9 A C2' C 4.922 7.744 -13.247 1.00 . A A . 10 A C2' 1 1
1 270 1 1 9 A C3' C 4.276 9.088 -13.592 1.00 . A A . 10 A C3' 1 1
1 271 1 1 9 A C4 C 3.190 4.932 -12.424 1.00 . A A . 10 A C4 1 1
1 272 1 1 9 A C4' C 3.922 9.654 -12.210 1.00 . A A . 10 A C4' 1 1
1 273 1 1 9 A C5 C 1.855 4.408 -12.691 1.00 . A A . 10 A C5 1 1
1 274 1 1 9 A C5' C 2.763 10.668 -12.201 1.00 . A A . 10 A C5' 1 1
1 275 1 1 9 A C6 C 1.720 2.973 -12.842 1.00 . A A . 10 A C6 1 1
1 276 1 1 9 A C8 C 1.717 6.470 -12.435 1.00 . A A . 10 A C8 1 1
1 277 1 1 9 A H1' H 4.869 6.869 -11.240 1.00 . A A . 10 A H1' 1 1
1 278 1 1 9 A H2 H 4.775 2.005 -12.426 1.00 . A A . 10 A H2 1 1
1 279 1 1 9 A H2' H 4.813 7.026 -14.082 1.00 . A A . 10 A H2' 1 1
1 280 1 1 9 A H3' H 3.357 8.918 -14.187 1.00 . A A . 10 A H3' 1 1
1 281 1 1 9 A H4' H 4.816 10.145 -11.779 1.00 . A A . 10 A H4' 1 1
1 282 1 1 9 A H5' H 2.631 11.064 -11.177 1.00 . A A . 10 A H5' 1 1
1 283 1 1 9 A H5'' H 3.012 11.540 -12.835 1.00 . A A . 10 A H5'' 1 1
1 284 1 1 9 A H61 H 0.537 1.376 -13.097 1.00 . A A . 10 A H61 1 1
1 285 1 1 9 A H62 H -0.273 3.025 -13.075 1.00 . A A . 10 A H62 1 1
1 286 1 1 9 A H8 H 1.272 7.445 -12.286 1.00 . A A . 10 A H8 1 1
1 287 1 1 9 A HO2' H 6.640 7.044 -12.702 1.00 . A A . 10 A HO2' 1 1
1 288 1 1 9 A HO3' H 6.039 9.725 -13.951 1.00 . A A . 10 A HO3' 1 1
1 289 1 1 9 A N1 N 2.778 2.190 -12.747 1.00 . A A . 10 A N1 1 1
1 290 1 1 9 A N3 N 4.292 3.968 -12.344 1.00 . A A . 10 A N3 1 1
1 291 1 1 9 A N6 N 0.541 2.400 -13.050 1.00 . A A . 10 A N6 1 1
1 292 1 1 9 A N7 N 0.886 5.404 -12.703 1.00 . A A . 10 A N7 1 1
1 293 1 1 9 A N9 N 3.091 6.312 -12.265 1.00 . A A . 10 A N9 1 1
1 294 1 1 9 A O2' O 6.312 7.910 -12.957 1.00 . A A . 10 A O2' 1 1
1 295 1 1 9 A O3' O 5.170 9.933 -14.307 1.00 . A A . 10 A O3' 1 1
1 296 1 1 9 A O4' O 3.608 8.513 -11.389 1.00 . A A . 10 A O4' 1 1
1 297 1 1 9 A O5' O 1.535 10.070 -12.661 1.00 . A A . 10 A O5' 1 1
1 298 1 1 9 A OP1 O 0.234 12.270 -12.971 1.00 . A A . 10 A OP1 1 1
1 299 1 1 9 A OP2 O -0.908 10.100 -13.443 1.00 . A A . 10 A OP2 1 1
1 300 1 1 9 A P P 0.098 10.809 -12.537 1.00 . A A . 10 A P 1 1
1 301 2 2 1 5PC C1' C 8.467 0.320 -9.487 1.00 . B B . 1 5PC C1' 1 1
1 302 2 2 1 5PC C2 C 6.108 1.177 -9.476 1.00 . B B . 1 5PC C2 1 1
1 303 2 2 1 5PC C2' C 9.191 0.825 -8.236 1.00 . B B . 1 5PC C2' 1 1
