NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
469850 |
1ajl   |
cing | 4-filtered-FRED | STAR | entry | full | 371 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ajl
# This FRED archive file contains, for PDB entry <1ajl>:
#
# - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister,
# G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for
# 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396.
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_1ajl
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1ajl
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 6005.59
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 $RNA__5__R__GP_GP_UP_AP_AP_UP_AP_AP_GP_CP_UP_C__3__ A . 1 1
2 . 2 $RNA__5__R__GP_AP_GP_UP_AP_CP_C__3__ B . 1 1
stop_
save_
save_RNA__5__R__GP_GP_UP_AP_AP_UP_AP_AP_GP_CP_UP_C__3__
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "RNA 5 R GP GP UP AP AP UP AP AP GP CP UP C 3 "
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_seq_one_letter_code GGUAAUAAGCUC
_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 G . 1 1
2 G . 1 1
3 U . 1 1
4 A . 1 1
5 A . 1 1
6 U . 1 1
7 A . 1 1
8 A . 1 1
9 G . 1 1
10 C . 1 1
11 U . 1 1
12 C . 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
G 1 1 1 1
G 2 2 1 1
U 3 3 1 1
A 4 4 1 1
A 5 5 1 1
U 6 6 1 1
A 7 7 1 1
A 8 8 1 1
G 9 9 1 1
C 10 10 1 1
U 11 11 1 1
C 12 12 1 1
stop_
save_
save_RNA__5__R__GP_AP_GP_UP_AP_CP_C__3__
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 2
_Entity.Name "RNA 5 R GP AP GP UP AP CP C 3 "
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_seq_one_letter_code GAGUACC
_Entity.Number_of_monomers 7
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 G . 1 2
2 A . 1 2
3 G . 1 2
4 U . 1 2
5 A . 1 2
6 C . 1 2
7 C . 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
G 1 1 1 2
A 2 2 1 2
G 3 3 1 2
U 4 4 1 2
A 5 5 1 2
C 6 6 1 2
C 7 7 1 2
stop_
save_
save_CNS/XPLOR_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
117 1 . . . 1 1
118 1 . . . 1 1
119 1 . . . 1 1
120 1 . . . 1 1
121 1 . . . 1 1
122 1 . . . 1 1
123 1 . . . 1 1
124 1 . . . 1 1
125 1 . . . 1 1
126 1 . . . 1 1
127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
130 1 . . . 1 1
131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
136 1 . . . 1 1
137 1 . . . 1 1
138 1 . . . 1 1
139 1 . . . 1 1
140 1 . . . 1 1
141 1 . . . 1 1
142 1 . . . 1 1
143 1 . . . 1 1
144 1 . . . 1 1
145 1 . . . 1 1
146 1 . . . 1 1
147 1 . . . 1 1
148 1 . . . 1 1
149 1 . . . 1 1
150 1 . . . 1 1
151 1 . . . 1 1
152 1 . . . 1 1
153 1 . . . 1 1
154 1 . . . 1 1
155 1 . . . 1 1
156 1 . . . 1 1
157 1 . . . 1 1
158 1 . . . 1 1
159 1 . . . 1 1
160 1 . . . 1 1
161 1 . . . 1 1
162 1 . . . 1 1
163 1 . . . 1 1
164 1 . . . 1 1
165 1 . . . 1 1
166 1 . . . 1 1
167 1 . . . 1 1
168 1 . . . 1 1
169 1 . . . 1 1
170 1 . . . 1 1
171 1 . . . 1 1
172 1 . . . 1 1
173 1 . . . 1 1
174 1 . . . 1 1
175 1 . . . 1 1
176 1 . . . 1 1
177 1 . . . 1 1
178 1 . . . 1 1
179 1 . . . 1 1
180 1 . . . 1 1
181 1 . . . 1 1
182 1 . . . 1 1
183 1 . . . 1 1
184 1 . . . 1 1
185 1 . . . 1 1
186 1 . . . 1 1
187 1 . . . 1 1
188 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 G O6 . 2 . O6 1 1
1 1 2 1 1 2 G O6 . 3 . O6 1 1
2 1 1 1 1 1 G H22 . 2 . H22 1 1
2 1 2 1 1 2 G H22 . 3 . H22 1 1
3 1 1 1 1 1 G H1 . 2 . H1 1 1
3 1 2 2 2 6 C H41 . 23 . H41 1 1
4 1 1 1 1 2 G H1 . 3 . H1 1 1
4 1 2 2 2 7 C H41 . 24 . H41 1 1
5 1 1 1 1 11 U H3 . 12 . H3 1 1
5 1 2 2 2 3 G H22 . 20 . H22 1 1
6 1 1 1 1 10 C H41 . 11 . H41 1 1
6 1 2 2 2 2 A H61 . 19 . H61 1 1
7 1 1 1 1 12 C H41 . 13 . H41 1 1
7 1 2 2 2 2 A H61 . 19 . H61 1 1
8 1 1 2 2 6 C H42 . 23 . H42 1 1
8 1 2 2 2 7 C H42 . 24 . H42 1 1
9 1 1 2 2 1 G H21 . 18 . H21 1 1
9 1 2 2 2 2 A H2 . 19 . H2 1 1
10 1 1 2 2 1 G H1 . 18 . H1 1 1
10 1 2 2 2 2 A H2 . 19 . H2 1 1
11 1 1 2 2 1 G H1 . 18 . H1 1 1
11 1 2 2 2 2 A H61 . 19 . H61 1 1
12 1 1 2 2 2 A H61 . 19 . H61 1 1
12 1 2 2 2 3 G H1 . 20 . H1 1 1
13 1 1 1 1 10 C H41 . 11 . H41 1 1
13 1 2 1 1 11 U H3 . 12 . H3 1 1
14 1 1 2 2 6 C H41 . 23 . H41 1 1
14 1 2 2 2 6 C H5 . 23 . H5 1 1
15 1 1 2 2 6 C H42 . 23 . H42 1 1
15 1 2 2 2 6 C H5 . 23 . H5 1 1
16 1 1 1 1 2 G H1 . 3 . H1 1 1
16 1 2 2 2 6 C H41 . 23 . H41 1 1
17 1 1 1 1 2 G H1 . 3 . H1 1 1
17 1 2 2 2 6 C H42 . 23 . H42 1 1
18 1 1 1 1 10 C H41 . 11 . H41 1 1
18 1 2 1 1 10 C H5 . 11 . H5 1 1
19 1 1 1 1 10 C H42 . 11 . H42 1 1
19 1 2 1 1 10 C H5 . 11 . H5 1 1
20 1 1 1 1 10 C H41 . 11 . H41 1 1
20 1 2 2 2 3 G H1 . 20 . H1 1 1
21 1 1 1 1 10 C H42 . 11 . H42 1 1
21 1 2 2 2 3 G H1 . 20 . H1 1 1
22 1 1 1 1 12 C H41 . 13 . H41 1 1
22 1 2 1 1 12 C H5 . 13 . H5 1 1
23 1 1 1 1 12 C H42 . 13 . H42 1 1
23 1 2 1 1 12 C H5 . 13 . H5 1 1
24 1 1 2 2 7 C H41 . 24 . H41 1 1
24 1 2 2 2 7 C H5 . 24 . H5 1 1
25 1 1 2 2 7 C H42 . 24 . H42 1 1
25 1 2 2 2 7 C H5 . 24 . H5 1 1
26 1 1 1 1 1 G H1 . 2 . H1 1 1
26 1 2 2 2 7 C H41 . 24 . H41 1 1
27 1 1 1 1 1 G H1 . 2 . H1 1 1
27 1 2 2 2 7 C H42 . 24 . H42 1 1
28 1 1 1 1 11 U H3 . 12 . H3 1 1
28 1 2 1 1 12 C H41 . 13 . H41 1 1
29 1 1 1 1 11 U H3 . 12 . H3 1 1
29 1 2 1 1 12 C H42 . 13 . H42 1 1
30 1 1 1 1 1 G H1 . 2 . H1 1 1
30 1 2 1 1 1 G H21 . 2 . H21 1 1
31 1 1 1 1 1 G H1 . 2 . H1 1 1
31 1 2 1 1 1 G H22 . 2 . H22 1 1
32 1 1 2 2 1 G H1 . 18 . H1 1 1
32 1 2 2 2 1 G H21 . 18 . H21 1 1
33 1 1 2 2 1 G H1 . 18 . H1 1 1
33 1 2 2 2 1 G H22 . 18 . H22 1 1
34 1 1 1 1 12 C H41 . 13 . H41 1 1
34 1 2 2 2 1 G H1 . 18 . H1 1 1
35 1 1 1 1 12 C H42 . 13 . H42 1 1
35 1 2 2 2 1 G H1 . 18 . H1 1 1
36 1 1 1 1 11 U H3 . 12 . H3 1 1
36 1 2 2 2 2 A H61 . 19 . H61 1 1
37 1 1 1 1 11 U H3 . 12 . H3 1 1
37 1 2 2 2 2 A H62 . 19 . H62 1 1
38 1 1 1 1 6 U H4' . 7 . H4' 1 1
38 1 2 1 1 7 A H8 . 8 . H8 1 1
39 1 1 1 1 6 U H2' . 7 . H2'' 1 1
39 1 2 1 1 6 U H6 . 7 . H6 1 1
40 1 1 1 1 2 G H2' . 3 . H2'' 1 1
40 1 2 1 1 3 U H6 . 4 . H6 1 1
41 1 1 1 1 8 A H2' . 9 . H2'' 1 1
41 1 2 1 1 9 G H8 . 10 . H8 1 1
42 1 1 1 1 8 A H2' . 9 . H2'' 1 1
42 1 2 1 1 8 A H8 . 9 . H8 1 1
43 1 1 1 1 10 C H2' . 11 . H2'' 1 1
43 1 2 1 1 11 U H6 . 12 . H6 1 1
44 1 1 1 1 11 U H2' . 12 . H2'' 1 1
44 1 2 1 1 11 U H6 . 12 . H6 1 1
45 1 1 1 1 3 U H2' . 4 . H2'' 1 1
45 1 2 1 1 4 A H8 . 5 . H8 1 1
46 1 1 1 1 4 A H2' . 5 . H2'' 1 1
46 1 2 1 1 4 A H8 . 5 . H8 1 1
47 1 1 1 1 9 G H2' . 10 . H2'' 1 1
47 1 2 1 1 10 C H6 . 11 . H6 1 1
48 1 1 1 1 11 U H2' . 12 . H2'' 1 1
48 1 2 1 1 12 C H6 . 13 . H6 1 1
49 1 1 2 2 6 C H2' . 23 . H2'' 1 1
49 1 2 2 2 7 C H6 . 24 . H6 1 1
50 1 1 2 2 3 G H2' . 20 . H2'' 1 1
50 1 2 2 2 4 U H6 . 21 . H6 1 1
51 1 1 1 1 7 A H2' . 8 . H2'' 1 1
51 1 2 1 1 7 A H8 . 8 . H8 1 1
52 1 1 1 1 7 A H2' . 8 . H2'' 1 1
52 1 2 1 1 8 A H8 . 9 . H8 1 1
53 1 1 1 1 1 G H2' . 2 . H2'' 1 1
53 1 2 1 1 2 G H8 . 3 . H8 1 1
54 1 1 1 1 1 G H2' . 2 . H2'' 1 1
54 1 2 1 1 1 G H8 . 2 . H8 1 1
55 1 1 2 2 3 G H3' . 20 . H3' 1 1
55 1 2 2 2 3 G H8 . 20 . H8 1 1
56 1 1 2 2 2 A H2' . 19 . H2'' 1 1
56 1 2 2 2 3 G H8 . 20 . H8 1 1
57 1 1 2 2 5 A H2' . 22 . H2'' 1 1
57 1 2 2 2 5 A H8 . 22 . H8 1 1
58 1 1 2 2 5 A H3' . 22 . H3' 1 1
58 1 2 2 2 5 A H8 . 22 . H8 1 1
59 1 1 1 1 4 A H2' . 5 . H2'' 1 1
59 1 2 1 1 5 A H8 . 6 . H8 1 1
60 1 1 1 1 5 A H2' . 6 . H2'' 1 1
60 1 2 1 1 5 A H8 . 6 . H8 1 1
61 1 1 1 1 5 A H2' . 6 . H2'' 1 1
61 1 2 1 1 6 U H6 . 7 . H6 1 1
62 1 1 1 1 9 G H2' . 10 . H2'' 1 1
62 1 2 1 1 9 G H8 . 10 . H8 1 1
63 1 1 2 2 5 A H2' . 22 . H2'' 1 1
63 1 2 2 2 6 C H6 . 23 . H6 1 1
64 1 1 2 2 4 U H2' . 21 . H2'' 1 1
64 1 2 2 2 5 A H8 . 22 . H8 1 1
65 1 1 1 1 8 A H3' . 9 . H3' 1 1
65 1 2 1 1 8 A H8 . 9 . H8 1 1
66 1 1 1 1 2 G H2' . 3 . H2'' 1 1
66 1 2 1 1 2 G H8 . 3 . H8 1 1
67 1 1 1 1 8 A H4' . 9 . H4' 1 1
67 1 2 1 1 8 A H8 . 9 . H8 1 1
68 1 1 1 1 3 U H2' . 4 . H2'' 1 1
68 1 2 1 1 3 U H6 . 4 . H6 1 1
69 1 1 2 2 1 G H2' . 18 . H2'' 1 1
69 1 2 2 2 2 A H8 . 19 . H8 1 1
70 1 1 2 2 2 A H2' . 19 . H2'' 1 1
70 1 2 2 2 2 A H8 . 19 . H8 1 1
71 1 1 2 2 1 G H2' . 18 . H2'' 1 1
71 1 2 2 2 1 G H8 . 18 . H8 1 1
72 1 1 1 1 7 A H3' . 8 . H3' 1 1
72 1 2 1 1 8 A H8 . 9 . H8 1 1
73 1 1 2 2 6 C H3' . 23 . H3' 1 1
73 1 2 2 2 6 C H6 . 23 . H6 1 1
74 1 1 2 2 6 C H2' . 23 . H2'' 1 1
74 1 2 2 2 6 C H6 . 23 . H6 1 1
75 1 1 1 1 6 U H4' . 7 . H4' 1 1
75 1 2 1 1 6 U H6 . 7 . H6 1 1
76 1 1 2 2 3 G H2' . 20 . H2'' 1 1
76 1 2 2 2 3 G H8 . 20 . H8 1 1
77 1 1 1 1 5 A H3' . 6 . H3' 1 1
77 1 2 1 1 5 A H8 . 6 . H8 1 1
78 1 1 1 1 4 A H3' . 5 . H3' 1 1
78 1 2 1 1 5 A H8 . 6 . H8 1 1
79 1 1 2 2 3 G H3' . 20 . H3' 1 1
79 1 2 2 2 4 U H6 . 21 . H6 1 1
80 1 1 1 1 10 C H3' . 11 . H3' 1 1
80 1 2 1 1 11 U H6 . 12 . H6 1 1
81 1 1 1 1 11 U H3' . 12 . H3' 1 1
81 1 2 1 1 11 U H6 . 12 . H6 1 1
82 1 1 1 1 12 C H3' . 13 . H3' 1 1
82 1 2 1 1 12 C H6 . 13 . H6 1 1
83 1 1 1 1 2 G H3' . 3 . H3' 1 1
83 1 2 1 1 3 U H6 . 4 . H6 1 1
84 1 1 1 1 10 C H3' . 11 . H3' 1 1
84 1 2 1 1 10 C H6 . 11 . H6 1 1
85 1 1 2 2 7 C H2' . 24 . H2'' 1 1
85 1 2 2 2 7 C H6 . 24 . H6 1 1
86 1 1 2 2 6 C H3' . 23 . H3' 1 1
86 1 2 2 2 7 C H6 . 24 . H6 1 1
87 1 1 2 2 7 C H3' . 24 . H3' 1 1
87 1 2 2 2 7 C H6 . 24 . H6 1 1
88 1 1 1 1 12 C H2' . 13 . H2'' 1 1
88 1 2 1 1 12 C H6 . 13 . H6 1 1
89 1 1 1 1 4 A H2 . 5 . H2 1 1
89 1 2 2 2 5 A H1' . 22 . H1' 1 1
90 1 1 1 1 4 A H2 . 5 . H2 1 1
90 1 2 1 1 5 A H1' . 6 . H1' 1 1
91 1 1 1 1 6 U H1' . 7 . H1' 1 1
91 1 2 1 1 6 U H6 . 7 . H6 1 1
92 1 1 1 1 4 A H1' . 5 . H1' 1 1
92 1 2 2 2 5 A H2 . 22 . H2 1 1
93 1 1 2 2 5 A H2 . 22 . H2 1 1
93 1 2 2 2 6 C H1' . 23 . H1' 1 1
94 1 1 1 1 1 G H1' . 2 . H1' 1 1
94 1 2 1 1 1 G H8 . 2 . H8 1 1
95 1 1 2 2 2 A H2 . 19 . H2 1 1
95 1 2 2 2 3 G H1' . 20 . H1' 1 1
96 1 1 1 1 12 C H1' . 13 . H1' 1 1
96 1 2 2 2 2 A H2 . 19 . H2 1 1
97 1 1 2 2 4 U H1' . 21 . H1' 1 1
97 1 2 2 2 4 U H6 . 21 . H6 1 1
98 1 1 2 2 2 A H1' . 19 . H1' 1 1
98 1 2 2 2 2 A H8 . 19 . H8 1 1
99 1 1 2 2 5 A H1' . 22 . H1' 1 1
99 1 2 2 2 5 A H8 . 22 . H8 1 1
100 1 1 1 1 8 A H1' . 9 . H1' 1 1