1 304 2 2 1 5PC C3' C 9.693 -0.451 -7.575 1.00 . B B . 1 5PC C3' 1 1
1 305 2 2 1 5PC C4 C 4.210 -0.295 -9.130 1.00 . B B . 1 5PC C4 1 1
1 306 2 2 1 5PC C4' C 10.094 -1.267 -8.811 1.00 . B B . 1 5PC C4' 1 1
1 307 2 2 1 5PC C5 C 5.045 -1.382 -8.947 1.00 . B B . 1 5PC C5 1 1
1 308 2 2 1 5PC C5' C 10.086 -2.787 -8.580 1.00 . B B . 1 5PC C5' 1 1
1 309 2 2 1 5PC C6 C 6.403 -1.229 -9.040 1.00 . B B . 1 5PC C6 1 1
1 310 2 2 1 5PC C7 C 4.606 -2.727 -8.636 1.00 . B B . 1 5PC C7 1 1
1 311 2 2 1 5PC C8 C 4.239 -3.844 -8.370 1.00 . B B . 1 5PC C8 1 1
1 312 2 2 1 5PC C9 C 3.815 -5.139 -8.056 1.00 . B B . 1 5PC C9 1 1
1 313 2 2 1 5PC H1' H 8.637 1.067 -10.279 1.00 . B B . 1 5PC H1' 1 1
1 314 2 2 1 5PC H2' H 8.556 1.444 -7.591 1.00 . B B . 1 5PC H2' 1 1
1 315 2 2 1 5PC H2'' H 10.047 1.463 -8.525 1.00 . B B . 1 5PC H2'' 1 1
1 316 2 2 1 5PC H3' H 8.865 -0.949 -7.029 1.00 . B B . 1 5PC H3' 1 1
1 317 2 2 1 5PC H4' H 11.108 -0.961 -9.138 1.00 . B B . 1 5PC H4' 1 1
1 318 2 2 1 5PC H41 H 2.364 -1.300 -8.841 1.00 . B B . 1 5PC H41 1 1
1 319 2 2 1 5PC H42 H 2.229 0.454 -9.199 1.00 . B B . 1 5PC H42 1 1
1 320 2 2 1 5PC H5' H 10.814 -3.063 -7.794 1.00 . B B . 1 5PC H5' 1 1
1 321 2 2 1 5PC H5'' H 9.098 -3.127 -8.218 1.00 . B B . 1 5PC H5'' 1 1
1 322 2 2 1 5PC H6 H 7.083 -2.073 -8.902 1.00 . B B . 1 5PC H6 1 1
1 323 2 2 1 5PC H91 H 4.036 -5.841 -8.880 1.00 . B B . 1 5PC H91 1 1
1 324 2 2 1 5PC H92 H 4.322 -5.510 -7.146 1.00 . B B . 1 5PC H92 1 1
1 325 2 2 1 5PC H93 H 2.726 -5.164 -7.870 1.00 . B B . 1 5PC H93 1 1
1 326 2 2 1 5PC N1 N 6.991 0.116 -9.327 1.00 . B B . 1 5PC N1 1 1
1 327 2 2 1 5PC N3 N 4.673 0.894 -9.373 1.00 . B B . 1 5PC N3 1 1
1 328 2 2 1 5PC N4 N 2.793 -0.396 -9.062 1.00 . B B . 1 5PC N4 1 1
1 329 2 2 1 5PC O2 O 6.512 2.322 -9.688 1.00 . B B . 1 5PC O2 1 1
1 330 2 2 1 5PC O3' O 10.810 -0.198 -6.709 1.00 . B B . 1 5PC O3' 1 1
1 331 2 2 1 5PC O4' O 9.151 -0.906 -9.848 1.00 . B B . 1 5PC O4' 1 1
1 332 2 2 1 5PC O5' O 10.409 -3.460 -9.791 1.00 . B B . 1 5PC O5' 1 1
1 333 2 2 2 5PC C1' C 6.965 3.872 -5.815 1.00 . B B . 2 5PC C1' 1 1
1 334 2 2 2 5PC C2 C 4.641 2.948 -5.667 1.00 . B B . 2 5PC C2 1 1
1 335 2 2 2 5PC C2' C 7.178 4.595 -4.477 1.00 . B B . 2 5PC C2' 1 1
1 336 2 2 2 5PC C3' C 8.474 4.009 -3.926 1.00 . B B . 2 5PC C3' 1 1
1 337 2 2 2 5PC C4 C 4.200 0.567 -5.539 1.00 . B B . 2 5PC C4 1 1
1 338 2 2 2 5PC C4' C 9.260 3.790 -5.226 1.00 . B B . 2 5PC C4' 1 1
1 339 2 2 2 5PC C5 C 5.552 0.282 -5.578 1.00 . B B . 2 5PC C5 1 1
1 340 2 2 2 5PC C5' C 10.355 2.708 -5.158 1.00 . B B . 2 5PC C5' 1 1
1 341 2 2 2 5PC C6 C 6.464 1.296 -5.700 1.00 . B B . 2 5PC C6 1 1
1 342 2 2 2 5PC C7 C 6.128 -1.044 -5.505 1.00 . B B . 2 5PC C7 1 1
1 343 2 2 2 5PC C8 C 6.613 -2.145 -5.448 1.00 . B B . 2 5PC C8 1 1
1 344 2 2 2 5PC C9 C 7.182 -3.421 -5.386 1.00 . B B . 2 5PC C9 1 1
1 345 2 2 2 5PC H1' H 6.583 4.602 -6.555 1.00 . B B . 2 5PC H1' 1 1
1 346 2 2 2 5PC H2' H 6.332 4.497 -3.783 1.00 . B B . 2 5PC H2' 1 1
1 347 2 2 2 5PC H2'' H 7.295 5.679 -4.651 1.00 . B B . 2 5PC H2'' 1 1
1 348 2 2 2 5PC H3' H 8.276 3.043 -3.418 1.00 . B B . 2 5PC H3' 1 1
1 349 2 2 2 5PC H4' H 9.744 4.744 -5.511 1.00 . B B . 2 5PC H4' 1 1
1 350 2 2 2 5PC H41 H 3.478 -1.422 -5.354 1.00 . B B . 2 5PC H41 1 1
1 351 2 2 2 5PC H42 H 2.217 -0.141 -5.445 1.00 . B B . 2 5PC H42 1 1
1 352 2 2 2 5PC H5' H 10.893 2.676 -6.125 1.00 . B B . 2 5PC H5' 1 1
1 353 2 2 2 5PC H5'' H 11.111 2.975 -4.395 1.00 . B B . 2 5PC H5'' 1 1
1 354 2 2 2 5PC H6 H 7.531 1.089 -5.783 1.00 . B B . 2 5PC H6 1 1
1 355 2 2 2 5PC H91 H 6.739 -4.013 -4.564 1.00 . B B . 2 5PC H91 1 1
1 356 2 2 2 5PC H92 H 7.024 -3.972 -6.330 1.00 . B B . 2 5PC H92 1 1
1 357 2 2 2 5PC H93 H 8.271 -3.352 -5.207 1.00 . B B . 2 5PC H93 1 1
1 358 2 2 2 5PC N1 N 6.007 2.720 -5.737 1.00 . B B . 2 5PC N1 1 1
1 359 2 2 2 5PC N3 N 3.753 1.784 -5.598 1.00 . B B . 2 5PC N3 1 1
1 360 2 2 2 5PC N4 N 3.200 -0.439 -5.440 1.00 . B B . 2 5PC N4 1 1
1 361 2 2 2 5PC O2 O 4.183 4.092 -5.645 1.00 . B B . 2 5PC O2 1 1
1 362 2 2 2 5PC O3' O 9.158 4.928 -3.055 1.00 . B B . 2 5PC O3' 1 1
1 363 2 2 2 5PC O4' O 8.286 3.470 -6.242 1.00 . B B . 2 5PC O4' 1 1
1 364 2 2 2 5PC O5' O 9.807 1.411 -4.858 1.00 . B B . 2 5PC O5' 1 1
1 365 2 2 2 5PC OP1 O 12.007 0.130 -4.461 1.00 . B B . 2 5PC OP1 1 1
1 366 2 2 2 5PC OP2 O 9.854 -1.136 -4.518 1.00 . B B . 2 5PC OP2 1 1
1 367 2 2 2 5PC P P 10.628 0.039 -5.117 1.00 . B B . 2 5PC P 1 1
1 368 2 2 3 PDU C1' C 3.815 6.081 -1.673 1.00 . B B . 3 PDU C1' 1 1
1 369 2 2 3 PDU C2 C 2.323 4.101 -2.027 1.00 . B B . 3 PDU C2 1 1
1 370 2 2 3 PDU C2' C 4.230 6.472 -0.251 1.00 . B B . 3 PDU C2' 1 1
1 371 2 2 3 PDU C3' C 5.052 7.744 -0.445 1.00 . B B . 3 PDU C3' 1 1