100 1 2 1 1 8 A H8 . 9 . H8 1 1
101 1 1 1 1 8 A H1' . 9 . H1' 1 1
101 1 2 1 1 9 G H8 . 10 . H8 1 1
102 1 1 1 1 9 G H1' . 10 . H1' 1 1
102 1 2 1 1 9 G H8 . 10 . H8 1 1
103 1 1 1 1 4 A H1' . 5 . H1' 1 1
103 1 2 1 1 4 A H8 . 5 . H8 1 1
104 1 1 1 1 11 U H1' . 12 . H1' 1 1
104 1 2 1 1 11 U H6 . 12 . H6 1 1
105 1 1 1 1 12 C H1' . 13 . H1' 1 1
105 1 2 1 1 12 C H6 . 13 . H6 1 1
106 1 1 2 2 7 C H1' . 24 . H1' 1 1
106 1 2 2 2 7 C H6 . 24 . H6 1 1
107 1 1 1 1 7 A H1' . 8 . H1' 1 1
107 1 2 1 1 7 A H8 . 8 . H8 1 1
108 1 1 1 1 2 G H1' . 3 . H1' 1 1
108 1 2 1 1 2 G H8 . 3 . H8 1 1
109 1 1 2 2 3 G H1' . 20 . H1' 1 1
109 1 2 2 2 3 G H8 . 20 . H8 1 1
110 1 1 1 1 3 U H1' . 4 . H1' 1 1
110 1 2 1 1 3 U H6 . 4 . H6 1 1
111 1 1 2 2 2 A H1' . 19 . H1' 1 1
111 1 2 2 2 3 G H8 . 20 . H8 1 1
112 1 1 2 2 3 G H1' . 20 . H1' 1 1
112 1 2 2 2 4 U H6 . 21 . H6 1 1
113 1 1 2 2 5 A H1' . 22 . H1' 1 1
113 1 2 2 2 6 C H6 . 23 . H6 1 1
114 1 1 2 2 6 C H1' . 23 . H1' 1 1
114 1 2 2 2 6 C H6 . 23 . H6 1 1
115 1 1 1 1 9 G H1' . 10 . H1' 1 1
115 1 2 1 1 10 C H6 . 11 . H6 1 1
116 1 1 1 1 10 C H1' . 11 . H1' 1 1
116 1 2 1 1 11 U H6 . 12 . H6 1 1
117 1 1 1 1 11 U H1' . 12 . H1' 1 1
117 1 2 1 1 12 C H6 . 13 . H6 1 1
118 1 1 1 1 1 G H1' . 2 . H1' 1 1
118 1 2 1 1 2 G H8 . 3 . H8 1 1
119 1 1 1 1 2 G H1' . 3 . H1' 1 1
119 1 2 1 1 3 U H6 . 4 . H6 1 1
120 1 1 1 1 3 U H1' . 4 . H1' 1 1
120 1 2 1 1 4 A H8 . 5 . H8 1 1
121 1 1 1 1 4 A H1' . 5 . H1' 1 1
121 1 2 1 1 5 A H8 . 6 . H8 1 1
122 1 1 1 1 5 A H1' . 6 . H1' 1 1
122 1 2 1 1 5 A H8 . 6 . H8 1 1
123 1 1 1 1 5 A H1' . 6 . H1' 1 1
123 1 2 1 1 6 U H6 . 7 . H6 1 1
124 1 1 1 1 7 A H1' . 8 . H1' 1 1
124 1 2 1 1 8 A H8 . 9 . H8 1 1
125 1 1 1 1 8 A H2 . 9 . H2 1 1
125 1 2 1 1 9 G H1' . 10 . H1' 1 1
126 1 1 2 2 4 U H1' . 21 . H1' 1 1
126 1 2 2 2 5 A H8 . 22 . H8 1 1
127 1 1 1 1 10 C H1' . 11 . H1' 1 1
127 1 2 1 1 10 C H6 . 11 . H6 1 1
128 1 1 2 2 6 C H1' . 23 . H1' 1 1
128 1 2 2 2 7 C H6 . 24 . H6 1 1
129 1 1 2 2 5 A H1' . 22 . H1' 1 1
129 1 2 2 2 5 A H2 . 22 . H2 1 1
130 1 1 1 1 7 A H2 . 8 . H2 1 1
130 1 2 1 1 8 A H1' . 9 . H1' 1 1
131 1 1 1 1 11 U H3 . 12 . H3 1 1
131 1 2 2 2 1 G H1 . 18 . H1 1 1
132 1 1 1 1 11 U H3 . 12 . H3 1 1
132 1 2 2 2 3 G H1 . 20 . H1 1 1
133 1 1 1 1 9 G H1 . 10 . H1 1 1
133 1 2 2 2 3 G H1 . 20 . H1 1 1
134 1 1 2 2 3 G H1 . 20 . H1 1 1
134 1 2 2 2 4 U H3 . 21 . H3 1 1
135 1 1 1 1 1 G H1 . 2 . H1 1 1
135 1 2 1 1 2 G H1 . 3 . H1 1 1
136 1 1 1 1 2 G H8 . 3 . H8 1 1
136 1 2 1 1 3 U H6 . 4 . H6 1 1
137 1 1 1 1 3 U H6 . 4 . H6 1 1
137 1 2 1 1 4 A H8 . 5 . H8 1 1
138 1 1 1 1 4 A H8 . 5 . H8 1 1
138 1 2 1 1 5 A H8 . 6 . H8 1 1
139 1 1 1 1 5 A H8 . 6 . H8 1 1
139 1 2 1 1 6 U H6 . 7 . H6 1 1
140 1 1 2 2 1 G H8 . 18 . H8 1 1
140 1 2 2 2 2 A H8 . 19 . H8 1 1
141 1 1 2 2 2 A H8 . 19 . H8 1 1
141 1 2 2 2 3 G H8 . 20 . H8 1 1
142 1 1 2 2 3 G H8 . 20 . H8 1 1
142 1 2 2 2 4 U H6 . 21 . H6 1 1
143 1 1 2 2 5 A H8 . 22 . H8 1 1
143 1 2 2 2 6 C H6 . 23 . H6 1 1
144 1 1 1 1 8 A H8 . 9 . H8 1 1
144 1 2 1 1 9 G H8 . 10 . H8 1 1
145 1 1 1 1 11 U H6 . 12 . H6 1 1
145 1 2 1 1 12 C H5 . 13 . H5 1 1
146 1 1 2 2 3 G H8 . 20 . H8 1 1
146 1 2 2 2 4 U H5 . 21 . H5 1 1
147 1 1 1 1 5 A H8 . 6 . H8 1 1
147 1 2 1 1 6 U H5 . 7 . H5 1 1
148 1 1 2 2 5 A H8 . 22 . H8 1 1
148 1 2 2 2 6 C H5 . 23 . H5 1 1
149 1 1 1 1 2 G H8 . 3 . H8 1 1
149 1 2 1 1 3 U H5 . 4 . H5 1 1
150 1 1 2 2 5 A H2' . 22 . H2'' 1 1
150 1 2 2 2 6 C H5 . 23 . H5 1 1
151 1 1 1 1 2 G H3' . 3 . H3' 1 1
151 1 2 1 1 3 U H5 . 4 . H5 1 1
152 1 1 1 1 2 G H2' . 3 . H2'' 1 1
152 1 2 1 1 3 U H5 . 4 . H5 1 1
153 1 1 1 1 6 U H2' . 7 . H2'' 1 1
153 1 2 1 1 6 U H5 . 7 . H5 1 1
154 1 1 1 1 12 C H3' . 13 . H3' 1 1
154 1 2 1 1 12 C H5 . 13 . H5 1 1
155 1 1 1 1 11 U H3' . 12 . H3' 1 1
155 1 2 1 1 12 C H5 . 13 . H5 1 1
156 1 1 1 1 11 U H2' . 12 . H2'' 1 1
156 1 2 1 1 12 C H5 . 13 . H5 1 1
157 1 1 1 1 9 G H2' . 10 . H2'' 1 1
157 1 2 1 1 10 C H5 . 11 . H5 1 1
158 1 1 2 2 3 G H2' . 20 . H2'' 1 1
158 1 2 2 2 4 U H5 . 21 . H5 1 1
159 1 1 2 2 6 C H2' . 23 . H2'' 1 1
159 1 2 2 2 7 C H5 . 24 . H5 1 1
160 1 1 2 2 3 G H3' . 20 . H3' 1 1
160 1 2 2 2 4 U H5 . 21 . H5 1 1
161 1 1 2 2 5 A H3' . 22 . H3' 1 1
161 1 2 2 2 6 C H5 . 23 . H5 1 1
162 1 1 1 1 9 G H3' . 10 . H3' 1 1
162 1 2 1 1 10 C H5 . 11 . H5 1 1
163 1 1 1 1 10 C H2' . 11 . H2'' 1 1
163 1 2 1 1 11 U H5 . 12 . H5 1 1
164 1 1 1 1 10 C H3' . 11 . H3' 1 1
164 1 2 1 1 11 U H5 . 12 . H5 1 1
165 1 1 2 2 6 C H3' . 23 . H3' 1 1
165 1 2 2 2 7 C H5 . 24 . H5 1 1
166 1 1 2 2 5 A H1' . 22 . H1' 1 1
166 1 2 2 2 6 C H5 . 23 . H5 1 1
167 1 1 1 1 4 A H2 . 5 . H2 1 1
167 1 2 1 1 6 U H5 . 7 . H5 1 1
168 1 1 1 1 6 U H1' . 7 . H1' 1 1
168 1 2 1 1 8 A H8 . 9 . H8 1 1
169 1 1 1 1 4 A H8 . 5 . H8 1 1
169 1 2 1 1 6 U H5 . 7 . H5 1 1
170 1 1 1 1 4 A H2' . 5 . H2'' 1 1
170 1 2 1 1 6 U H5 . 7 . H5 1 1
171 1 1 1 1 6 U H5' . 7 . H5' 1 1
171 1 2 1 1 7 A H2 . 8 . H2 1 1
172 1 1 1 1 6 U H5'' . 7 . H5'' 1 1
172 1 2 1 1 7 A H2 . 8 . H2 1 1
173 1 1 1 1 2 G H8 . 3 . H8 1 1
173 1 2 1 1 3 U H3' . 4 . H3' 1 1
174 1 1 2 2 4 U H3' . 21 . H3' 1 1
174 1 2 2 2 5 A H3' . 22 . H3' 1 1
175 1 1 1 1 4 A H2 . 5 . H2 1 1
175 1 2 1 1 5 A H2 . 6 . H2 1 1
176 1 1 1 1 5 A H2 . 6 . H2 1 1
176 1 2 2 2 3 G H3' . 20 . H3' 1 1
177 1 1 1 1 5 A H2 . 6 . H2 1 1
177 1 2 2 2 4 U H6 . 21 . H6 1 1
178 1 1 1 1 5 A H2 . 6 . H2 1 1
178 1 2 2 2 4 U H5 . 21 . H5 1 1
179 1 1 1 1 4 A H2 . 5 . H2 1 1
179 1 2 1 1 5 A H8 . 6 . H8 1 1
180 1 1 1 1 4 A H2 . 5 . H2 1 1
180 1 2 1 1 5 A H2' . 6 . H2'' 1 1
181 1 1 1 1 5 A H1' . 6 . H1' 1 1
181 1 2 1 1 6 U H5 . 7 . H5 1 1
182 1 1 1 1 6 U H1' . 7 . H1' 1 1
182 1 2 1 1 7 A H8 . 8 . H8 1 1
183 1 1 1 1 5 A H2 . 6 . H2 1 1
183 1 2 1 1 6 U H5 . 7 . H5 1 1
184 1 1 1 1 6 U H5 . 7 . H5 1 1
184 1 2 2 2 4 U H5 . 21 . H5 1 1
185 1 1 1 1 7 A H2 . 8 . H2 1 1
185 1 2 1 1 8 A H8 . 9 . H8 1 1
186 1 1 1 1 7 A H2 . 8 . H2 1 1
186 1 2 1 1 8 A H2' . 9 . H2'' 1 1
187 1 1 1 1 7 A H2 . 8 . H2 1 1
187 1 2 1 1 9 G H8 . 10 . H8 1 1
188 1 1 1 1 8 A H1' . 9 . H1' 1 1
188 1 2 1 1 9 G H1' . 10 . H1' 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 . . . . . 3.0 3.0 6.5 1 1
2 1 . . . . . 3.0 3.0 6.5 1 1
3 1 . . . . . 3.0 3.0 6.5 1 1
4 1 . . . . . 3.0 3.0 6.5 1 1
5 1 . . . . . 3.0 3.0 6.5 1 1
6 1 . . . . . 3.0 3.0 6.5 1 1
7 1 . . . . . 3.0 3.0 6.5 1 1
8 1 . . . . . 3.0 3.0 6.5 1 1
9 1 . . . . . 3.0 3.0 6.5 1 1
10 1 . . . . . 3.0 3.0 6.5 1 1
11 1 . . . . . 3.0 3.0 6.5 1 1
12 1 . . . . . 3.0 3.0 6.5 1 1
13 1 . . . . . 3.0 3.0 6.5 1 1
14 1 . . . . . 1.8 1.8 5.0 1 1
15 1 . . . . . 1.8 1.8 5.0 1 1
16 1 . . . . . 1.8 1.8 5.0 1 1
17 1 . . . . . 1.8 1.8 5.0 1 1
18 1 . . . . . 1.8 1.8 5.0 1 1
19 1 . . . . . 1.8 1.8 5.0 1 1
20 1 . . . . . 1.8 1.8 5.0 1 1
21 1 . . . . . 1.8 1.8 5.0 1 1
22 1 . . . . . 1.8 1.8 5.0 1 1
23 1 . . . . . 1.8 1.8 5.0 1 1
24 1 . . . . . 1.8 1.8 5.0 1 1
25 1 . . . . . 1.8 1.8 5.0 1 1
26 1 . . . . . 1.8 1.8 5.0 1 1
27 1 . . . . . 1.8 1.8 5.0 1 1
28 1 . . . . . 1.8 1.8 5.0 1 1
29 1 . . . . . 1.8 1.8 5.0 1 1
30 1 . . . . . 1.8 1.8 5.0 1 1
31 1 . . . . . 1.8 1.8 5.0 1 1
32 1 . . . . . 1.8 1.8 5.0 1 1
33 1 . . . . . 1.8 1.8 5.0 1 1
34 1 . . . . . 1.8 1.8 5.0 1 1
35 1 . . . . . 1.8 1.8 5.0 1 1
36 1 . . . . . 1.8 1.8 5.0 1 1
37 1 . . . . . 1.8 1.8 5.0 1 1
38 1 . . . . . 2.0 2.0 4.0 1 1
39 1 . . . . . 1.8 1.8 3.0 1 1
40 1 . . . . . 1.8 1.8 3.0 1 1
41 1 . . . . . 1.8 1.8 3.0 1 1
42 1 . . . . . 1.8 1.8 3.0 1 1
43 1 . . . . . 1.8 1.8 3.0 1 1
44 1 . . . . . 1.8 1.8 3.0 1 1
45 1 . . . . . 1.8 1.8 3.0 1 1
46 1 . . . . . 2.0 1.8 4.0 1 1
47 1 . . . . . 1.8 1.8 3.0 1 1
48 1 . . . . . 1.8 1.8 3.0 1 1
49 1 . . . . . 1.8 1.8 3.0 1 1
50 1 . . . . . 2.0 1.8 4.0 1 1
51 1 . . . . . 2.0 1.8 4.0 1 1
52 1 . . . . . 1.8 1.8 3.0 1 1
53 1 . . . . . 1.8 1.8 3.0 1 1
54 1 . . . . . 1.8 1.8 3.0 1 1
55 1 . . . . . 1.8 1.8 3.0 1 1
56 1 . . . . . 2.0 2.0 4.0 1 1
57 1 . . . . . 2.0 1.8 4.0 1 1
58 1 . . . . . 1.8 1.8 3.0 1 1
59 1 . . . . . 1.8 1.8 3.0 1 1
60 1 . . . . . 1.8 1.8 3.0 1 1
61 1 . . . . . 2.0 2.0 4.0 1 1
62 1 . . . . . 2.0 1.8 4.0 1 1
63 1 . . . . . 2.0 2.0 4.0 1 1
64 1 . . . . . 2.0 2.0 4.0 1 1
65 1 . . . . . 2.0 2.0 4.0 1 1
66 1 . . . . . 2.0 2.0 4.0 1 1
67 1 . . . . . 3.0 2.5 5.0 1 1
68 1 . . . . . 2.0 2.0 4.0 1 1
69 1 . . . . . 1.8 1.8 3.0 1 1
70 1 . . . . . 1.8 1.8 3.0 1 1
71 1 . . . . . 2.0 2.0 4.0 1 1
72 1 . . . . . 3.0 2.5 5.0 1 1
73 1 . . . . . 1.8 1.8 3.0 1 1
74 1 . . . . . 1.8 1.8 3.0 1 1
75 1 . . . . . 3.0 2.5 5.0 1 1
76 1 . . . . . 2.0 2.0 4.0 1 1
77 1 . . . . . 2.0 2.0 4.0 1 1
78 1 . . . . . 3.0 2.5 5.0 1 1
79 1 . . . . . 1.8 1.8 3.0 1 1
80 1 . . . . . 2.0 2.0 4.0 1 1
81 1 . . . . . 3.0 2.5 5.0 1 1
82 1 . . . . . 2.0 2.0 4.0 1 1
83 1 . . . . . 1.8 1.8 3.0 1 1
84 1 . . . . . 2.0 2.0 4.0 1 1
85 1 . . . . . 2.0 2.0 4.0 1 1
86 1 . . . . . 2.0 2.0 4.0 1 1
87 1 . . . . . 2.0 2.0 4.0 1 1
88 1 . . . . . 3.0 2.5 5.0 1 1
89 1 . . . . . 2.0 2.0 4.0 1 1
90 1 . . . . . 2.0 2.0 4.0 1 1
91 1 . . . . . 2.0 2.0 4.0 1 1
92 1 . . . . . 1.8 1.8 3.0 1 1
93 1 . . . . . 1.8 1.8 3.0 1 1
94 1 . . . . . 3.0 2.5 5.0 1 1
95 1 . . . . . 1.8 1.8 3.0 1 1
96 1 . . . . . 2.0 2.0 4.0 1 1
97 1 . . . . . 2.0 2.0 4.0 1 1
98 1 . . . . . 2.0 2.0 4.0 1 1
99 1 . . . . . 2.0 2.0 4.0 1 1
100 1 . . . . . 2.0 2.0 4.0 1 1
101 1 . . . . . 2.0 2.0 4.0 1 1
102 1 . . . . . 2.0 1.8 4.0 1 1
103 1 . . . . . 2.0 2.0 4.0 1 1
104 1 . . . . . 2.0 1.8 4.0 1 1
105 1 . . . . . 2.0 1.8 4.0 1 1
106 1 . . . . . 2.0 2.0 4.0 1 1
107 1 . . . . . 2.0 1.8 4.0 1 1
108 1 . . . . . 3.0 2.5 5.0 1 1
109 1 . . . . . 3.0 2.5 5.0 1 1
110 1 . . . . . 3.0 2.5 5.0 1 1
111 1 . . . . . 3.0 2.5 5.0 1 1
112 1 . . . . . 3.0 2.5 5.0 1 1
113 1 . . . . . 3.0 2.5 5.0 1 1
114 1 . . . . . 3.0 2.5 5.0 1 1
115 1 . . . . . 3.0 2.5 5.0 1 1
116 1 . . . . . 3.0 2.5 5.0 1 1
117 1 . . . . . 3.0 2.5 5.0 1 1
118 1 . . . . . 3.0 2.5 5.0 1 1
119 1 . . . . . 3.0 2.5 5.0 1 1