1 372 2 2 3 PDU C4 C 3.120 1.832 -2.181 1.00 . B B . 3 PDU C4 1 1
1 373 2 2 3 PDU C4' C 5.639 7.576 -1.862 1.00 . B B . 3 PDU C4' 1 1
1 374 2 2 3 PDU C5 C 4.574 2.348 -1.972 1.00 . B B . 3 PDU C5 1 1
1 375 2 2 3 PDU C5' C 7.139 7.213 -1.898 1.00 . B B . 3 PDU C5' 1 1
1 376 2 2 3 PDU C5A C 5.709 1.472 -1.979 1.00 . B B . 3 PDU C5A 1 1
1 377 2 2 3 PDU C5B C 6.668 0.744 -1.990 1.00 . B B . 3 PDU C5B 1 1
1 378 2 2 3 PDU C5M C 7.787 -0.096 -2.008 1.00 . B B . 3 PDU C5M 1 1
1 379 2 2 3 PDU C6 C 4.761 3.679 -1.800 1.00 . B B . 3 PDU C6 1 1
1 380 2 2 3 PDU H1' H 2.904 6.657 -1.938 1.00 . B B . 3 PDU H1' 1 1
1 381 2 2 3 PDU H2' H 4.870 5.698 0.214 1.00 . B B . 3 PDU H2' 1 1
1 382 2 2 3 PDU H2'' H 3.362 6.616 0.414 1.00 . B B . 3 PDU H2'' 1 1
1 383 2 2 3 PDU H3 H 1.168 2.444 -2.321 1.00 . B B . 3 PDU H3 1 1
1 384 2 2 3 PDU H3' H 5.844 7.825 0.326 1.00 . B B . 3 PDU H3' 1 1
1 385 2 2 3 PDU H4' H 5.516 8.524 -2.419 1.00 . B B . 3 PDU H4' 1 1
1 386 2 2 3 PDU H5' H 7.500 7.254 -2.942 1.00 . B B . 3 PDU H5' 1 1
1 387 2 2 3 PDU H5'' H 7.734 7.963 -1.342 1.00 . B B . 3 PDU H5'' 1 1
1 388 2 2 3 PDU H6 H 5.761 4.086 -1.641 1.00 . B B . 3 PDU H6 1 1
1 389 2 2 3 PDU H71 H 7.661 -0.914 -2.740 1.00 . B B . 3 PDU H71 1 1
1 390 2 2 3 PDU H72 H 8.695 0.468 -2.293 1.00 . B B . 3 PDU H72 1 1
1 391 2 2 3 PDU H73 H 7.964 -0.547 -1.015 1.00 . B B . 3 PDU H73 1 1
1 392 2 2 3 PDU N1 N 3.598 4.612 -1.837 1.00 . B B . 3 PDU N1 1 1
1 393 2 2 3 PDU N3 N 2.133 2.766 -2.198 1.00 . B B . 3 PDU N3 1 1
1 394 2 2 3 PDU O2 O 1.312 4.804 -2.037 1.00 . B B . 3 PDU O2 1 1
1 395 2 2 3 PDU O3' O 4.219 8.920 -0.407 1.00 . B B . 3 PDU O3' 1 1
1 396 2 2 3 PDU O4 O 2.830 0.645 -2.325 1.00 . B B . 3 PDU O4 1 1
1 397 2 2 3 PDU O4' O 4.872 6.549 -2.532 1.00 . B B . 3 PDU O4' 1 1
1 398 2 2 3 PDU O5' O 7.368 5.903 -1.350 1.00 . B B . 3 PDU O5' 1 1
1 399 2 2 3 PDU OP1 O 9.876 5.946 -0.808 1.00 . B B . 3 PDU OP1 1 1
1 400 2 2 3 PDU OP2 O 8.666 3.761 -0.807 1.00 . B B . 3 PDU OP2 1 1
1 401 2 2 3 PDU P P 8.779 5.126 -1.488 1.00 . B B . 3 PDU P 1 1
1 402 2 2 4 5PC C1' C -0.337 5.589 1.156 1.00 . B B . 4 5PC C1' 1 1
1 403 2 2 4 5PC C2 C -0.340 3.095 0.940 1.00 . B B . 4 5PC C2 1 1
1 404 2 2 4 5PC C2' C -0.625 6.109 2.567 1.00 . B B . 4 5PC C2' 1 1
1 405 2 2 4 5PC C3' C -0.214 7.582 2.574 1.00 . B B . 4 5PC C3' 1 1