120 1 . . . . . 3.0 2.5 5.0 1 1
121 1 . . . . . 3.0 2.5 5.0 1 1
122 1 . . . . . 3.0 2.5 5.0 1 1
123 1 . . . . . 3.0 2.5 5.0 1 1
124 1 . . . . . 2.0 1.8 4.5 1 1
125 1 . . . . . 2.0 2.0 4.0 1 1
126 1 . . . . . 3.0 2.5 6.0 1 1
127 1 . . . . . 3.0 2.5 5.0 1 1
128 1 . . . . . 3.0 2.5 5.0 1 1
129 1 . . . . . 3.0 2.5 6.0 1 1
130 1 . . . . . 2.0 2.0 4.0 1 1
131 1 . . . . . 4.0 3.0 5.0 1 1
132 1 . . . . . 4.0 3.0 5.0 1 1
133 1 . . . . . 4.0 3.0 5.0 1 1
134 1 . . . . . 3.0 2.0 4.5 1 1
135 1 . . . . . 3.0 2.0 4.5 1 1
136 1 . . . . . 3.0 2.5 6.0 1 1
137 1 . . . . . 3.0 2.5 6.0 1 1
138 1 . . . . . 3.0 2.5 6.0 1 1
139 1 . . . . . 3.0 2.5 6.0 1 1
140 1 . . . . . 3.0 2.5 6.0 1 1
141 1 . . . . . 3.0 2.5 6.0 1 1
142 1 . . . . . 3.0 2.5 6.0 1 1
143 1 . . . . . 3.0 2.5 6.0 1 1
144 1 . . . . . 3.0 2.5 6.0 1 1
145 1 . . . . . 3.0 2.5 6.0 1 1
146 1 . . . . . 3.0 2.5 6.0 1 1
147 1 . . . . . 3.0 2.5 6.0 1 1
148 1 . . . . . 3.0 2.5 6.0 1 1
149 1 . . . . . 3.0 2.5 6.0 1 1
150 1 . . . . . 2.0 2.0 4.0 1 1
151 1 . . . . . 3.0 2.5 5.0 1 1
152 1 . . . . . 3.0 2.5 6.0 1 1
153 1 . . . . . 3.0 2.5 5.0 1 1
154 1 . . . . . 3.0 2.5 5.0 1 1
155 1 . . . . . 3.0 2.5 5.0 1 1
156 1 . . . . . 2.0 2.0 4.0 1 1
157 1 . . . . . 2.0 2.0 4.0 1 1
158 1 . . . . . 2.0 2.0 4.0 1 1
159 1 . . . . . 3.0 2.5 5.0 1 1
160 1 . . . . . 3.0 2.5 5.0 1 1
161 1 . . . . . 3.0 2.5 6.0 1 1
162 1 . . . . . 2.0 2.0 4.0 1 1
163 1 . . . . . 3.0 2.5 5.0 1 1
164 1 . . . . . 3.0 2.5 5.0 1 1
165 1 . . . . . 3.0 2.5 5.0 1 1
166 1 . . . . . 3.0 2.5 6.0 1 1
167 1 . . . . . 6.0 5.0 66.0 1 1
168 1 . . . . . 6.0 5.0 66.0 1 1
169 1 . . . . . 6.0 5.0 66.0 1 1
170 1 . . . . . 6.0 5.0 66.0 1 1
171 1 . . . . . 6.0 5.0 66.0 1 1
172 1 . . . . . 6.0 5.0 66.0 1 1
173 1 . . . . . 6.0 5.0 66.0 1 1
174 1 . . . . . 6.0 5.0 66.0 1 1
175 1 . . . . . 6.0 5.0 66.0 1 1
176 1 . . . . . 6.0 5.0 66.0 1 1
177 1 . . . . . 6.0 5.0 66.0 1 1
178 1 . . . . . 6.0 5.0 66.0 1 1
179 1 . . . . . 6.0 5.0 66.0 1 1
180 1 . . . . . 6.0 5.0 66.0 1 1
181 1 . . . . . 6.0 5.0 66.0 1 1
182 1 . . . . . 6.0 5.0 66.0 1 1
183 1 . . . . . 6.0 5.0 66.0 1 1
184 1 . . . . . 6.0 5.0 66.0 1 1
185 1 . . . . . 6.0 5.0 66.0 1 1
186 1 . . . . . 6.0 5.0 66.0 1 1
187 1 . . . . . 6.0 5.0 66.0 1 1
188 1 . . . . . 6.0 5.0 66.0 1 1
stop_
save_
save_CNS/XPLOR_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
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 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 1 G H1 . 2 . H1 1 2
1 1 2 2 2 7 C N3 . 24 . N3 1 2
2 1 1 1 1 1 G H21 . 2 . H21 1 2
2 1 2 2 2 7 C O2 . 24 . O2 1 2
3 1 1 1 1 1 G O6 . 2 . O6 1 2
3 1 2 2 2 7 C H41 . 24 . H41 1 2
4 1 1 1 1 1 G H21 . 2 . H21 1 2
4 1 2 2 2 7 C N3 . 24 . N3 1 2
5 1 1 1 1 2 G H1 . 3 . H1 1 2
5 1 2 2 2 6 C N3 . 23 . N3 1 2
6 1 1 1 1 2 G H21 . 3 . H21 1 2
6 1 2 2 2 6 C O2 . 23 . O2 1 2
7 1 1 1 1 2 G O6 . 3 . O6 1 2
7 1 2 2 2 6 C H41 . 23 . H41 1 2
8 1 1 1 1 2 G H21 . 3 . H21 1 2
8 1 2 2 2 6 C N3 . 23 . N3 1 2
9 1 1 1 1 10 C N3 . 11 . N3 1 2
9 1 2 2 2 3 G H1 . 20 . H1 1 2
10 1 1 1 1 10 C O2 . 11 . O2 1 2
10 1 2 2 2 3 G H21 . 20 . H21 1 2
11 1 1 1 1 10 C H41 . 11 . H41 1 2
11 1 2 2 2 3 G O6 . 20 . O6 1 2
12 1 1 1 1 10 C N3 . 11 . N3 1 2
12 1 2 2 2 3 G H21 . 20 . H21 1 2
13 1 1 1 1 12 C N3 . 13 . N3 1 2
13 1 2 2 2 1 G H1 . 18 . H1 1 2
14 1 1 1 1 12 C O2 . 13 . O2 1 2
14 1 2 2 2 1 G H21 . 18 . H21 1 2
15 1 1 1 1 12 C H41 . 13 . H41 1 2
15 1 2 2 2 1 G O6 . 18 . O6 1 2
16 1 1 1 1 12 C N3 . 13 . N3 1 2
16 1 2 2 2 1 G H21 . 18 . H21 1 2
17 1 1 1 1 11 U H3 . 12 . H3 1 2
17 1 2 2 2 2 A N1 . 19 . N1 1 2
18 1 1 1 1 11 U O4 . 12 . O4 1 2
18 1 2 2 2 2 A H61 . 19 . H61 1 2
19 1 1 1 1 11 U O2 . 12 . O2 1 2
19 1 2 2 2 2 A H2 . 19 . H2 1 2
20 1 1 1 1 11 U H3 . 12 . H3 1 2
20 1 2 2 2 2 A H2 . 19 . H2 1 2
21 1 1 1 1 9 G O6 . 10 . O6 1 2
21 1 2 2 2 4 U H3 . 21 . H3 1 2
22 1 1 1 1 9 G H1 . 10 . H1 1 2
22 1 2 2 2 4 U O2 . 21 . O2 1 2
23 1 1 1 1 9 G O6 . 10 . O6 1 2
23 1 2 2 2 4 U O2 . 21 . O2 1 2
24 1 1 1 1 9 G N1 . 10 . N1 1 2
24 1 2 2 2 4 U N3 . 21 . N3 1 2
25 1 1 1 1 9 G H1 . 10 . H1 1 2
25 1 2 2 2 4 U H3 . 21 . H3 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 . . . . . 1.9 1.8 2.0 1 2
2 1 . . . . . 2.0 1.9 2.1 1 2
3 1 . . . . . 1.7 1.6 1.8 1 2
4 1 . . . . . 3.0 2.9 3.1 1 2
5 1 . . . . . 1.9 1.8 2.0 1 2
6 1 . . . . . 2.0 1.9 2.1 1 2
7 1 . . . . . 1.7 1.6 1.8 1 2
8 1 . . . . . 3.0 2.9 3.1 1 2
9 1 . . . . . 1.9 1.8 2.0 1 2
10 1 . . . . . 2.0 1.9 2.1 1 2
11 1 . . . . . 1.7 1.6 1.8 1 2
12 1 . . . . . 3.0 2.9 3.1 1 2
13 1 . . . . . 1.9 1.8 2.0 1 2
14 1 . . . . . 2.0 1.9 2.1 1 2
15 1 . . . . . 1.7 1.6 1.8 1 2
16 1 . . . . . 3.0 2.9 3.1 1 2
17 1 . . . . . 1.9 1.8 2.0 1 2
18 1 . . . . . 1.8 1.7 1.9 1 2
19 1 . . . . . 3.2 3.1 3.3 1 2
20 1 . . . . . 2.9 2.8 3.0 1 2
21 1 . . . . . 1.9 1.8 2.0 1 2
22 1 . . . . . 1.8 1.7 1.9 1 2
23 1 . . . . . 3.7 3.6 3.8 1 2
24 1 . . . . . 3.7 3.6 3.8 1 2
25 1 . . . . . 2.6 2.5 2.7 1 2
stop_
save_
save_CNS/XPLOR_dihedral_5
_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 G H22 1 1 1 G N2 1 1 1 G C2 1 1 1 G N3 -5.0 5.0 . 2 . H22 . 2 . N2 . 2 . C2 . 2 . N3 1 1
2 . 1 1 2 G H22 1 1 2 G N2 1 1 2 G C2 1 1 2 G N3 -5.0 5.0 . 3 . H22 . 3 . N2 . 3 . C2 . 3 . N3 1 1
3 . 1 1 4 A H62 1 1 4 A N6 1 1 4 A C6 1 1 4 A C5 -5.0 5.0 . 5 . H62 . 5 . N6 . 5 . C6 . 5 . C5 1 1
4 . 1 1 5 A H62 1 1 5 A N6 1 1 5 A C6 1 1 5 A C5 -5.0 5.0 . 6 . H62 . 6 . N6 . 6 . C6 . 6 . C5 1 1
5 . 1 1 7 A H62 1 1 7 A N6 1 1 7 A C6 1 1 7 A C5 -5.0 5.0 . 8 . H62 . 8 . N6 . 8 . C6 . 8 . C5 1 1
6 . 1 1 8 A H62 1 1 8 A N6 1 1 8 A C6 1 1 8 A C5 -5.0 5.0 . 9 . H62 . 9 . N6 . 9 . C6 . 9 . C5 1 1
7 . 1 1 9 G H22 1 1 9 G N2 1 1 9 G C2 1 1 9 G N3 -5.0 5.0 . 10 . H22 . 10 . N2 . 10 . C2 . 10 . N3 1 1
8 . 1 1 10 C H42 1 1 10 C N4 1 1 10 C C4 1 1 10 C C5 -5.0 5.0 . 11 . H42 . 11 . N4 . 11 . C4 . 11 . C5 1 1
9 . 1 1 12 C H42 1 1 12 C N4 1 1 12 C C4 1 1 12 C C5 -5.0 5.0 . 13 . H42 . 13 . N4 . 13 . C4 . 13 . C5 1 1
10 . 2 2 1 G H22 2 2 1 G N2 2 2 1 G C2 2 2 1 G N3 -5.0 5.0 . 18 . H22 . 18 . N2 . 18 . C2 . 18 . N3 1 1
11 . 2 2 2 A H62 2 2 2 A N6 2 2 2 A C6 2 2 2 A C5 -5.0 5.0 . 19 . H62 . 19 . N6 . 19 . C6 . 19 . C5 1 1
12 . 2 2 3 G H22 2 2 3 G N2 2 2 3 G C2 2 2 3 G N3 -5.0 5.0 . 20 . H22 . 20 . N2 . 20 . C2 . 20 . N3 1 1
13 . 2 2 5 A H62 2 2 5 A N6 2 2 5 A C6 2 2 5 A C5 -5.0 5.0 . 22 . H62 . 22 . N6 . 22 . C6 . 22 . C5 1 1
14 . 2 2 6 C H42 2 2 6 C N4 2 2 6 C C4 2 2 6 C C5 -5.0 5.0 . 23 . H42 . 23 . N4 . 23 . C4 . 23 . C5 1 1
15 . 2 2 7 C H42 2 2 7 C N4 2 2 7 C C4 2 2 7 C C5 -5.0 5.0 . 24 . H42 . 24 . N4 . 24 . C4 . 24 . C5 1 1
16 . 1 1 1 G C4' 1 1 1 G O4' 1 1 1 G C1' 1 1 1 G C2' -5.0 5.0 . 2 . C4' . 2 . O4' . 2 . C1' . 2 . C2' 1 1
17 . 1 1 1 G O4' 1 1 1 G C1' 1 1 1 G C2' 1 1 1 G C3' -26.999998 -17.0 . 2 . O4' . 2 . C1' . 2 . C2' . 2 . C3' 1 1
18 . 1 1 1 G C1' 1 1 1 G C2' 1 1 1 G C3' 1 1 1 G C4' 30.999998 41.0 . 2 . C1' . 2 . C2' . 2 . C3' . 2 . C4' 1 1
19 . 1 1 1 G C2' 1 1 1 G C3' 1 1 1 G C4' 1 1 1 G O4' -41.0 -30.999998 . 2 . C2' . 2 . C3' . 2 . C4' . 2 . O4' 1 1
20 . 1 1 2 G C4' 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G C2' -5.0 5.0 . 3 . C4' . 3 . O4' . 3 . C1' . 3 . C2' 1 1
21 . 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G C2' 1 1 2 G C3' -26.999998 -17.0 . 3 . O4' . 3 . C1' . 3 . C2' . 3 . C3' 1 1
22 . 1 1 2 G C1' 1 1 2 G C2' 1 1 2 G C3' 1 1 2 G C4' 30.999998 41.0 . 3 . C1' . 3 . C2' . 3 . C3' . 3 . C4' 1 1
23 . 1 1 2 G C2' 1 1 2 G C3' 1 1 2 G C4' 1 1 2 G O4' -41.0 -30.999998 . 3 . C2' . 3 . C3' . 3 . C4' . 3 . O4' 1 1
24 . 1 1 3 U C4' 1 1 3 U O4' 1 1 3 U C1' 1 1 3 U C2' -5.0 5.0 . 4 . C4' . 4 . O4' . 4 . C1' . 4 . C2' 1 1
25 . 1 1 3 U O4' 1 1 3 U C1' 1 1 3 U C2' 1 1 3 U C3' -26.999998 -17.0 . 4 . O4' . 4 . C1' . 4 . C2' . 4 . C3' 1 1
26 . 1 1 3 U C1' 1 1 3 U C2' 1 1 3 U C3' 1 1 3 U C4' 30.999998 41.0 . 4 . C1' . 4 . C2' . 4 . C3' . 4 . C4' 1 1
27 . 1 1 3 U C2' 1 1 3 U C3' 1 1 3 U C4' 1 1 3 U O4' -41.0 -30.999998 . 4 . C2' . 4 . C3' . 4 . C4' . 4 . O4' 1 1
28 . 1 1 4 A C4' 1 1 4 A O4' 1 1 4 A C1' 1 1 4 A C2' -5.0 5.0 . 5 . C4' . 5 . O4' . 5 . C1' . 5 . C2' 1 1
29 . 1 1 4 A O4' 1 1 4 A C1' 1 1 4 A C2' 1 1 4 A C3' -26.999998 -17.0 . 5 . O4' . 5 . C1' . 5 . C2' . 5 . C3' 1 1
30 . 1 1 4 A C1' 1 1 4 A C2' 1 1 4 A C3' 1 1 4 A C4' 30.999998 41.0 . 5 . C1' . 5 . C2' . 5 . C3' . 5 . C4' 1 1
31 . 1 1 4 A C2' 1 1 4 A C3' 1 1 4 A C4' 1 1 4 A O4' -41.0 -30.999998 . 5 . C2' . 5 . C3' . 5 . C4' . 5 . O4' 1 1
32 . 1 1 9 G C4' 1 1 9 G O4' 1 1 9 G C1' 1 1 9 G C2' -5.0 5.0 . 10 . C4' . 10 . O4' . 10 . C1' . 10 . C2' 1 1
33 . 1 1 9 G O4' 1 1 9 G C1' 1 1 9 G C2' 1 1 9 G C3' -26.999998 -17.0 . 10 . O4' . 10 . C1' . 10 . C2' . 10 . C3' 1 1
34 . 1 1 9 G C1' 1 1 9 G C2' 1 1 9 G C3' 1 1 9 G C4' 30.999998 41.0 . 10 . C1' . 10 . C2' . 10 . C3' . 10 . C4' 1 1
35 . 1 1 9 G C2' 1 1 9 G C3' 1 1 9 G C4' 1 1 9 G O4' -41.0 -30.999998 . 10 . C2' . 10 . C3' . 10 . C4' . 10 . O4' 1 1
36 . 1 1 10 C C4' 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C C2' -5.0 5.0 . 11 . C4' . 11 . O4' . 11 . C1' . 11 . C2' 1 1
37 . 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C C2' 1 1 10 C C3' -26.999998 -17.0 . 11 . O4' . 11 . C1' . 11 . C2' . 11 . C3' 1 1
38 . 1 1 10 C C1' 1 1 10 C C2' 1 1 10 C C3' 1 1 10 C C4' 30.999998 41.0 . 11 . C1' . 11 . C2' . 11 . C3' . 11 . C4' 1 1
39 . 1 1 10 C C2' 1 1 10 C C3' 1 1 10 C C4' 1 1 10 C O4' -41.0 -30.999998 . 11 . C2' . 11 . C3' . 11 . C4' . 11 . O4' 1 1
40 . 1 1 11 U C4' 1 1 11 U O4' 1 1 11 U C1' 1 1 11 U C2' -5.0 5.0 . 12 . C4' . 12 . O4' . 12 . C1' . 12 . C2' 1 1
41 . 1 1 11 U O4' 1 1 11 U C1' 1 1 11 U C2' 1 1 11 U C3' -26.999998 -17.0 . 12 . O4' . 12 . C1' . 12 . C2' . 12 . C3' 1 1
42 . 1 1 11 U C1' 1 1 11 U C2' 1 1 11 U C3' 1 1 11 U C4' 30.999998 41.0 . 12 . C1' . 12 . C2' . 12 . C3' . 12 . C4' 1 1
43 . 1 1 11 U C2' 1 1 11 U C3' 1 1 11 U C4' 1 1 11 U O4' -41.0 -30.999998 . 12 . C2' . 12 . C3' . 12 . C4' . 12 . O4' 1 1