1 406 2 2 4 5PC C4 C 1.697 1.805 1.208 1.00 . B B . 4 5PC C4 1 1
1 407 2 2 4 5PC C4' C 0.025 7.872 1.085 1.00 . B B . 4 5PC C4' 1 1
1 408 2 2 4 5PC C5 C 2.423 2.952 1.484 1.00 . B B . 4 5PC C5 1 1
1 409 2 2 4 5PC C5' C 1.043 8.984 0.772 1.00 . B B . 4 5PC C5' 1 1
1 410 2 2 4 5PC C6 C 1.798 4.170 1.506 1.00 . B B . 4 5PC C6 1 1
1 411 2 2 4 5PC C7 C 3.846 3.001 1.737 1.00 . B B . 4 5PC C7 1 1
1 412 2 2 4 5PC C8 C 5.034 3.045 1.935 1.00 . B B . 4 5PC C8 1 1
1 413 2 2 4 5PC C9 C 6.414 3.099 2.156 1.00 . B B . 4 5PC C9 1 1
1 414 2 2 4 5PC H1' H -1.292 5.525 0.594 1.00 . B B . 4 5PC H1' 1 1
1 415 2 2 4 5PC H2' H -0.065 5.580 3.356 1.00 . B B . 4 5PC H2' 1 1
1 416 2 2 4 5PC H2'' H -1.690 5.962 2.794 1.00 . B B . 4 5PC H2'' 1 1
1 417 2 2 4 5PC H3' H 0.733 7.693 3.140 1.00 . B B . 4 5PC H3' 1 1
1 418 2 2 4 5PC H4' H -0.937 8.157 0.614 1.00 . B B . 4 5PC H4' 1 1
1 419 2 2 4 5PC H41 H 3.286 0.401 1.340 1.00 . B B . 4 5PC H41 1 1
1 420 2 2 4 5PC H42 H 1.671 -0.283 0.934 1.00 . B B . 4 5PC H42 1 1
1 421 2 2 4 5PC H5' H 1.179 9.054 -0.324 1.00 . B B . 4 5PC H5' 1 1
1 422 2 2 4 5PC H5'' H 0.639 9.963 1.093 1.00 . B B . 4 5PC H5'' 1 1
1 423 2 2 4 5PC H6 H 2.309 5.101 1.762 1.00 . B B . 4 5PC H6 1 1
1 424 2 2 4 5PC H91 H 6.771 2.191 2.673 1.00 . B B . 4 5PC H91 1 1
1 425 2 2 4 5PC H92 H 6.961 3.181 1.197 1.00 . B B . 4 5PC H92 1 1
1 426 2 2 4 5PC H93 H 6.684 3.975 2.773 1.00 . B B . 4 5PC H93 1 1
1 427 2 2 4 5PC N1 N 0.351 4.269 1.177 1.00 . B B . 4 5PC N1 1 1
1 428 2 2 4 5PC N3 N 0.422 1.842 0.959 1.00 . B B . 4 5PC N3 1 1
1 429 2 2 4 5PC N4 N 2.281 0.511 1.166 1.00 . B B . 4 5PC N4 1 1
1 430 2 2 4 5PC O2 O -1.555 3.095 0.736 1.00 . B B . 4 5PC O2 1 1
1 431 2 2 4 5PC O3' O -1.228 8.435 3.139 1.00 . B B . 4 5PC O3' 1 1
1 432 2 2 4 5PC O4' O 0.449 6.616 0.523 1.00 . B B . 4 5PC O4' 1 1
1 433 2 2 4 5PC O5' O 2.311 8.761 1.416 1.00 . B B . 4 5PC O5' 1 1
1 434 2 2 4 5PC OP1 O 3.316 11.035 0.741 1.00 . B B . 4 5PC OP1 1 1
1 435 2 2 4 5PC OP2 O 4.704 9.446 2.073 1.00 . B B . 4 5PC OP2 1 1
1 436 2 2 4 5PC P P 3.647 9.559 0.971 1.00 . B B . 4 5PC P 1 1
1 437 2 2 5 5PC C1' C -4.170 3.388 4.058 1.00 . B B . 5 5PC C1' 1 1
1 438 2 2 5 5PC C2 C -2.820 1.277 3.976 1.00 . B B . 5 5PC C2 1 1
1 439 2 2 5 5PC C2' C -4.904 3.559 5.392 1.00 . B B . 5 5PC C2' 1 1
1 440 2 2 5 5PC C3' C -4.777 5.038 5.751 1.00 . B B . 5 5PC C3' 1 1
1 441 2 2 5 5PC C4 C -0.439 1.279 4.430 1.00 . B B . 5 5PC C4 1 1
1 442 2 2 5 5PC C4' C -4.669 5.670 4.358 1.00 . B B . 5 5PC C4' 1 1
1 443 2 2 5 5PC C5 C -0.453 2.642 4.671 1.00 . B B . 5 5PC C5 1 1
1 444 2 2 5 5PC C5' C -4.016 7.063 4.308 1.00 . B B . 5 5PC C5' 1 1
1 445 2 2 5 5PC C6 C -1.626 3.345 4.572 1.00 . B B . 5 5PC C6 1 1
1 446 2 2 5 5PC C7 C 0.705 3.435 5.020 1.00 . B B . 5 5PC C7 1 1
1 447 2 2 5 5PC C8 C 1.670 4.100 5.301 1.00 . B B . 5 5PC C8 1 1
1 448 2 2 5 5PC C9 C 2.789 4.875 5.619 1.00 . B B . 5 5PC C9 1 1
1 449 2 2 5 5PC H1' H -4.851 2.853 3.371 1.00 . B B . 5 5PC H1' 1 1
1 450 2 2 5 5PC H2' H -4.499 2.935 6.201 1.00 . B B . 5 5PC H2' 1 1
1 451 2 2 5 5PC H2'' H -5.966 3.274 5.270 1.00 . B B . 5 5PC H2'' 1 1
1 452 2 2 5 5PC H3' H -3.843 5.202 6.326 1.00 . B B . 5 5PC H3' 1 1
1 453 2 2 5 5PC H4' H -5.684 5.764 3.938 1.00 . B B . 5 5PC H4' 1 1
1 454 2 2 5 5PC H41 H 1.625 0.929 4.788 1.00 . B B . 5 5PC H41 1 1
1 455 2 2 5 5PC H42 H 0.667 -0.509 4.285 1.00 . B B . 5 5PC H42 1 1
1 456 2 2 5 5PC H5' H -3.977 7.410 3.257 1.00 . B B . 5 5PC H5' 1 1
1 457 2 2 5 5PC H5'' H -4.649 7.794 4.847 1.00 . B B . 5 5PC H5'' 1 1
1 458 2 2 5 5PC H6 H -1.698 4.421 4.768 1.00 . B B . 5 5PC H6 1 1
1 459 2 2 5 5PC H91 H 3.220 4.573 6.591 1.00 . B B . 5 5PC H91 1 1
1 460 2 2 5 5PC H92 H 3.574 4.770 4.848 1.00 . B B . 5 5PC H92 1 1
1 461 2 2 5 5PC H93 H 2.518 5.945 5.684 1.00 . B B . 5 5PC H93 1 1
1 462 2 2 5 5PC N1 N -2.882 2.645 4.183 1.00 . B B . 5 5PC N1 1 1
1 463 2 2 5 5PC N3 N -1.512 0.629 4.096 1.00 . B B . 5 5PC N3 1 1
1 464 2 2 5 5PC N4 N 0.738 0.487 4.525 1.00 . B B . 5 5PC N4 1 1
1 465 2 2 5 5PC O2 O -3.830 0.619 3.721 1.00 . B B . 5 5PC O2 1 1
1 466 2 2 5 5PC O3' O -5.912 5.549 6.484 1.00 . B B . 5 5PC O3' 1 1
1 467 2 2 5 5PC O4' O -3.958 4.721 3.539 1.00 . B B . 5 5PC O4' 1 1
1 468 2 2 5 5PC O5' O -2.693 7.070 4.877 1.00 . B B . 5 5PC O5' 1 1
1 469 2 2 5 5PC OP1 O -2.422 9.623 5.089 1.00 . B B . 5 5PC OP1 1 1
1 470 2 2 5 5PC OP2 O -0.470 8.146 5.593 1.00 . B B . 5 5PC OP2 1 1
1 471 2 2 5 5PC P P -1.695 8.335 4.695 1.00 . B B . 5 5PC P 1 1
1 472 2 2 6 PDU C1' C -7.061 -0.466 7.110 1.00 . B B . 6 PDU C1' 1 1
1 473 2 2 6 PDU C2 C -4.998 -1.816 6.670 1.00 . B B . 6 PDU C2 1 1
1 474 2 2 6 PDU C2' C -7.574 -0.639 8.543 1.00 . B B . 6 PDU C2' 1 1