44 . 1 1 12 C C4' 1 1 12 C O4' 1 1 12 C C1' 1 1 12 C C2' -5.0 5.0 . 13 . C4' . 13 . O4' . 13 . C1' . 13 . C2' 1 1
45 . 1 1 12 C O4' 1 1 12 C C1' 1 1 12 C C2' 1 1 12 C C3' -26.999998 -17.0 . 13 . O4' . 13 . C1' . 13 . C2' . 13 . C3' 1 1
46 . 1 1 12 C C1' 1 1 12 C C2' 1 1 12 C C3' 1 1 12 C C4' 30.999998 41.0 . 13 . C1' . 13 . C2' . 13 . C3' . 13 . C4' 1 1
47 . 1 1 12 C C2' 1 1 12 C C3' 1 1 12 C C4' 1 1 12 C O4' -41.0 -30.999998 . 13 . C2' . 13 . C3' . 13 . C4' . 13 . O4' 1 1
48 . 2 2 1 G C4' 2 2 1 G O4' 2 2 1 G C1' 2 2 1 G C2' -5.0 5.0 . 18 . C4' . 18 . O4' . 18 . C1' . 18 . C2' 1 1
49 . 2 2 1 G O4' 2 2 1 G C1' 2 2 1 G C2' 2 2 1 G C3' -26.999998 -17.0 . 18 . O4' . 18 . C1' . 18 . C2' . 18 . C3' 1 1
50 . 2 2 1 G C1' 2 2 1 G C2' 2 2 1 G C3' 2 2 1 G C4' 30.999998 41.0 . 18 . C1' . 18 . C2' . 18 . C3' . 18 . C4' 1 1
51 . 2 2 1 G C2' 2 2 1 G C3' 2 2 1 G C4' 2 2 1 G O4' -41.0 -30.999998 . 18 . C2' . 18 . C3' . 18 . C4' . 18 . O4' 1 1
52 . 2 2 2 A C4' 2 2 2 A O4' 2 2 2 A C1' 2 2 2 A C2' -5.0 5.0 . 19 . C4' . 19 . O4' . 19 . C1' . 19 . C2' 1 1
53 . 2 2 2 A O4' 2 2 2 A C1' 2 2 2 A C2' 2 2 2 A C3' -26.999998 -17.0 . 19 . O4' . 19 . C1' . 19 . C2' . 19 . C3' 1 1
54 . 2 2 2 A C1' 2 2 2 A C2' 2 2 2 A C3' 2 2 2 A C4' 30.999998 41.0 . 19 . C1' . 19 . C2' . 19 . C3' . 19 . C4' 1 1
55 . 2 2 2 A C2' 2 2 2 A C3' 2 2 2 A C4' 2 2 2 A O4' -41.0 -30.999998 . 19 . C2' . 19 . C3' . 19 . C4' . 19 . O4' 1 1
56 . 2 2 3 G C4' 2 2 3 G O4' 2 2 3 G C1' 2 2 3 G C2' -5.0 5.0 . 20 . C4' . 20 . O4' . 20 . C1' . 20 . C2' 1 1
57 . 2 2 3 G O4' 2 2 3 G C1' 2 2 3 G C2' 2 2 3 G C3' -26.999998 -17.0 . 20 . O4' . 20 . C1' . 20 . C2' . 20 . C3' 1 1
58 . 2 2 3 G C1' 2 2 3 G C2' 2 2 3 G C3' 2 2 3 G C4' 30.999998 41.0 . 20 . C1' . 20 . C2' . 20 . C3' . 20 . C4' 1 1
59 . 2 2 3 G C2' 2 2 3 G C3' 2 2 3 G C4' 2 2 3 G O4' -41.0 -30.999998 . 20 . C2' . 20 . C3' . 20 . C4' . 20 . O4' 1 1
60 . 2 2 5 A C4' 2 2 5 A O4' 2 2 5 A C1' 2 2 5 A C2' -5.0 5.0 . 22 . C4' . 22 . O4' . 22 . C1' . 22 . C2' 1 1
61 . 2 2 5 A O4' 2 2 5 A C1' 2 2 5 A C2' 2 2 5 A C3' -26.999998 -17.0 . 22 . O4' . 22 . C1' . 22 . C2' . 22 . C3' 1 1
62 . 2 2 5 A C1' 2 2 5 A C2' 2 2 5 A C3' 2 2 5 A C4' 30.999998 41.0 . 22 . C1' . 22 . C2' . 22 . C3' . 22 . C4' 1 1
63 . 2 2 5 A C2' 2 2 5 A C3' 2 2 5 A C4' 2 2 5 A O4' -41.0 -30.999998 . 22 . C2' . 22 . C3' . 22 . C4' . 22 . O4' 1 1
64 . 2 2 6 C C4' 2 2 6 C O4' 2 2 6 C C1' 2 2 6 C C2' -5.0 5.0 . 23 . C4' . 23 . O4' . 23 . C1' . 23 . C2' 1 1
65 . 2 2 6 C O4' 2 2 6 C C1' 2 2 6 C C2' 2 2 6 C C3' -26.999998 -17.0 . 23 . O4' . 23 . C1' . 23 . C2' . 23 . C3' 1 1
66 . 2 2 6 C C1' 2 2 6 C C2' 2 2 6 C C3' 2 2 6 C C4' 30.999998 41.0 . 23 . C1' . 23 . C2' . 23 . C3' . 23 . C4' 1 1
67 . 2 2 6 C C2' 2 2 6 C C3' 2 2 6 C C4' 2 2 6 C O4' -41.0 -30.999998 . 23 . C2' . 23 . C3' . 23 . C4' . 23 . O4' 1 1
68 . 2 2 7 C C4' 2 2 7 C O4' 2 2 7 C C1' 2 2 7 C C2' -5.0 5.0 . 24 . C4' . 24 . O4' . 24 . C1' . 24 . C2' 1 1
69 . 2 2 7 C O4' 2 2 7 C C1' 2 2 7 C C2' 2 2 7 C C3' -26.999998 -17.0 . 24 . O4' . 24 . C1' . 24 . C2' . 24 . C3' 1 1
70 . 2 2 7 C C1' 2 2 7 C C2' 2 2 7 C C3' 2 2 7 C C4' 30.999998 41.0 . 24 . C1' . 24 . C2' . 24 . C3' . 24 . C4' 1 1
71 . 2 2 7 C C2' 2 2 7 C C3' 2 2 7 C C4' 2 2 7 C O4' -41.0 -30.999998 . 24 . C2' . 24 . C3' . 24 . C4' . 24 . O4' 1 1
72 . 1 1 6 U C4' 1 1 6 U O4' 1 1 6 U C1' 1 1 6 U C2' -23.0 -13.0 . 7 . C4' . 7 . O4' . 7 . C1' . 7 . C2' 1 1
73 . 1 1 6 U O4' 1 1 6 U C1' 1 1 6 U C2' 1 1 6 U C3' 29.0 39.0 . 7 . O4' . 7 . C1' . 7 . C2' . 7 . C3' 1 1
74 . 1 1 6 U C1' 1 1 6 U C2' 1 1 6 U C3' 1 1 6 U C4' -42.0 -32.0 . 7 . C1' . 7 . C2' . 7 . C3' . 7 . C4' 1 1
75 . 1 1 6 U C2' 1 1 6 U C3' 1 1 6 U C4' 1 1 6 U O4' 21.0 30.999998 . 7 . C2' . 7 . C3' . 7 . C4' . 7 . O4' 1 1
76 . 1 1 7 A C4' 1 1 7 A O4' 1 1 7 A C1' 1 1 7 A C2' -23.0 -13.0 . 8 . C4' . 8 . O4' . 8 . C1' . 8 . C2' 1 1
77 . 1 1 7 A O4' 1 1 7 A C1' 1 1 7 A C2' 1 1 7 A C3' 29.0 39.0 . 8 . O4' . 8 . C1' . 8 . C2' . 8 . C3' 1 1
78 . 1 1 7 A C1' 1 1 7 A C2' 1 1 7 A C3' 1 1 7 A C4' -42.0 -32.0 . 8 . C1' . 8 . C2' . 8 . C3' . 8 . C4' 1 1
79 . 1 1 7 A C2' 1 1 7 A C3' 1 1 7 A C4' 1 1 7 A O4' 21.0 30.999998 . 8 . C2' . 8 . C3' . 8 . C4' . 8 . O4' 1 1
80 . 1 1 5 A C4' 1 1 5 A O4' 1 1 5 A C1' 1 1 5 A C2' -40.0 0.0 . 6 . C4' . 6 . O4' . 6 . C1' . 6 . C2' 1 1
81 . 1 1 5 A O4' 1 1 5 A C1' 1 1 5 A C2' 1 1 5 A C3' -10.0 40.0 . 6 . O4' . 6 . C1' . 6 . C2' . 6 . C3' 1 1
82 . 1 1 5 A C1' 1 1 5 A C2' 1 1 5 A C3' 1 1 5 A C4' -35.0 35.0 . 6 . C1' . 6 . C2' . 6 . C3' . 6 . C4' 1 1
83 . 1 1 5 A C2' 1 1 5 A C3' 1 1 5 A C4' 1 1 5 A O4' -40.0 40.0 . 6 . C2' . 6 . C3' . 6 . C4' . 6 . O4' 1 1
84 . 1 1 8 A C4' 1 1 8 A O4' 1 1 8 A C1' 1 1 8 A C2' -40.0 0.0 . 9 . C4' . 9 . O4' . 9 . C1' . 9 . C2' 1 1
85 . 1 1 8 A O4' 1 1 8 A C1' 1 1 8 A C2' 1 1 8 A C3' -10.0 40.0 . 9 . O4' . 9 . C1' . 9 . C2' . 9 . C3' 1 1
86 . 1 1 8 A C1' 1 1 8 A C2' 1 1 8 A C3' 1 1 8 A C4' -35.0 35.0 . 9 . C1' . 9 . C2' . 9 . C3' . 9 . C4' 1 1
87 . 1 1 8 A C2' 1 1 8 A C3' 1 1 8 A C4' 1 1 8 A O4' -40.0 40.0 . 9 . C2' . 9 . C3' . 9 . C4' . 9 . O4' 1 1
88 . 2 2 4 U C4' 2 2 4 U O4' 2 2 4 U C1' 2 2 4 U C2' -40.0 0.0 . 21 . C4' . 21 . O4' . 21 . C1' . 21 . C2' 1 1
89 . 2 2 4 U O4' 2 2 4 U C1' 2 2 4 U C2' 2 2 4 U C3' -10.0 40.0 . 21 . O4' . 21 . C1' . 21 . C2' . 21 . C3' 1 1
90 . 2 2 4 U C1' 2 2 4 U C2' 2 2 4 U C3' 2 2 4 U C4' -35.0 35.0 . 21 . C1' . 21 . C2' . 21 . C3' . 21 . C4' 1 1
91 . 2 2 4 U C2' 2 2 4 U C3' 2 2 4 U C4' 2 2 4 U O4' -40.0 40.0 . 21 . C2' . 21 . C3' . 21 . C4' . 21 . O4' 1 1
92 . 1 1 1 G O4' 1 1 1 G C1' 1 1 1 G N9 1 1 1 G C4 -179.99998 -40.0 . 2 . O4' . 2 . C1' . 2 . N9 . 2 . C4 1 1
93 . 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G N9 1 1 2 G C4 -179.99998 -40.0 . 3 . O4' . 3 . C1' . 3 . N9 . 3 . C4 1 1
94 . 1 1 3 U O4' 1 1 3 U C1' 1 1 3 U N1 1 1 3 U C2 -179.99998 -40.0 . 4 . O4' . 4 . C1' . 4 . N1 . 4 . C2 1 1
95 . 1 1 4 A O4' 1 1 4 A C1' 1 1 4 A N9 1 1 4 A C4 -179.99998 -40.0 . 5 . O4' . 5 . C1' . 5 . N9 . 5 . C4 1 1
96 . 1 1 5 A O4' 1 1 5 A C1' 1 1 5 A N9 1 1 5 A C4 -179.99998 -40.0 . 6 . O4' . 6 . C1' . 6 . N9 . 6 . C4 1 1
97 . 1 1 8 A O4' 1 1 8 A C1' 1 1 8 A N9 1 1 8 A C4 -179.99998 -40.0 . 9 . O4' . 9 . C1' . 9 . N9 . 9 . C4 1 1
98 . 1 1 9 G O4' 1 1 9 G C1' 1 1 9 G N9 1 1 9 G C4 -179.99998 -40.0 . 10 . O4' . 10 . C1' . 10 . N9 . 10 . C4 1 1
99 . 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C N1 1 1 10 C C2 -179.99998 -40.0 . 11 . O4' . 11 . C1' . 11 . N1 . 11 . C2 1 1
100 . 1 1 11 U O4' 1 1 11 U C1' 1 1 11 U N1 1 1 11 U C2 -179.99998 -40.0 . 12 . O4' . 12 . C1' . 12 . N1 . 12 . C2 1 1
101 . 1 1 12 C O4' 1 1 12 C C1' 1 1 12 C N1 1 1 12 C C2 -179.99998 -40.0 . 13 . O4' . 13 . C1' . 13 . N1 . 13 . C2 1 1
102 . 2 2 1 G O4' 2 2 1 G C1' 2 2 1 G N9 2 2 1 G C4 -179.99998 -40.0 . 18 . O4' . 18 . C1' . 18 . N9 . 18 . C4 1 1
103 . 2 2 2 A O4' 2 2 2 A C1' 2 2 2 A N9 2 2 2 A C4 -179.99998 -40.0 . 19 . O4' . 19 . C1' . 19 . N9 . 19 . C4 1 1
104 . 2 2 3 G O4' 2 2 3 G C1' 2 2 3 G N9 2 2 3 G C4 -179.99998 -40.0 . 20 . O4' . 20 . C1' . 20 . N9 . 20 . C4 1 1
105 . 2 2 4 U O4' 2 2 4 U C1' 2 2 4 U N1 2 2 4 U C2 -179.99998 -40.0 . 21 . O4' . 21 . C1' . 21 . N1 . 21 . C2 1 1
106 . 2 2 5 A O4' 2 2 5 A C1' 2 2 5 A N9 2 2 5 A C4 -179.99998 -40.0 . 22 . O4' . 22 . C1' . 22 . N9 . 22 . C4 1 1
107 . 2 2 6 C O4' 2 2 6 C C1' 2 2 6 C N1 2 2 6 C C2 -179.99998 -40.0 . 23 . O4' . 23 . C1' . 23 . N1 . 23 . C2 1 1
108 . 2 2 7 C O4' 2 2 7 C C1' 2 2 7 C N1 2 2 7 C C2 -179.99998 -40.0 . 24 . O4' . 24 . C1' . 24 . N1 . 24 . C2 1 1
109 . 1 1 2 G P 1 1 2 G O5' 1 1 2 G C5' 1 1 2 G C4' 160.0 200.0 . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' 1 1
110 . 1 1 3 U P 1 1 3 U O5' 1 1 3 U C5' 1 1 3 U C4' 160.0 200.0 . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' 1 1
111 . 1 1 10 C P 1 1 10 C O5' 1 1 10 C C5' 1 1 10 C C4' 160.0 200.0 . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' 1 1
112 . 1 1 11 U P 1 1 11 U O5' 1 1 11 U C5' 1 1 11 U C4' 160.0 200.0 . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' 1 1
113 . 1 1 12 C P 1 1 12 C O5' 1 1 12 C C5' 1 1 12 C C4' 160.0 200.0 . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' 1 1
114 . 2 2 2 A P 2 2 2 A O5' 2 2 2 A C5' 2 2 2 A C4' 160.0 200.0 . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' 1 1
115 . 2 2 3 G P 2 2 3 G O5' 2 2 3 G C5' 2 2 3 G C4' 160.0 200.0 . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' 1 1
116 . 2 2 4 U P 2 2 4 U O5' 2 2 4 U C5' 2 2 4 U C4' 160.0 200.0 . 21 . P . 21 . O5' . 21 . C5' . 21 . C4' 1 1
117 . 2 2 6 C P 2 2 6 C O5' 2 2 6 C C5' 2 2 6 C C4' 160.0 200.0 . 23 . P . 23 . O5' . 23 . C5' . 23 . C4' 1 1
118 . 2 2 7 C P 2 2 7 C O5' 2 2 7 C C5' 2 2 7 C C4' 160.0 200.0 . 24 . P . 24 . O5' . 24 . C5' . 24 . C4' 1 1
119 . 1 1 1 G O5' 1 1 1 G C5' 1 1 1 G C4' 1 1 1 G C3' 35.0 75.0 . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' 1 1
120 . 1 1 2 G O5' 1 1 2 G C5' 1 1 2 G C4' 1 1 2 G C3' 35.0 75.0 . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' 1 1
121 . 1 1 3 U O5' 1 1 3 U C5' 1 1 3 U C4' 1 1 3 U C3' 35.0 75.0 . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' 1 1
122 . 1 1 10 C O5' 1 1 10 C C5' 1 1 10 C C4' 1 1 10 C C3' 35.0 75.0 . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' 1 1
123 . 1 1 11 U O5' 1 1 11 U C5' 1 1 11 U C4' 1 1 11 U C3' 35.0 75.0 . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' 1 1
124 . 1 1 12 C O5' 1 1 12 C C5' 1 1 12 C C4' 1 1 12 C C3' 35.0 75.0 . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' 1 1
125 . 2 2 1 G O5' 2 2 1 G C5' 2 2 1 G C4' 2 2 1 G C3' 35.0 75.0 . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' 1 1
126 . 2 2 2 A O5' 2 2 2 A C5' 2 2 2 A C4' 2 2 2 A C3' 35.0 75.0 . 19 . O5' . 19 . C5' . 19 . C4' . 19 . C3' 1 1
127 . 2 2 3 G O5' 2 2 3 G C5' 2 2 3 G C4' 2 2 3 G C3' 35.0 75.0 . 20 . O5' . 20 . C5' . 20 . C4' . 20 . C3' 1 1
128 . 2 2 4 U O5' 2 2 4 U C5' 2 2 4 U C4' 2 2 4 U C3' 35.0 75.0 . 21 . O5' . 21 . C5' . 21 . C4' . 21 . C3' 1 1
129 . 2 2 6 C O5' 2 2 6 C C5' 2 2 6 C C4' 2 2 6 C C3' 35.0 75.0 . 23 . O5' . 23 . C5' . 23 . C4' . 23 . C3' 1 1
130 . 2 2 7 C O5' 2 2 7 C C5' 2 2 7 C C4' 2 2 7 C C3' 35.0 75.0 . 24 . O5' . 24 . C5' . 24 . C4' . 24 . C3' 1 1
131 . 1 1 2 G C4' 1 1 2 G C3' 1 1 2 G O3' 1 1 2 G P -174.99998 -135.0 . 3 . C4' . 3 . C3' . 3 . O3' . 3 . P 1 1
132 . 1 1 9 G C4' 1 1 9 G C3' 1 1 9 G O3' 1 1 9 G P -174.99998 -135.0 . 10 . C4' . 10 . C3' . 10 . O3' . 10 . P 1 1
133 . 1 1 10 C C4' 1 1 10 C C3' 1 1 10 C O3' 1 1 10 C P -174.99998 -135.0 . 11 . C4' . 11 . C3' . 11 . O3' . 11 . P 1 1
134 . 1 1 11 U C4' 1 1 11 U C3' 1 1 11 U O3' 1 1 11 U P -174.99998 -135.0 . 12 . C4' . 12 . C3' . 12 . O3' . 12 . P 1 1
135 . 2 2 2 A C4' 2 2 2 A C3' 2 2 2 A O3' 2 2 2 A P -174.99998 -135.0 . 19 . C4' . 19 . C3' . 19 . O3' . 19 . P 1 1
136 . 2 2 3 G C4' 2 2 3 G C3' 2 2 3 G O3' 2 2 3 G P -174.99998 -135.0 . 20 . C4' . 20 . C3' . 20 . O3' . 20 . P 1 1
137 . 2 2 5 A C4' 2 2 5 A C3' 2 2 5 A O3' 2 2 5 A P -174.99998 -135.0 . 22 . C4' . 22 . C3' . 22 . O3' . 22 . P 1 1
138 . 2 2 6 C C4' 2 2 6 C C3' 2 2 6 C O3' 2 2 6 C P -174.99998 -135.0 . 23 . C4' . 23 . C3' . 23 . O3' . 23 . P 1 1
139 . 1 1 1 G O3' 1 1 2 G P 1 1 2 G O5' 1 1 2 G C5' -100.0 -40.0 . 2 . O3' . 3 . P . 3 . O5' . 3 . C5' 1 1
140 . 1 1 2 G O3' 1 1 3 U P 1 1 3 U O5' 1 1 3 U C5' -100.0 -40.0 . 3 . O3' . 4 . P . 4 . O5' . 4 . C5' 1 1
141 . 1 1 9 G O3' 1 1 10 C P 1 1 10 C O5' 1 1 10 C C5' -100.0 -40.0 . 10 . O3' . 11 . P . 11 . O5' . 11 . C5' 1 1
142 . 1 1 10 C O3' 1 1 11 U P 1 1 11 U O5' 1 1 11 U C5' -100.0 -40.0 . 11 . O3' . 12 . P . 12 . O5' . 12 . C5' 1 1
143 . 1 1 11 U O3' 1 1 12 C P 1 1 12 C O5' 1 1 12 C C5' -100.0 -40.0 . 12 . O3' . 13 . P . 13 . O5' . 13 . C5' 1 1
144 . 2 2 1 G O3' 2 2 2 A P 2 2 2 A O5' 2 2 2 A C5' -100.0 -40.0 . 18 . O3' . 19 . P . 19 . O5' . 19 . C5' 1 1
145 . 2 2 2 A O3' 2 2 3 G P 2 2 3 G O5' 2 2 3 G C5' -100.0 -40.0 . 19 . O3' . 20 . P . 20 . O5' . 20 . C5' 1 1
146 . 2 2 3 G O3' 2 2 4 U P 2 2 4 U O5' 2 2 4 U C5' -100.0 -40.0 . 20 . O3' . 21 . P . 21 . O5' . 21 . C5' 1 1
147 . 2 2 5 A O3' 2 2 6 C P 2 2 6 C O5' 2 2 6 C C5' -100.0 -40.0 . 22 . O3' . 23 . P . 23 . O5' . 23 . C5' 1 1
148 . 2 2 6 C O3' 2 2 7 C P 2 2 7 C O5' 2 2 7 C C5' -100.0 -40.0 . 23 . O3' . 24 . P . 24 . O5' . 24 . C5' 1 1
149 . 1 1 1 G C3' 1 1 1 G O3' 1 1 2 G P 1 1 2 G O5' -100.0 -40.0 . 2 . C3' . 2 . O3' . 3 . P . 3 . O5' 1 1
150 . 1 1 2 G C3' 1 1 2 G O3' 1 1 3 U P 1 1 3 U O5' -100.0 -40.0 . 3 . C3' . 3 . O3' . 4 . P . 4 . O5' 1 1
151 . 1 1 9 G C3' 1 1 10 C O3' 1 1 10 C P 1 1 10 C O5' -100.0 -40.0 . 10 . C3' . 11 . O3' . 11 . P . 11 . O5' 1 1
152 . 1 1 10 C C3' 1 1 10 C O3' 1 1 11 U P 1 1 11 U O5' -100.0 -40.0 . 11 . C3' . 11 . O3' . 12 . P . 12 . O5' 1 1
153 . 1 1 11 U C3' 1 1 11 U O3' 1 1 12 C P 1 1 12 C O5' -100.0 -40.0 . 12 . C3' . 12 . O3' . 13 . P . 13 . O5' 1 1
154 . 2 2 1 G C3' 2 2 1 G O3' 2 2 2 A P 2 2 2 A O5' -100.0 -40.0 . 18 . C3' . 18 . O3' . 19 . P . 19 . O5' 1 1
155 . 2 2 2 A C3' 2 2 2 A O3' 2 2 3 G P 2 2 3 G O5' -100.0 -40.0 . 19 . C3' . 19 . O3' . 20 . P . 20 . O5' 1 1
156 . 2 2 3 G C3' 2 2 3 G O3' 2 2 4 U P 2 2 4 U O5' -100.0 -40.0 . 20 . C3' . 20 . O3' . 21 . P . 21 . O5' 1 1
157 . 2 2 5 A C3' 2 2 5 A O3' 2 2 6 C P 2 2 6 C O5' -100.0 -40.0 . 22 . C3' . 22 . O3' . 23 . P . 23 . O5' 1 1
158 . 2 2 6 C C3' 2 2 6 C O3' 2 2 7 C P 2 2 7 C O5' -100.0 -40.0 . 23 . C3' . 23 . O3' . 24 . P . 24 . O5' 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 G C1' C 12.889 2.593 3.646 1.00 . A A . 2 G C1' 1 1
1 2 1 1 1 G C2 C 10.373 6.119 3.504 1.00 . A A . 2 G C2 1 1
1 3 1 1 1 G C2' C 12.455 1.280 4.305 1.00 . A A . 2 G C2' 1 1
1 4 1 1 1 G C3' C 13.322 0.247 3.592 1.00 . A A . 2 G C3' 1 1
1 5 1 1 1 G C4 C 11.179 4.207 2.708 1.00 . A A . 2 G C4 1 1
1 6 1 1 1 G C4' C 14.605 1.013 3.339 1.00 . A A . 2 G C4' 1 1
1 7 1 1 1 G C5 C 10.422 4.244 1.562 1.00 . A A . 2 G C5 1 1
1 8 1 1 1 G C5' C 15.465 0.471 2.200 1.00 . A A . 2 G C5' 1 1
1 9 1 1 1 G C6 C 9.536 5.338 1.347 1.00 . A A . 2 G C6 1 1
1 10 1 1 1 G C8 C 11.572 2.460 1.451 1.00 . A A . 2 G C8 1 1
1 11 1 1 1 G H1 H 8.980 7.044 2.326 1.00 . A A . 2 G H1 1 1
1 12 1 1 1 G H1' H 13.027 3.374 4.394 1.00 . A A . 2 G H1' 1 1
1 13 1 1 1 G H2' H 11.401 1.093 4.117 1.00 . A A . 2 G H2' 1 1
1 14 1 1 1 G H21 H 9.619 7.829 4.292 1.00 . A A . 2 G H21 1 1
1 15 1 1 1 G H22 H 10.856 7.040 5.242 1.00 . A A . 2 G H22 1 1
1 16 1 1 1 G H3' H 12.865 -0.144 2.682 1.00 . A A . 2 G H3' 1 1
1 17 1 1 1 G H4' H 15.207 1.065 4.246 1.00 . A A . 2 G H4' 1 1
1 18 1 1 1 G H5' H 16.361 1.086 2.108 1.00 . A A . 2 G H5' 1 1
1 19 1 1 1 G H5'' H 15.759 -0.552 2.433 1.00 . A A . 2 G H5'' 1 1
1 20 1 1 1 G H8 H 11.985 1.508 1.122 1.00 . A A . 2 G H8 1 1
1 21 1 1 1 G HO2' H 12.222 0.602 6.116 1.00 . A A . 2 G HO2' 1 1
1 22 1 1 1 G HO5' H 14.328 1.338 0.882 1.00 . A A . 2 G HO5' 1 1
1 23 1 1 1 G N1 N 9.581 6.239 2.392 1.00 . A A . 2 G N1 1 1
1 24 1 1 1 G N2 N 10.276 7.074 4.418 1.00 . A A . 2 G N2 1 1
1 25 1 1 1 G N3 N 11.208 5.107 3.720 1.00 . A A . 2 G N3 1 1
1 26 1 1 1 G N7 N 10.681 3.128 0.770 1.00 . A A . 2 G N7 1 1
1 27 1 1 1 G N9 N 11.922 3.055 2.633 1.00 . A A . 2 G N9 1 1
1 28 1 1 1 G O2' O 12.737 1.305 5.709 1.00 . A A . 2 G O2' 1 1
1 29 1 1 1 G O3' O 13.630 -0.795 4.534 1.00 . A A . 2 G O3' 1 1
1 30 1 1 1 G O4' O 14.150 2.326 3.004 1.00 . A A . 2 G O4' 1 1
1 31 1 1 1 G O5' O 14.760 0.483 0.955 1.00 . A A . 2 G O5' 1 1
1 32 1 1 1 G O6 O 8.794 5.552 0.389 1.00 . A A . 2 G O6 1 1
1 33 1 1 2 G C1' C 8.877 0.458 7.642 1.00 . A A . 3 G C1' 1 1
1 34 1 1 2 G C2 C 6.344 3.265 5.479 1.00 . A A . 3 G C2 1 1
1 35 1 1 2 G C2' C 8.418 -0.965 7.921 1.00 . A A . 3 G C2' 1 1
1 36 1 1 2 G C3' C 9.712 -1.773 7.809 1.00 . A A . 3 G C3' 1 1
1 37 1 1 2 G C4 C 7.932 1.716 5.646 1.00 . A A . 3 G C4 1 1
1 38 1 1 2 G C4' C 10.746 -0.812 8.340 1.00 . A A . 3 G C4' 1 1
1 39 1 1 2 G C5 C 8.189 1.690 4.296 1.00 . A A . 3 G C5 1 1
1 40 1 1 2 G C5' C 12.031 -1.022 7.537 1.00 . A A . 3 G C5' 1 1
1 41 1 1 2 G C6 C 7.452 2.540 3.428 1.00 . A A . 3 G C6 1 1
1 42 1 1 2 G C8 C 9.509 0.278 5.168 1.00 . A A . 3 G C8 1 1
1 43 1 1 2 G H1 H 5.966 3.934 3.583 1.00 . A A . 3 G H1 1 1
1 44 1 1 2 G H1' H 8.301 1.178 8.224 1.00 . A A . 3 G H1' 1 1
1 45 1 1 2 G H2' H 7.686 -1.290 7.183 1.00 . A A . 3 G H2' 1 1
1 46 1 1 2 G H21 H 4.832 4.613 5.357 1.00 . A A . 3 G H21 1 1
1 47 1 1 2 G H22 H 5.291 4.133 6.975 1.00 . A A . 3 G H22 1 1
1 48 1 1 2 G H3' H 9.914 -2.104 6.789 1.00 . A A . 3 G H3' 1 1
1 49 1 1 2 G H4' H 10.926 -0.936 9.408 1.00 . A A . 3 G H4' 1 1
1 50 1 1 2 G H5' H 12.727 -0.206 7.735 1.00 . A A . 3 G H5' 1 1
1 51 1 1 2 G H5'' H 12.487 -1.971 7.818 1.00 . A A . 3 G H5'' 1 1
1 52 1 1 2 G H8 H 10.276 -0.483 5.299 1.00 . A A . 3 G H8 1 1
1 53 1 1 2 G HO2' H 8.203 -1.888 9.619 1.00 . A A . 3 G HO2' 1 1
1 54 1 1 2 G N1 N 6.536 3.304 4.123 1.00 . A A . 3 G N1 1 1
1 55 1 1 2 G N2 N 5.416 4.070 5.977 1.00 . A A . 3 G N2 1 1
1 56 1 1 2 G N3 N 7.026 2.477 6.309 1.00 . A A . 3 G N3 1 1
1 57 1 1 2 G N7 N 9.192 0.774 4.006 1.00 . A A . 3 G N7 1 1
1 58 1 1 2 G N9 N 8.789 0.799 6.208 1.00 . A A . 3 G N9 1 1
1 59 1 1 2 G O2' O 7.886 -1.062 9.248 1.00 . A A . 3 G O2' 1 1
1 60 1 1 2 G O3' O 9.491 -2.881 8.695 1.00 . A A . 3 G O3' 1 1
1 61 1 1 2 G O4' O 10.250 0.503 8.049 1.00 . A A . 3 G O4' 1 1
1 62 1 1 2 G O5' O 11.684 -1.046 6.125 1.00 . A A . 3 G O5' 1 1
1 63 1 1 2 G O6 O 7.544 2.653 2.209 1.00 . A A . 3 G O6 1 1
1 64 1 1 2 G OP1 O 13.202 -2.996 5.659 1.00 . A A . 3 G OP1 1 1
1 65 1 1 2 G OP2 O 11.607 -2.119 3.857 1.00 . A A . 3 G OP2 1 1
1 66 1 1 2 G P P 12.514 -1.865 4.998 1.00 . A A . 3 G P 1 1
1 67 1 1 3 U C1' C 5.576 -1.347 5.442 1.00 . A A . 4 U C1' 1 1
1 68 1 1 3 U C2 C 6.624 -0.829 3.296 1.00 . A A . 4 U C2 1 1
1 69 1 1 3 U C2' C 4.404 -2.304 5.237 1.00 . A A . 4 U C2' 1 1
1 70 1 1 3 U C3' C 4.832 -3.476 6.108 1.00 . A A . 4 U C3' 1 1
1 71 1 1 3 U C4 C 8.664 -1.974 2.551 1.00 . A A . 4 U C4 1 1
1 72 1 1 3 U C4' C 5.409 -2.768 7.323 1.00 . A A . 4 U C4' 1 1
1 73 1 1 3 U C5 C 8.639 -2.710 3.793 1.00 . A A . 4 U C5 1 1
1 74 1 1 3 U C5' C 6.409 -3.581 8.144 1.00 . A A . 4 U C5' 1 1
1 75 1 1 3 U C6 C 7.651 -2.487 4.694 1.00 . A A . 4 U C6 1 1
1 76 1 1 3 U H1' H 5.248 -0.308 5.394 1.00 . A A . 4 U H1' 1 1
1 77 1 1 3 U H2' H 4.310 -2.597 4.190 1.00 . A A . 4 U H2' 1 1
1 78 1 1 3 U H3 H 7.624 -0.535 1.542 1.00 . A A . 4 U H3 1 1
1 79 1 1 3 U H3' H 5.542 -4.143 5.616 1.00 . A A . 4 U H3' 1 1
1 80 1 1 3 U H4' H 4.610 -2.422 7.979 1.00 . A A . 4 U H4' 1 1
1 81 1 1 3 U H5 H 9.415 -3.445 4.006 1.00 . A A . 4 U H5 1 1
1 82 1 1 3 U H5' H 6.698 -3.003 9.022 1.00 . A A . 4 U H5' 1 1
1 83 1 1 3 U H5'' H 5.933 -4.507 8.469 1.00 . A A . 4 U H5'' 1 1
1 84 1 1 3 U H6 H 7.647 -3.050 5.628 1.00 . A A . 4 U H6 1 1
1 85 1 1 3 U HO2' H 3.278 -1.642 6.679 1.00 . A A . 4 U HO2' 1 1
1 86 1 1 3 U N1 N 6.659 -1.569 4.461 1.00 . A A . 4 U N1 1 1
1 87 1 1 3 U N3 N 7.635 -1.071 2.395 1.00 . A A . 4 U N3 1 1
1 88 1 1 3 U O2 O 5.752 0.001 3.067 1.00 . A A . 4 U O2 1 1
1 89 1 1 3 U O2' O 3.191 -1.724 5.727 1.00 . A A . 4 U O2' 1 1
1 90 1 1 3 U O3' O 3.644 -4.163 6.528 1.00 . A A . 4 U O3' 1 1
1 91 1 1 3 U O4 O 9.502 -2.103 1.665 1.00 . A A . 4 U O4 1 1
1 92 1 1 3 U O4' O 6.079 -1.631 6.761 1.00 . A A . 4 U O4' 1 1
1 93 1 1 3 U O5' O 7.587 -3.901 7.387 1.00 . A A . 4 U O5' 1 1
1 94 1 1 3 U OP1 O 8.646 -5.170 9.277 1.00 . A A . 4 U OP1 1 1
1 95 1 1 3 U OP2 O 9.923 -4.761 7.094 1.00 . A A . 4 U OP2 1 1
1 96 1 1 3 U P P 8.968 -4.299 8.125 1.00 . A A . 4 U P 1 1
1 97 1 1 4 A C1' C 1.659 -1.292 1.181 1.00 . A A . 5 A C1' 1 1