1 475 2 2 6 PDU C3' C -8.817 0.237 8.607 1.00 . B B . 6 PDU C3' 1 1
1 476 2 2 6 PDU C4 C -2.762 -0.974 6.994 1.00 . B B . 6 PDU C4 1 1
1 477 2 2 6 PDU C4' C -8.468 1.378 7.633 1.00 . B B . 6 PDU C4' 1 1
1 478 2 2 6 PDU C5 C -3.362 0.395 7.430 1.00 . B B . 6 PDU C5 1 1
1 479 2 2 6 PDU C5' C -7.884 2.616 8.352 1.00 . B B . 6 PDU C5' 1 1
1 480 2 2 6 PDU C5A C -2.531 1.496 7.820 1.00 . B B . 6 PDU C5A 1 1
1 481 2 2 6 PDU C5B C -1.837 2.426 8.141 1.00 . B B . 6 PDU C5B 1 1
1 482 2 2 6 PDU C5M C -1.034 3.511 8.508 1.00 . B B . 6 PDU C5M 1 1
1 483 2 2 6 PDU C6 C -4.711 0.533 7.429 1.00 . B B . 6 PDU C6 1 1
1 484 2 2 6 PDU H1' H -7.570 -1.201 6.453 1.00 . B B . 6 PDU H1' 1 1
1 485 2 2 6 PDU H2' H -6.842 -0.267 9.284 1.00 . B B . 6 PDU H2' 1 1
1 486 2 2 6 PDU H2'' H -7.769 -1.695 8.788 1.00 . B B . 6 PDU H2'' 1 1
1 487 2 2 6 PDU H3 H -3.262 -2.860 6.367 1.00 . B B . 6 PDU H3 1 1
1 488 2 2 6 PDU H3' H -8.979 0.614 9.635 1.00 . B B . 6 PDU H3' 1 1
1 489 2 2 6 PDU H4' H -9.371 1.693 7.076 1.00 . B B . 6 PDU H4' 1 1
1 490 2 2 6 PDU H5' H -8.646 3.082 9.004 1.00 . B B . 6 PDU H5' 1 1
1 491 2 2 6 PDU H5'' H -7.052 2.313 9.018 1.00 . B B . 6 PDU H5'' 1 1
1 492 2 2 6 PDU H6 H -5.193 1.473 7.713 1.00 . B B . 6 PDU H6 1 1
1 493 2 2 6 PDU H71 H -1.287 4.405 7.909 1.00 . B B . 6 PDU H71 1 1
1 494 2 2 6 PDU H72 H -1.174 3.766 9.574 1.00 . B B . 6 PDU H72 1 1
1 495 2 2 6 PDU H73 H 0.036 3.286 8.344 1.00 . B B . 6 PDU H73 1 1
1 496 2 2 6 PDU N1 N -5.577 -0.609 7.033 1.00 . B B . 6 PDU N1 1 1
1 497 2 2 6 PDU N3 N -3.643 -1.953 6.650 1.00 . B B . 6 PDU N3 1 1
1 498 2 2 6 PDU O2 O -5.659 -2.809 6.367 1.00 . B B . 6 PDU O2 1 1
1 499 2 2 6 PDU O3' O -9.980 -0.487 8.157 1.00 . B B . 6 PDU O3' 1 1
1 500 2 2 6 PDU O4 O -1.554 -1.204 6.956 1.00 . B B . 6 PDU O4 1 1
1 501 2 2 6 PDU O4' O -7.499 0.846 6.699 1.00 . B B . 6 PDU O4' 1 1
1 502 2 2 6 PDU O5' O -7.409 3.578 7.401 1.00 . B B . 6 PDU O5' 1 1
1 503 2 2 6 PDU OP1 O -7.372 5.856 8.591 1.00 . B B . 6 PDU OP1 1 1
1 504 2 2 6 PDU OP2 O -5.353 4.386 8.724 1.00 . B B . 6 PDU OP2 1 1
1 505 2 2 6 PDU P P -6.505 4.853 7.828 1.00 . B B . 6 PDU P 1 1
1 506 2 2 7 PDU C1' C -6.456 -4.971 9.409 1.00 . B B . 7 PDU C1' 1 1
1 507 2 2 7 PDU C2 C -3.976 -4.669 9.501 1.00 . B B . 7 PDU C2 1 1