1 98 1 1 4 A C2 C 2.291 0.509 -2.710 1.00 . A A . 5 A C2 1 1
1 99 1 1 4 A C2' C 0.354 -1.856 0.621 1.00 . A A . 5 A C2' 1 1
1 100 1 1 4 A C3' C 0.273 -3.225 1.288 1.00 . A A . 5 A C3' 1 1
1 101 1 1 4 A C4 C 2.833 -0.749 -0.996 1.00 . A A . 5 A C4 1 1
1 102 1 1 4 A C4' C 0.906 -2.975 2.642 1.00 . A A . 5 A C4' 1 1
1 103 1 1 4 A C5 C 4.034 -1.097 -1.543 1.00 . A A . 5 A C5 1 1
1 104 1 1 4 A C5' C 1.461 -4.220 3.331 1.00 . A A . 5 A C5' 1 1
1 105 1 1 4 A C6 C 4.330 -0.550 -2.802 1.00 . A A . 5 A C6 1 1
1 106 1 1 4 A C8 C 3.930 -2.096 0.327 1.00 . A A . 5 A C8 1 1
1 107 1 1 4 A H1' H 1.534 -0.254 1.473 1.00 . A A . 5 A H1' 1 1
1 108 1 1 4 A H2 H 1.593 1.173 -3.219 1.00 . A A . 5 A H2 1 1
1 109 1 1 4 A H2' H 0.419 -1.949 -0.460 1.00 . A A . 5 A H2' 1 1
1 110 1 1 4 A H3' H 0.765 -4.013 0.718 1.00 . A A . 5 A H3' 1 1
1 111 1 1 4 A H4' H 0.202 -2.481 3.312 1.00 . A A . 5 A H4' 1 1
1 112 1 1 4 A H5' H 0.654 -4.939 3.468 1.00 . A A . 5 A H5' 1 1
1 113 1 1 4 A H5'' H 2.229 -4.664 2.696 1.00 . A A . 5 A H5'' 1 1
1 114 1 1 4 A H61 H 5.605 -0.381 -4.374 1.00 . A A . 5 A H61 1 1
1 115 1 1 4 A H62 H 6.179 -1.358 -3.042 1.00 . A A . 5 A H62 1 1
1 116 1 1 4 A H8 H 4.156 -2.728 1.181 1.00 . A A . 5 A H8 1 1
1 117 1 1 4 A HO2' H -1.504 -1.627 1.145 1.00 . A A . 5 A HO2' 1 1
1 118 1 1 4 A N1 N 3.421 0.260 -3.362 1.00 . A A . 5 A N1 1 1
1 119 1 1 4 A N3 N 1.895 0.062 -1.529 1.00 . A A . 5 A N3 1 1
1 120 1 1 4 A N6 N 5.462 -0.782 -3.459 1.00 . A A . 5 A N6 1 1
1 121 1 1 4 A N7 N 4.730 -1.955 -0.696 1.00 . A A . 5 A N7 1 1
1 122 1 1 4 A N9 N 2.766 -1.392 0.215 1.00 . A A . 5 A N9 1 1
1 123 1 1 4 A O2' O -0.757 -1.039 1.007 1.00 . A A . 5 A O2' 1 1
1 124 1 1 4 A O3' O -1.116 -3.504 1.517 1.00 . A A . 5 A O3' 1 1
1 125 1 1 4 A O4' O 1.977 -2.078 2.345 1.00 . A A . 5 A O4' 1 1
1 126 1 1 4 A O5' O 2.033 -3.907 4.607 1.00 . A A . 5 A O5' 1 1
1 127 1 1 4 A OP1 O 1.758 -5.791 6.239 1.00 . A A . 5 A OP1 1 1
1 128 1 1 4 A OP2 O 3.725 -5.760 4.596 1.00 . A A . 5 A OP2 1 1
1 129 1 1 4 A P P 2.782 -5.037 5.480 1.00 . A A . 5 A P 1 1
1 130 1 1 5 A C1' C 0.528 -3.077 -3.804 1.00 . A A . 6 A C1' 1 1
1 131 1 1 5 A C2 C 4.256 -2.591 -5.972 1.00 . A A . 6 A C2 1 1
1 132 1 1 5 A C2' C -0.223 -4.262 -4.393 1.00 . A A . 6 A C2' 1 1
1 133 1 1 5 A C3' C -1.614 -4.174 -3.737 1.00 . A A . 6 A C3' 1 1
1 134 1 1 5 A C4 C 3.012 -3.216 -4.276 1.00 . A A . 6 A C4 1 1
1 135 1 1 5 A C4' C -1.536 -2.996 -2.768 1.00 . A A . 6 A C4' 1 1
1 136 1 1 5 A C5 C 4.077 -3.731 -3.595 1.00 . A A . 6 A C5 1 1
1 137 1 1 5 A C5' C -2.169 -3.260 -1.407 1.00 . A A . 6 A C5' 1 1
1 138 1 1 5 A C6 C 5.328 -3.631 -4.224 1.00 . A A . 6 A C6 1 1
1 139 1 1 5 A C8 C 2.383 -4.054 -2.359 1.00 . A A . 6 A C8 1 1
1 140 1 1 5 A H1' H 0.502 -2.221 -4.471 1.00 . A A . 6 A H1' 1 1
1 141 1 1 5 A H2 H 4.363 -2.127 -6.953 1.00 . A A . 6 A H2 1 1
1 142 1 1 5 A H2' H 0.269 -5.193 -4.118 1.00 . A A . 6 A H2' 1 1
1 143 1 1 5 A H3' H -1.901 -5.102 -3.244 1.00 . A A . 6 A H3' 1 1
1 144 1 1 5 A H4' H -1.989 -2.106 -3.207 1.00 . A A . 6 A H4' 1 1
1 145 1 1 5 A H5' H -2.016 -2.390 -0.767 1.00 . A A . 6 A H5' 1 1
1 146 1 1 5 A H5'' H -3.239 -3.424 -1.537 1.00 . A A . 6 A H5'' 1 1
1 147 1 1 5 A H61 H 7.327 -3.996 -4.200 1.00 . A A . 6 A H61 1 1
1 148 1 1 5 A H62 H 6.450 -4.510 -2.775 1.00 . A A . 6 A H62 1 1
1 149 1 1 5 A H8 H 1.733 -4.354 -1.537 1.00 . A A . 6 A H8 1 1
1 150 1 1 5 A HO2' H -0.722 -4.941 -6.151 1.00 . A A . 6 A HO2' 1 1
1 151 1 1 5 A N1 N 5.379 -3.047 -5.429 1.00 . A A . 6 A N1 1 1
1 152 1 1 5 A N3 N 3.024 -2.621 -5.488 1.00 . A A . 6 A N3 1 1
1 153 1 1 5 A N6 N 6.460 -4.082 -3.690 1.00 . A A . 6 A N6 1 1
1 154 1 1 5 A N7 N 3.671 -4.263 -2.374 1.00 . A A . 6 A N7 1 1
1 155 1 1 5 A N9 N 1.916 -3.426 -3.478 1.00 . A A . 6 A N9 1 1
1 156 1 1 5 A O2' O -0.317 -4.133 -5.816 1.00 . A A . 6 A O2' 1 1
1 157 1 1 5 A O3' O -2.553 -3.804 -4.759 1.00 . A A . 6 A O3' 1 1
1 158 1 1 5 A O4' O -0.146 -2.773 -2.592 1.00 . A A . 6 A O4' 1 1
1 159 1 1 5 A O5' O -1.591 -4.414 -0.781 1.00 . A A . 6 A O5' 1 1
1 160 1 1 5 A OP1 O -3.301 -4.635 1.036 1.00 . A A . 6 A OP1 1 1
1 161 1 1 5 A OP2 O -1.121 -5.980 1.115 1.00 . A A . 6 A OP2 1 1
1 162 1 1 5 A P P -1.847 -4.735 0.776 1.00 . A A . 6 A P 1 1
1 163 1 1 6 U C1' C 1.103 -7.999 -5.170 1.00 . A A . 7 U C1' 1 1
1 164 1 1 6 U C2 C 2.488 -7.958 -3.152 1.00 . A A . 7 U C2 1 1
1 165 1 1 6 U C2' C 0.254 -9.235 -5.436 1.00 . A A . 7 U C2' 1 1
1 166 1 1 6 U C3' C -0.260 -8.927 -6.832 1.00 . A A . 7 U C3' 1 1
1 167 1 1 6 U C4 C 1.561 -7.290 -0.977 1.00 . A A . 7 U C4 1 1
1 168 1 1 6 U C4' C -0.533 -7.427 -6.774 1.00 . A A . 7 U C4' 1 1
1 169 1 1 6 U C5 C 0.301 -7.063 -1.646 1.00 . A A . 7 U C5 1 1
1 170 1 1 6 U C5' C -1.955 -7.051 -6.375 1.00 . A A . 7 U C5' 1 1
1 171 1 1 6 U C6 C 0.192 -7.278 -2.979 1.00 . A A . 7 U C6 1 1
1 172 1 1 6 U H1' H 2.087 -8.088 -5.633 1.00 . A A . 7 U H1' 1 1
1 173 1 1 6 U H2' H -0.568 -9.311 -4.724 1.00 . A A . 7 U H2' 1 1
1 174 1 1 6 U H3 H 3.473 -7.893 -1.366 1.00 . A A . 7 U H3 1 1
1 175 1 1 6 U H3' H -1.136 -9.515 -7.113 1.00 . A A . 7 U H3' 1 1
1 176 1 1 6 U H4' H -0.302 -6.961 -7.732 1.00 . A A . 7 U H4' 1 1
1 177 1 1 6 U H5 H -0.567 -6.740 -1.075 1.00 . A A . 7 U H5 1 1
1 178 1 1 6 U H5' H -2.655 -7.536 -7.056 1.00 . A A . 7 U H5' 1 1
1 179 1 1 6 U H5'' H -2.145 -7.401 -5.360 1.00 . A A . 7 U H5'' 1 1
1 180 1 1 6 U H6 H -0.756 -7.066 -3.475 1.00 . A A . 7 U H6 1 1
1 181 1 1 6 U HO2' H 1.807 -10.254 -6.014 1.00 . A A . 7 U HO2' 1 1
1 182 1 1 6 U N1 N 1.252 -7.721 -3.726 1.00 . A A . 7 U N1 1 1
1 183 1 1 6 U N3 N 2.578 -7.727 -1.798 1.00 . A A . 7 U N3 1 1
1 184 1 1 6 U O2 O 3.455 -8.350 -3.797 1.00 . A A . 7 U O2 1 1
1 185 1 1 6 U O2' O 1.059 -10.419 -5.436 1.00 . A A . 7 U O2' 1 1
1 186 1 1 6 U O3' O 0.827 -9.123 -7.747 1.00 . A A . 7 U O3' 1 1
1 187 1 1 6 U O4 O 1.771 -7.123 0.219 1.00 . A A . 7 U O4 1 1
1 188 1 1 6 U O4' O 0.380 -6.923 -5.781 1.00 . A A . 7 U O4' 1 1
1 189 1 1 6 U O5' O -2.153 -5.635 -6.430 1.00 . A A . 7 U O5' 1 1
1 190 1 1 6 U OP1 O -4.230 -4.242 -6.569 1.00 . A A . 7 U OP1 1 1
1 191 1 1 6 U OP2 O -3.902 -5.913 -4.653 1.00 . A A . 7 U OP2 1 1
1 192 1 1 6 U P P -3.341 -4.927 -5.604 1.00 . A A . 7 U P 1 1
1 193 1 1 7 A C1' C -1.706 -7.777 -12.111 1.00 . A A . 8 A C1' 1 1
1 194 1 1 7 A C2 C -3.819 -4.006 -12.422 1.00 . A A . 8 A C2 1 1
1 195 1 1 7 A C2' C -0.192 -7.900 -11.995 1.00 . A A . 8 A C2' 1 1
1 196 1 1 7 A C3' C 0.013 -9.231 -12.704 1.00 . A A . 8 A C3' 1 1
1 197 1 1 7 A C4 C -2.946 -5.706 -11.343 1.00 . A A . 8 A C4 1 1
1 198 1 1 7 A C4' C -1.135 -10.068 -12.142 1.00 . A A . 8 A C4' 1 1
1 199 1 1 7 A C5 C -3.335 -5.223 -10.128 1.00 . A A . 8 A C5 1 1
1 200 1 1 7 A C5' C -0.811 -10.816 -10.850 1.00 . A A . 8 A C5' 1 1
1 201 1 1 7 A C6 C -4.033 -4.003 -10.133 1.00 . A A . 8 A C6 1 1
1 202 1 1 7 A C8 C -2.327 -7.047 -9.731 1.00 . A A . 8 A C8 1 1
1 203 1 1 7 A H1' H -1.999 -7.441 -13.106 1.00 . A A . 8 A H1' 1 1
1 204 1 1 7 A H2 H -4.034 -3.479 -13.352 1.00 . A A . 8 A H2 1 1
1 205 1 1 7 A H2' H 0.119 -7.961 -10.952 1.00 . A A . 8 A H2' 1 1
1 206 1 1 7 A H3' H 0.996 -9.671 -12.536 1.00 . A A . 8 A H3' 1 1
1 207 1 1 7 A H4' H -1.481 -10.786 -12.886 1.00 . A A . 8 A H4' 1 1
1 208 1 1 7 A H5' H -1.702 -11.348 -10.516 1.00 . A A . 8 A H5' 1 1
1 209 1 1 7 A H5'' H -0.019 -11.540 -11.049 1.00 . A A . 8 A H5'' 1 1
1 210 1 1 7 A H61 H -4.969 -2.524 -9.104 1.00 . A A . 8 A H61 1 1
1 211 1 1 7 A H62 H -4.321 -3.824 -8.127 1.00 . A A . 8 A H62 1 1
1 212 1 1 7 A H8 H -1.885 -7.903 -9.220 1.00 . A A . 8 A H8 1 1
1 213 1 1 7 A HO2' H -0.129 -6.491 -13.343 1.00 . A A . 8 A HO2' 1 1
1 214 1 1 7 A N1 N -4.259 -3.417 -11.317 1.00 . A A . 8 A N1 1 1
1 215 1 1 7 A N3 N -3.155 -5.144 -12.553 1.00 . A A . 8 A N3 1 1
1 216 1 1 7 A N6 N -4.477 -3.402 -9.034 1.00 . A A . 8 A N6 1 1
1 217 1 1 7 A N7 N -2.940 -6.079 -9.106 1.00 . A A . 8 A N7 1 1
1 218 1 1 7 A N9 N -2.293 -6.887 -11.092 1.00 . A A . 8 A N9 1 1
1 219 1 1 7 A O2' O 0.477 -6.836 -12.679 1.00 . A A . 8 A O2' 1 1
1 220 1 1 7 A O3' O -0.263 -9.041 -14.103 1.00 . A A . 8 A O3' 1 1
1 221 1 1 7 A O4' O -2.186 -9.114 -11.893 1.00 . A A . 8 A O4' 1 1
1 222 1 1 7 A O5' O -0.381 -9.925 -9.809 1.00 . A A . 8 A O5' 1 1
1 223 1 1 7 A OP1 O 0.398 -11.571 -8.085 1.00 . A A . 8 A OP1 1 1
1 224 1 1 7 A OP2 O 2.081 -10.320 -9.556 1.00 . A A . 8 A OP2 1 1
1 225 1 1 7 A P P 0.807 -10.343 -8.802 1.00 . A A . 8 A P 1 1
1 226 1 1 8 A C1' C -0.469 -3.357 -13.183 1.00 . A A . 9 A C1' 1 1
1 227 1 1 8 A C2 C -2.395 -0.805 -10.274 1.00 . A A . 9 A C2 1 1
1 228 1 1 8 A C2' C 0.700 -2.512 -13.641 1.00 . A A . 9 A C2' 1 1
1 229 1 1 8 A C3' C 1.242 -3.262 -14.869 1.00 . A A . 9 A C3' 1 1
1 230 1 1 8 A C4 C -1.174 -2.511 -10.913 1.00 . A A . 9 A C4 1 1
1 231 1 1 8 A C4' C 0.377 -4.519 -14.978 1.00 . A A . 9 A C4' 1 1
1 232 1 1 8 A C5 C -0.915 -2.902 -9.632 1.00 . A A . 9 A C5 1 1
1 233 1 1 8 A C5' C 1.142 -5.793 -15.321 1.00 . A A . 9 A C5' 1 1
1 234 1 1 8 A C6 C -1.490 -2.121 -8.614 1.00 . A A . 9 A C6 1 1
1 235 1 1 8 A C8 C 0.099 -4.283 -10.887 1.00 . A A . 9 A C8 1 1
1 236 1 1 8 A H1' H -1.414 -2.989 -13.584 1.00 . A A . 9 A H1' 1 1
1 237 1 1 8 A H2 H -2.987 0.082 -10.509 1.00 . A A . 9 A H2 1 1
1 238 1 1 8 A H2' H 1.458 -2.468 -12.857 1.00 . A A . 9 A H2' 1 1
1 239 1 1 8 A H3' H 2.302 -3.492 -14.777 1.00 . A A . 9 A H3' 1 1
1 240 1 1 8 A H4' H -0.419 -4.374 -15.709 1.00 . A A . 9 A H4' 1 1
1 241 1 1 8 A H5' H 1.618 -5.672 -16.294 1.00 . A A . 9 A H5' 1 1
1 242 1 1 8 A H5'' H 1.912 -5.959 -14.566 1.00 . A A . 9 A H5'' 1 1
1 243 1 1 8 A H61 H -1.790 -1.778 -6.634 1.00 . A A . 9 A H61 1 1
1 244 1 1 8 A H62 H -0.774 -3.152 -7.011 1.00 . A A . 9 A H62 1 1
1 245 1 1 8 A H8 H 0.751 -5.076 -11.255 1.00 . A A . 9 A H8 1 1
1 246 1 1 8 A HO2' H 1.012 -0.657 -14.130 1.00 . A A . 9 A HO2' 1 1
1 247 1 1 8 A N1 N -2.235 -1.064 -8.981 1.00 . A A . 9 A N1 1 1
1 248 1 1 8 A N3 N -1.916 -1.460 -11.318 1.00 . A A . 9 A N3 1 1
1 249 1 1 8 A N6 N -1.340 -2.369 -7.316 1.00 . A A . 9 A N6 1 1
1 250 1 1 8 A N7 N -0.104 -4.036 -9.620 1.00 . A A . 9 A N7 1 1
1 251 1 1 8 A N9 N -0.522 -3.404 -11.721 1.00 . A A . 9 A N9 1 1
1 252 1 1 8 A O2' O 0.236 -1.208 -13.986 1.00 . A A . 9 A O2' 1 1
1 253 1 1 8 A O3' O 0.961 -2.468 -16.038 1.00 . A A . 9 A O3' 1 1
1 254 1 1 8 A O4' O -0.197 -4.655 -13.686 1.00 . A A . 9 A O4' 1 1
1 255 1 1 8 A O5' O 0.274 -6.932 -15.363 1.00 . A A . 9 A O5' 1 1
1 256 1 1 8 A OP1 O 0.772 -9.166 -16.384 1.00 . A A . 9 A OP1 1 1
1 257 1 1 8 A OP2 O 2.129 -8.319 -14.382 1.00 . A A . 9 A OP2 1 1
1 258 1 1 8 A P P 0.840 -8.421 -15.106 1.00 . A A . 9 A P 1 1
1 259 1 1 9 G C1' C -0.072 2.158 -12.985 1.00 . A A . 10 G C1' 1 1
1 260 1 1 9 G C2 C 2.909 3.322 -10.069 1.00 . A A . 10 G C2 1 1
1 261 1 1 9 G C2' C 0.869 2.853 -13.951 1.00 . A A . 10 G C2' 1 1
1 262 1 1 9 G C3' C 0.887 1.890 -15.134 1.00 . A A . 10 G C3' 1 1
1 263 1 1 9 G C4 C 1.624 1.851 -11.134 1.00 . A A . 10 G C4 1 1
1 264 1 1 9 G C4' C -0.554 1.496 -15.198 1.00 . A A . 10 G C4' 1 1
1 265 1 1 9 G C5 C 2.120 0.767 -10.453 1.00 . A A . 10 G C5 1 1
1 266 1 1 9 G C5' C -0.733 0.167 -15.941 1.00 . A A . 10 G C5' 1 1
1 267 1 1 9 G C6 C 3.126 0.965 -9.464 1.00 . A A . 10 G C6 1 1
1 268 1 1 9 G C8 C 0.669 0.012 -11.808 1.00 . A A . 10 G C8 1 1
1 269 1 1 9 G H1 H 4.173 2.535 -8.664 1.00 . A A . 10 G H1 1 1
1 270 1 1 9 G H1' H -0.696 2.875 -12.452 1.00 . A A . 10 G H1' 1 1
1 271 1 1 9 G H2' H 1.857 2.952 -13.513 1.00 . A A . 10 G H2' 1 1
1 272 1 1 9 G H21 H 4.078 4.693 -9.137 1.00 . A A . 10 G H21 1 1
1 273 1 1 9 G H22 H 2.980 5.328 -10.340 1.00 . A A . 10 G H22 1 1
1 274 1 1 9 G H3' H 1.566 1.051 -14.988 1.00 . A A . 10 G H3' 1 1
1 275 1 1 9 G H4' H -1.170 2.273 -15.652 1.00 . A A . 10 G H4' 1 1
1 276 1 1 9 G H5' H -0.834 -0.635 -15.210 1.00 . A A . 10 G H5' 1 1
1 277 1 1 9 G H5'' H -1.638 0.214 -16.546 1.00 . A A . 10 G H5'' 1 1
1 278 1 1 9 G H8 H 0.029 -0.651 -12.374 1.00 . A A . 10 G H8 1 1
1 279 1 1 9 G HO2' H 0.268 4.119 -15.299 1.00 . A A . 10 G HO2' 1 1
1 280 1 1 9 G N1 N 3.462 2.301 -9.341 1.00 . A A . 10 G N1 1 1
1 281 1 1 9 G N2 N 3.358 4.545 -9.828 1.00 . A A . 10 G N2 1 1
1 282 1 1 9 G N3 N 1.970 3.153 -10.996 1.00 . A A . 10 G N3 1 1
1 283 1 1 9 G N7 N 1.502 -0.401 -10.890 1.00 . A A . 10 G N7 1 1
1 284 1 1 9 G N9 N 0.689 1.355 -12.010 1.00 . A A . 10 G N9 1 1
1 285 1 1 9 G O2' O 0.333 4.122 -14.340 1.00 . A A . 10 G O2' 1 1
1 286 1 1 9 G O3' O 1.249 2.694 -16.261 1.00 . A A . 10 G O3' 1 1
1 287 1 1 9 G O4' O -0.909 1.322 -13.811 1.00 . A A . 10 G O4' 1 1
1 288 1 1 9 G O5' O 0.408 -0.121 -16.801 1.00 . A A . 10 G O5' 1 1
1 289 1 1 9 G O6 O 3.700 0.124 -8.772 1.00 . A A . 10 G O6 1 1
1 290 1 1 9 G OP1 O 2.591 -1.200 -17.464 1.00 . A A . 10 G OP1 1 1
1 291 1 1 9 G OP2 O 2.194 -0.503 -15.033 1.00 . A A . 10 G OP2 1 1
1 292 1 1 9 G P P 1.674 -1.039 -16.314 1.00 . A A . 10 G P 1 1
1 293 1 1 10 C C1' C 4.856 5.721 -12.741 1.00 . A A . 11 C C1' 1 1
1 294 1 1 10 C C2 C 5.923 3.923 -11.451 1.00 . A A . 11 C C2 1 1
1 295 1 1 10 C C2' C 5.690 6.309 -13.876 1.00 . A A . 11 C C2' 1 1
1 296 1 1 10 C C3' C 4.777 6.156 -15.098 1.00 . A A . 11 C C3' 1 1
1 297 1 1 10 C C4 C 5.612 1.664 -11.995 1.00 . A A . 11 C C4 1 1
1 298 1 1 10 C C4' C 3.404 6.303 -14.506 1.00 . A A . 11 C C4' 1 1
1 299 1 1 10 C C5 C 4.773 2.019 -13.093 1.00 . A A . 11 C C5 1 1
1 300 1 1 10 C C5' C 2.493 5.321 -15.231 1.00 . A A . 11 C C5' 1 1
1 301 1 1 10 C C6 C 4.551 3.326 -13.315 1.00 . A A . 11 C C6 1 1
1 302 1 1 10 C H1' H 5.027 6.266 -11.812 1.00 . A A . 11 C H1' 1 1
1 303 1 1 10 C H2' H 6.615 5.753 -14.006 1.00 . A A . 11 C H2' 1 1
1 304 1 1 10 C H3' H 4.922 5.207 -15.616 1.00 . A A . 11 C H3' 1 1
1 305 1 1 10 C H4' H 3.021 7.321 -14.580 1.00 . A A . 11 C H4' 1 1
1 306 1 1 10 C H41 H 6.540 0.167 -10.980 1.00 . A A . 11 C H41 1 1
1 307 1 1 10 C H42 H 5.435 -0.345 -12.238 1.00 . A A . 11 C H42 1 1
1 308 1 1 10 C H5 H 4.323 1.262 -13.736 1.00 . A A . 11 C H5 1 1
1 309 1 1 10 C H5' H 1.583 5.170 -14.650 1.00 . A A . 11 C H5' 1 1
1 310 1 1 10 C H5'' H 2.236 5.721 -16.212 1.00 . A A . 11 C H5'' 1 1
1 311 1 1 10 C H6 H 3.916 3.629 -14.146 1.00 . A A . 11 C H6 1 1
1 312 1 1 10 C HO2' H 5.931 8.147 -14.463 1.00 . A A . 11 C HO2' 1 1
1 313 1 1 10 C N1 N 5.111 4.277 -12.514 1.00 . A A . 11 C N1 1 1
1 314 1 1 10 C N3 N 6.156 2.603 -11.215 1.00 . A A . 11 C N3 1 1
1 315 1 1 10 C N4 N 5.883 0.394 -11.716 1.00 . A A . 11 C N4 1 1
1 316 1 1 10 C O2 O 6.424 4.787 -10.739 1.00 . A A . 11 C O2 1 1
1 317 1 1 10 C O2' O 5.958 7.691 -13.619 1.00 . A A . 11 C O2' 1 1
1 318 1 1 10 C O3' O 5.111 7.277 -15.940 1.00 . A A . 11 C O3' 1 1
1 319 1 1 10 C O4' O 3.497 5.886 -13.138 1.00 . A A . 11 C O4' 1 1
1 320 1 1 10 C O5' O 3.196 4.048 -15.394 1.00 . A A . 11 C O5' 1 1
1 321 1 1 10 C OP1 O 2.916 3.680 -17.862 1.00 . A A . 11 C OP1 1 1
1 322 1 1 10 C OP2 O 3.579 1.747 -16.315 1.00 . A A . 11 C OP2 1 1
1 323 1 1 10 C P P 2.813 2.991 -16.556 1.00 . A A . 11 C P 1 1
1 324 1 1 11 U C1' C 10.713 7.220 -14.091 1.00 . A A . 12 U C1' 1 1
1 325 1 1 11 U C2 C 10.942 4.974 -13.156 1.00 . A A . 12 U C2 1 1
1 326 1 1 11 U C2' C 11.313 7.481 -15.463 1.00 . A A . 12 U C2' 1 1
1 327 1 1 11 U C3' C 10.215 8.237 -16.219 1.00 . A A . 12 U C3' 1 1
1 328 1 1 11 U C4 C 9.341 3.191 -13.686 1.00 . A A . 12 U C4 1 1
1 329 1 1 11 U C4' C 9.468 8.947 -15.119 1.00 . A A . 12 U C4' 1 1
1 330 1 1 11 U C5 C 8.634 4.145 -14.504 1.00 . A A . 12 U C5 1 1
1 331 1 1 11 U C5' C 7.982 8.937 -15.479 1.00 . A A . 12 U C5' 1 1
1 332 1 1 11 U C6 C 9.087 5.418 -14.609 1.00 . A A . 12 U C6 1 1
1 333 1 1 11 U H1' H 11.452 7.408 -13.310 1.00 . A A . 12 U H1' 1 1
1 334 1 1 11 U H2' H 11.540 6.542 -15.960 1.00 . A A . 12 U H2' 1 1
1 335 1 1 11 U H3 H 10.995 3.048 -12.488 1.00 . A A . 12 U H3 1 1
1 336 1 1 11 U H3' H 9.584 7.581 -16.817 1.00 . A A . 12 U H3' 1 1
1 337 1 1 11 U H4' H 9.826 9.964 -14.956 1.00 . A A . 12 U H4' 1 1
1 338 1 1 11 U H5 H 7.741 3.837 -15.048 1.00 . A A . 12 U H5 1 1
1 339 1 1 11 U H5' H 7.392 9.249 -14.617 1.00 . A A . 12 U H5' 1 1
1 340 1 1 11 U H5'' H 7.803 9.617 -16.312 1.00 . A A . 12 U H5'' 1 1
1 341 1 1 11 U H6 H 8.544 6.124 -15.230 1.00 . A A . 12 U H6 1 1
1 342 1 1 11 U HO2' H 13.243 7.693 -15.319 1.00 . A A . 12 U HO2' 1 1
1 343 1 1 11 U N1 N 10.214 5.835 -13.955 1.00 . A A . 12 U N1 1 1
1 344 1 1 11 U N3 N 10.466 3.688 -13.063 1.00 . A A . 12 U N3 1 1
1 345 1 1 11 U O2 O 11.958 5.320 -12.565 1.00 . A A . 12 U O2 1 1
1 346 1 1 11 U O2' O 12.487 8.289 -15.331 1.00 . A A . 12 U O2' 1 1
1 347 1 1 11 U O3' O 10.960 9.141 -17.051 1.00 . A A . 12 U O3' 1 1
1 348 1 1 11 U O4 O 9.007 2.025 -13.510 1.00 . A A . 12 U O4 1 1
1 349 1 1 11 U O4' O 9.637 8.147 -13.940 1.00 . A A . 12 U O4' 1 1
1 350 1 1 11 U O5' O 7.616 7.583 -15.866 1.00 . A A . 12 U O5' 1 1
1 351 1 1 11 U OP1 O 6.307 8.322 -17.884 1.00 . A A . 12 U OP1 1 1
1 352 1 1 11 U OP2 O 6.605 5.832 -17.351 1.00 . A A . 12 U OP2 1 1
1 353 1 1 11 U P P 6.415 7.228 -16.894 1.00 . A A . 12 U P 1 1
1 354 1 1 12 C C1' C 14.408 4.927 -15.646 1.00 . A A . 13 C C1' 1 1
1 355 1 1 12 C C2 C 13.081 2.922 -15.149 1.00 . A A . 13 C C2 1 1
1 356 1 1 12 C C2' C 15.522 4.699 -16.673 1.00 . A A . 13 C C2' 1 1
1 357 1 1 12 C C3' C 15.187 5.753 -17.720 1.00 . A A . 13 C C3' 1 1
1 358 1 1 12 C C4 C 11.076 2.467 -16.274 1.00 . A A . 13 C C4 1 1
1 359 1 1 12 C C4' C 14.822 6.922 -16.821 1.00 . A A . 13 C C4' 1 1
1 360 1 1 12 C C5 C 11.210 3.658 -17.052 1.00 . A A . 13 C C5 1 1
1 361 1 1 12 C C5' C 14.021 8.040 -17.491 1.00 . A A . 13 C C5' 1 1
1 362 1 1 12 C C6 C 12.289 4.432 -16.835 1.00 . A A . 13 C C6 1 1
1 363 1 1 12 C H1' H 14.768 4.750 -14.631 1.00 . A A . 13 C H1' 1 1
1 364 1 1 12 C H2' H 15.472 3.694 -17.092 1.00 . A A . 13 C H2' 1 1
1 365 1 1 12 C H3' H 14.339 5.445 -18.332 1.00 . A A . 13 C H3' 1 1
1 366 1 1 12 C H4' H 15.720 7.352 -16.376 1.00 . A A . 13 C H4' 1 1
1 367 1 1 12 C H41 H 9.981 0.795 -15.900 1.00 . A A . 13 C H41 1 1
1 368 1 1 12 C H42 H 9.296 1.901 -17.071 1.00 . A A . 13 C H42 1 1
1 369 1 1 12 C H5 H 10.467 3.939 -17.798 1.00 . A A . 13 C H5 1 1
1 370 1 1 12 C H5' H 13.868 8.844 -16.770 1.00 . A A . 13 C H5' 1 1
1 371 1 1 12 C H5'' H 14.591 8.427 -18.336 1.00 . A A . 13 C H5'' 1 1
1 372 1 1 12 C H6 H 12.421 5.347 -17.413 1.00 . A A . 13 C H6 1 1
1 373 1 1 12 C HO2' H 16.922 4.335 -15.368 1.00 . A A . 13 C HO2' 1 1
1 374 1 1 12 C HO3' H 17.088 6.105 -17.934 1.00 . A A . 13 C HO3' 1 1
1 375 1 1 12 C N1 N 13.219 4.082 -15.899 1.00 . A A . 13 C N1 1 1
1 376 1 1 12 C N3 N 11.994 2.132 -15.361 1.00 . A A . 13 C N3 1 1
1 377 1 1 12 C N4 N 10.034 1.657 -16.428 1.00 . A A . 13 C N4 1 1
1 378 1 1 12 C O2 O 13.929 2.613 -14.317 1.00 . A A . 13 C O2 1 1
1 379 1 1 12 C O2' O 16.806 4.957 -16.091 1.00 . A A . 13 C O2' 1 1
1 380 1 1 12 C O3' O 16.330 6.058 -18.525 1.00 . A A . 13 C O3' 1 1
1 381 1 1 12 C O4' O 14.039 6.312 -15.786 1.00 . A A . 13 C O4' 1 1
1 382 1 1 12 C O5' O 12.743 7.584 -17.959 1.00 . A A . 13 C O5' 1 1
1 383 1 1 12 C OP1 O 12.288 9.785 -19.082 1.00 . A A . 13 C OP1 1 1
1 384 1 1 12 C OP2 O 10.578 7.881 -19.185 1.00 . A A . 13 C OP2 1 1
1 385 1 1 12 C P P 11.612 8.636 -18.441 1.00 . A A . 13 C P 1 1
1 386 2 2 1 G C1' C 13.392 -5.219 -12.926 1.00 . B B . 18 G C1' 1 1
1 387 2 2 1 G C2 C 13.532 -0.991 -13.905 1.00 . B B . 18 G C2 1 1
1 388 2 2 1 G C2' C 13.553 -4.954 -11.433 1.00 . B B . 18 G C2' 1 1
1 389 2 2 1 G C3' C 12.518 -5.901 -10.850 1.00 . B B . 18 G C3' 1 1
1 390 2 2 1 G C4 C 12.559 -2.988 -13.790 1.00 . B B . 18 G C4 1 1
1 391 2 2 1 G C4' C 12.684 -7.128 -11.729 1.00 . B B . 18 G C4' 1 1
1 392 2 2 1 G C5 C 11.372 -2.555 -14.330 1.00 . B B . 18 G C5 1 1