1 508 2 2 7 PDU C2' C -7.338 -5.357 10.601 1.00 . B B . 7 PDU C2' 1 1
1 509 2 2 7 PDU C3' C -8.720 -5.565 9.975 1.00 . B B . 7 PDU C3' 1 1
1 510 2 2 7 PDU C4 C -2.895 -2.624 10.178 1.00 . B B . 7 PDU C4 1 1
1 511 2 2 7 PDU C4' C -8.627 -4.866 8.600 1.00 . B B . 7 PDU C4' 1 1
1 512 2 2 7 PDU C5 C -4.296 -2.003 10.464 1.00 . B B . 7 PDU C5 1 1
1 513 2 2 7 PDU C5' C -9.744 -3.852 8.282 1.00 . B B . 7 PDU C5' 1 1
1 514 2 2 7 PDU C5A C -4.432 -0.633 10.864 1.00 . B B . 7 PDU C5A 1 1
1 515 2 2 7 PDU C5B C -4.547 0.522 11.188 1.00 . B B . 7 PDU C5B 1 1
1 516 2 2 7 PDU C5M C -4.682 1.866 11.552 1.00 . B B . 7 PDU C5M 1 1
1 517 2 2 7 PDU C6 C -5.394 -2.781 10.279 1.00 . B B . 7 PDU C6 1 1
1 518 2 2 7 PDU H1' H -6.177 -5.902 8.871 1.00 . B B . 7 PDU H1' 1 1
1 519 2 2 7 PDU H2' H -7.394 -4.533 11.337 1.00 . B B . 7 PDU H2' 1 1
1 520 2 2 7 PDU H2'' H -6.953 -6.242 11.138 1.00 . B B . 7 PDU H2'' 1 1
1 521 2 2 7 PDU H3 H -1.962 -4.321 9.516 1.00 . B B . 7 PDU H3 1 1
1 522 2 2 7 PDU H3' H -9.502 -5.115 10.618 1.00 . B B . 7 PDU H3' 1 1
1 523 2 2 7 PDU H4' H -8.644 -5.630 7.800 1.00 . B B . 7 PDU H4' 1 1
1 524 2 2 7 PDU H5' H -9.519 -3.351 7.320 1.00 . B B . 7 PDU H5' 1 1
1 525 2 2 7 PDU H5'' H -10.703 -4.382 8.131 1.00 . B B . 7 PDU H5'' 1 1
1 526 2 2 7 PDU H6 H -6.400 -2.414 10.490 1.00 . B B . 7 PDU H6 1 1
1 527 2 2 7 PDU H71 H -3.852 2.185 12.208 1.00 . B B . 7 PDU H71 1 1
1 528 2 2 7 PDU H72 H -4.676 2.518 10.658 1.00 . B B . 7 PDU H72 1 1
1 529 2 2 7 PDU H73 H -5.632 2.040 12.089 1.00 . B B . 7 PDU H73 1 1
1 530 2 2 7 PDU HO3' H -8.976 -7.334 10.694 1.00 . B B . 7 PDU HO3' 1 1
1 531 2 2 7 PDU N1 N -5.245 -4.170 9.757 1.00 . B B . 7 PDU N1 1 1
1 532 2 2 7 PDU N3 N -2.876 -3.902 9.719 1.00 . B B . 7 PDU N3 1 1
1 533 2 2 7 PDU O2 O -3.776 -5.805 9.070 1.00 . B B . 7 PDU O2 1 1
1 534 2 2 7 PDU O3' O -8.980 -6.955 9.811 1.00 . B B . 7 PDU O3' 1 1
1 535 2 2 7 PDU O4 O -1.832 -2.026 10.338 1.00 . B B . 7 PDU O4 1 1
1 536 2 2 7 PDU O4' O -7.337 -4.231 8.552 1.00 . B B . 7 PDU O4' 1 1
1 537 2 2 7 PDU O5' O -9.905 -2.872 9.325 1.00 . B B . 7 PDU O5' 1 1
1 538 2 2 7 PDU OP1 O -12.123 -1.885 8.465 1.00 . B B . 7 PDU OP1 1 1
1 539 2 2 7 PDU OP2 O -11.042 -0.875 10.474 1.00 . B B . 7 PDU OP2 1 1
1 540 2 2 7 PDU P P -10.784 -1.526 9.114 1.00 . B B . 7 PDU P 1 1
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