1 393 2 2 1 G C5' C 11.465 -8.047 -11.787 1.00 . B B . 18 G C5' 1 1
1 394 2 2 1 G C6 C 11.233 -1.191 -14.706 1.00 . B B . 18 G C6 1 1
1 395 2 2 1 G C8 C 11.115 -4.624 -13.931 1.00 . B B . 18 G C8 1 1
1 396 2 2 1 G H1 H 12.376 0.505 -14.689 1.00 . B B . 18 G H1 1 1
1 397 2 2 1 G H1' H 14.342 -5.114 -13.450 1.00 . B B . 18 G H1' 1 1
1 398 2 2 1 G H2' H 13.313 -3.921 -11.200 1.00 . B B . 18 G H2' 1 1
1 399 2 2 1 G H21 H 14.446 0.819 -13.980 1.00 . B B . 18 G H21 1 1
1 400 2 2 1 G H22 H 15.402 -0.486 -13.314 1.00 . B B . 18 G H22 1 1
1 401 2 2 1 G H3' H 11.507 -5.493 -10.862 1.00 . B B . 18 G H3' 1 1
1 402 2 2 1 G H4' H 13.552 -7.709 -11.417 1.00 . B B . 18 G H4' 1 1
1 403 2 2 1 G H5' H 11.680 -8.879 -12.458 1.00 . B B . 18 G H5' 1 1
1 404 2 2 1 G H5'' H 11.267 -8.438 -10.788 1.00 . B B . 18 G H5'' 1 1
1 405 2 2 1 G H8 H 10.684 -5.618 -13.836 1.00 . B B . 18 G H8 1 1
1 406 2 2 1 G HO2' H 14.956 -4.994 -10.084 1.00 . B B . 18 G HO2' 1 1
1 407 2 2 1 G HO5' H 10.254 -6.523 -11.782 1.00 . B B . 18 G HO5' 1 1
1 408 2 2 1 G N1 N 12.386 -0.474 -14.452 1.00 . B B . 18 G N1 1 1
1 409 2 2 1 G N2 N 14.541 -0.152 -13.719 1.00 . B B . 18 G N2 1 1
1 410 2 2 1 G N3 N 13.680 -2.265 -13.549 1.00 . B B . 18 G N3 1 1
1 411 2 2 1 G N7 N 10.463 -3.605 -14.415 1.00 . B B . 18 G N7 1 1
1 412 2 2 1 G N9 N 12.389 -4.326 -13.533 1.00 . B B . 18 G N9 1 1
1 413 2 2 1 G O2' O 14.872 -5.296 -10.992 1.00 . B B . 18 G O2' 1 1
1 414 2 2 1 G O3' O 12.943 -6.255 -9.525 1.00 . B B . 18 G O3' 1 1
1 415 2 2 1 G O4' O 12.929 -6.580 -13.031 1.00 . B B . 18 G O4' 1 1
1 416 2 2 1 G O5' O 10.302 -7.356 -12.257 1.00 . B B . 18 G O5' 1 1
1 417 2 2 1 G O6 O 10.258 -0.627 -15.193 1.00 . B B . 18 G O6 1 1
1 418 2 2 2 A C1' C 15.371 -0.974 -8.818 1.00 . B B . 19 A C1' 1 1
1 419 2 2 2 A C2 C 13.359 2.202 -11.019 1.00 . B B . 19 A C2 1 1
1 420 2 2 2 A C2' C 14.979 -0.747 -7.393 1.00 . B B . 19 A C2' 1 1
1 421 2 2 2 A C3' C 14.725 -2.151 -6.858 1.00 . B B . 19 A C3' 1 1
1 422 2 2 2 A C4 C 13.636 0.152 -10.287 1.00 . B B . 19 A C4 1 1
1 423 2 2 2 A C4' C 15.782 -2.951 -7.577 1.00 . B B . 19 A C4' 1 1
1 424 2 2 2 A C5 C 12.484 -0.284 -10.873 1.00 . B B . 19 A C5 1 1
1 425 2 2 2 A C5' C 15.213 -4.342 -7.857 1.00 . B B . 19 A C5' 1 1
1 426 2 2 2 A C6 C 11.747 0.664 -11.593 1.00 . B B . 19 A C6 1 1
1 427 2 2 2 A C8 C 13.309 -1.959 -9.882 1.00 . B B . 19 A C8 1 1
1 428 2 2 2 A H1' H 16.087 -0.228 -9.163 1.00 . B B . 19 A H1' 1 1
1 429 2 2 2 A H2 H 13.665 3.249 -11.052 1.00 . B B . 19 A H2 1 1
1 430 2 2 2 A H2' H 14.070 -0.168 -7.358 1.00 . B B . 19 A H2' 1 1
1 431 2 2 2 A H3' H 13.712 -2.499 -7.063 1.00 . B B . 19 A H3' 1 1
1 432 2 2 2 A H4' H 16.718 -3.010 -7.021 1.00 . B B . 19 A H4' 1 1
1 433 2 2 2 A H5' H 15.865 -4.874 -8.549 1.00 . B B . 19 A H5' 1 1
1 434 2 2 2 A H5'' H 15.135 -4.900 -6.923 1.00 . B B . 19 A H5'' 1 1
1 435 2 2 2 A H61 H 10.149 1.088 -12.771 1.00 . B B . 19 A H61 1 1
1 436 2 2 2 A H62 H 10.214 -0.545 -12.152 1.00 . B B . 19 A H62 1 1
1 437 2 2 2 A H8 H 13.425 -2.918 -9.404 1.00 . B B . 19 A H8 1 1
1 438 2 2 2 A HO2' H 16.134 -0.568 -5.838 1.00 . B B . 19 A HO2' 1 1
1 439 2 2 2 A N1 N 12.220 1.918 -11.647 1.00 . B B . 19 A N1 1 1
1 440 2 2 2 A N3 N 14.148 1.400 -10.319 1.00 . B B . 19 A N3 1 1
1 441 2 2 2 A N6 N 10.613 0.381 -12.223 1.00 . B B . 19 A N6 1 1
1 442 2 2 2 A N7 N 12.283 -1.633 -10.615 1.00 . B B . 19 A N7 1 1
1 443 2 2 2 A N9 N 14.169 -0.944 -9.652 1.00 . B B . 19 A N9 1 1
1 444 2 2 2 A O2' O 16.053 -0.119 -6.683 1.00 . B B . 19 A O2' 1 1
1 445 2 2 2 A O3' O 14.960 -2.004 -5.445 1.00 . B B . 19 A O3' 1 1
1 446 2 2 2 A O4' O 15.968 -2.280 -8.841 1.00 . B B . 19 A O4' 1 1
1 447 2 2 2 A O5' O 13.893 -4.182 -8.442 1.00 . B B . 19 A O5' 1 1
1 448 2 2 2 A OP1 O 12.904 -6.013 -7.030 1.00 . B B . 19 A OP1 1 1
1 449 2 2 2 A OP2 O 11.409 -4.551 -8.509 1.00 . B B . 19 A OP2 1 1
1 450 2 2 2 A P P 12.690 -5.256 -8.284 1.00 . B B . 19 A P 1 1
1 451 2 2 3 G C1' C 12.535 3.063 -7.348 1.00 . B B . 20 G C1' 1 1
1 452 2 2 3 G C2 C 9.390 3.497 -10.232 1.00 . B B . 20 G C2 1 1
1 453 2 2 3 G C2' C 11.955 3.583 -6.038 1.00 . B B . 20 G C2' 1 1
1 454 2 2 3 G C3' C 12.675 2.728 -4.990 1.00 . B B . 20 G C3' 1 1
1 455 2 2 3 G C4 C 10.669 2.321 -8.853 1.00 . B B . 20 G C4 1 1
1 456 2 2 3 G C4' C 14.044 2.617 -5.595 1.00 . B B . 20 G C4' 1 1
1 457 2 2 3 G C5 C 10.024 1.135 -9.088 1.00 . B B . 20 G C5 1 1
1 458 2 2 3 G C5' C 14.703 1.324 -5.117 1.00 . B B . 20 G C5' 1 1
1 459 2 2 3 G C6 C 8.932 1.108 -10.000 1.00 . B B . 20 G C6 1 1
1 460 2 2 3 G C8 C 11.557 0.705 -7.682 1.00 . B B . 20 G C8 1 1
1 461 2 2 3 G H1 H 7.926 2.435 -11.188 1.00 . B B . 20 G H1 1 1
1 462 2 2 3 G H1' H 12.686 3.871 -8.071 1.00 . B B . 20 G H1' 1 1
1 463 2 2 3 G H2' H 10.877 3.423 -6.000 1.00 . B B . 20 G H2' 1 1
1 464 2 2 3 G H21 H 8.196 4.634 -11.413 1.00 . B B . 20 G H21 1 1
1 465 2 2 3 G H22 H 9.557 5.462 -10.694 1.00 . B B . 20 G H22 1 1
1 466 2 2 3 G H3' H 12.191 1.764 -4.822 1.00 . B B . 20 G H3' 1 1
1 467 2 2 3 G H4' H 14.670 3.482 -5.374 1.00 . B B . 20 G H4' 1 1
1 468 2 2 3 G H5' H 15.606 1.138 -5.698 1.00 . B B . 20 G H5' 1 1
1 469 2 2 3 G H5'' H 14.961 1.417 -4.062 1.00 . B B . 20 G H5'' 1 1
1 470 2 2 3 G H8 H 12.200 0.189 -6.972 1.00 . B B . 20 G H8 1 1
1 471 2 2 3 G HO2' H 11.684 5.468 -6.439 1.00 . B B . 20 G HO2' 1 1
1 472 2 2 3 G N1 N 8.685 2.360 -10.532 1.00 . B B . 20 G N1 1 1
1 473 2 2 3 G N2 N 9.018 4.619 -10.830 1.00 . B B . 20 G N2 1 1
1 474 2 2 3 G N3 N 10.409 3.536 -9.387 1.00 . B B . 20 G N3 1 1
1 475 2 2 3 G N7 N 10.598 0.111 -8.339 1.00 . B B . 20 G N7 1 1
1 476 2 2 3 G N9 N 11.654 2.047 -7.947 1.00 . B B . 20 G N9 1 1
1 477 2 2 3 G O2' O 12.276 4.970 -5.870 1.00 . B B . 20 G O2' 1 1
1 478 2 2 3 G O3' O 12.667 3.551 -3.814 1.00 . B B . 20 G O3' 1 1
1 479 2 2 3 G O4' O 13.807 2.501 -7.007 1.00 . B B . 20 G O4' 1 1
1 480 2 2 3 G O5' O 13.769 0.223 -5.292 1.00 . B B . 20 G O5' 1 1
1 481 2 2 3 G O6 O 8.230 0.156 -10.329 1.00 . B B . 20 G O6 1 1
1 482 2 2 3 G OP1 O 14.509 -0.961 -3.197 1.00 . B B . 20 G OP1 1 1
1 483 2 2 3 G OP2 O 12.584 -1.889 -4.614 1.00 . B B . 20 G OP2 1 1
1 484 2 2 3 G P P 13.891 -1.199 -4.520 1.00 . B B . 20 G P 1 1
1 485 2 2 4 U C1' C 7.803 4.129 -6.816 1.00 . B B . 21 U C1' 1 1
1 486 2 2 4 U C2 C 6.577 2.197 -7.682 1.00 . B B . 21 U C2 1 1
1 487 2 2 4 U C2' C 6.720 4.749 -5.922 1.00 . B B . 21 U C2' 1 1
1 488 2 2 4 U C3' C 7.480 5.031 -4.629 1.00 . B B . 21 U C3' 1 1
1 489 2 2 4 U C4 C 7.268 -0.101 -7.158 1.00 . B B . 21 U C4 1 1
1 490 2 2 4 U C4' C 8.866 5.374 -5.137 1.00 . B B . 21 U C4' 1 1
1 491 2 2 4 U C5 C 8.362 0.460 -6.399 1.00 . B B . 21 U C5 1 1
1 492 2 2 4 U C5' C 9.993 5.253 -4.110 1.00 . B B . 21 U C5' 1 1
1 493 2 2 4 U C6 C 8.511 1.803 -6.314 1.00 . B B . 21 U C6 1 1
1 494 2 2 4 U H1' H 7.793 4.579 -7.810 1.00 . B B . 21 U H1' 1 1
1 495 2 2 4 U H2' H 5.903 4.047 -5.752 1.00 . B B . 21 U H2' 1 1
1 496 2 2 4 U H3 H 5.660 0.471 -8.287 1.00 . B B . 21 U H3 1 1
1 497 2 2 4 U H3' H 7.472 4.192 -3.933 1.00 . B B . 21 U H3' 1 1
1 498 2 2 4 U H4' H 8.881 6.376 -5.567 1.00 . B B . 21 U H4' 1 1
1 499 2 2 4 U H5 H 9.071 -0.196 -5.897 1.00 . B B . 21 U H5 1 1
1 500 2 2 4 U H5' H 10.922 5.597 -4.564 1.00 . B B . 21 U H5' 1 1
1 501 2 2 4 U H5'' H 9.761 5.886 -3.254 1.00 . B B . 21 U H5'' 1 1
1 502 2 2 4 U H6 H 9.341 2.209 -5.734 1.00 . B B . 21 U H6 1 1
1 503 2 2 4 U HO2' H 6.494 6.680 -5.905 1.00 . B B . 21 U HO2' 1 1
1 504 2 2 4 U N1 N 7.645 2.664 -6.937 1.00 . B B . 21 U N1 1 1
1 505 2 2 4 U N3 N 6.442 0.828 -7.754 1.00 . B B . 21 U N3 1 1
1 506 2 2 4 U O2 O 5.787 2.946 -8.252 1.00 . B B . 21 U O2 1 1
1 507 2 2 4 U O2' O 6.239 5.968 -6.497 1.00 . B B . 21 U O2' 1 1
1 508 2 2 4 U O3' O 6.915 6.220 -4.052 1.00 . B B . 21 U O3' 1 1
1 509 2 2 4 U O4 O 7.037 -1.297 -7.294 1.00 . B B . 21 U O4 1 1
1 510 2 2 4 U O4' O 9.061 4.414 -6.175 1.00 . B B . 21 U O4' 1 1
1 511 2 2 4 U O5' O 10.166 3.901 -3.660 1.00 . B B . 21 U O5' 1 1
1 512 2 2 4 U OP1 O 11.654 4.528 -1.738 1.00 . B B . 21 U OP1 1 1
1 513 2 2 4 U OP2 O 11.271 2.069 -2.352 1.00 . B B . 21 U OP2 1 1
1 514 2 2 4 U P P 11.443 3.481 -2.763 1.00 . B B . 21 U P 1 1
1 515 2 2 5 A C1' C 1.463 4.464 -2.609 1.00 . B B . 22 A C1' 1 1
1 516 2 2 5 A C2 C 1.819 2.612 1.295 1.00 . B B . 22 A C2 1 1
1 517 2 2 5 A C2' C 1.358 5.833 -1.982 1.00 . B B . 22 A C2' 1 1
1 518 2 2 5 A C3' C 2.333 6.654 -2.819 1.00 . B B . 22 A C3' 1 1
1 519 2 2 5 A C4 C 2.509 3.149 -0.718 1.00 . B B . 22 A C4 1 1
1 520 2 2 5 A C4' C 2.140 6.077 -4.198 1.00 . B B . 22 A C4' 1 1
1 521 2 2 5 A C5 C 3.708 2.524 -0.550 1.00 . B B . 22 A C5 1 1
1 522 2 2 5 A C5' C 3.445 6.125 -4.999 1.00 . B B . 22 A C5' 1 1
1 523 2 2 5 A C6 C 3.919 1.898 0.687 1.00 . B B . 22 A C6 1 1
1 524 2 2 5 A C8 C 3.749 3.346 -2.502 1.00 . B B . 22 A C8 1 1
1 525 2 2 5 A H1' H 0.520 3.921 -2.547 1.00 . B B . 22 A H1' 1 1
1 526 2 2 5 A H2 H 1.068 2.653 2.087 1.00 . B B . 22 A H2 1 1
1 527 2 2 5 A H2' H 1.665 5.803 -0.939 1.00 . B B . 22 A H2' 1 1
1 528 2 2 5 A H3' H 3.351 6.580 -2.460 1.00 . B B . 22 A H3' 1 1
1 529 2 2 5 A H4' H 1.342 6.583 -4.742 1.00 . B B . 22 A H4' 1 1
1 530 2 2 5 A H5' H 3.285 5.657 -5.970 1.00 . B B . 22 A H5' 1 1
1 531 2 2 5 A H5'' H 3.734 7.166 -5.149 1.00 . B B . 22 A H5'' 1 1
1 532 2 2 5 A H61 H 5.123 0.800 1.902 1.00 . B B . 22 A H61 1 1
1 533 2 2 5 A H62 H 5.800 1.219 0.342 1.00 . B B . 22 A H62 1 1
1 534 2 2 5 A H8 H 4.079 3.684 -3.481 1.00 . B B . 22 A H8 1 1
1 535 2 2 5 A HO2' H 0.088 7.179 -2.583 1.00 . B B . 22 A HO2' 1 1
1 536 2 2 5 A N1 N 2.937 1.963 1.598 1.00 . B B . 22 A N1 1 1
1 537 2 2 5 A N3 N 1.498 3.237 0.172 1.00 . B B . 22 A N3 1 1
1 538 2 2 5 A N6 N 5.037 1.254 1.000 1.00 . B B . 22 A N6 1 1
1 539 2 2 5 A N7 N 4.495 2.650 -1.691 1.00 . B B . 22 A N7 1 1
1 540 2 2 5 A N9 N 2.534 3.678 -1.983 1.00 . B B . 22 A N9 1 1
1 541 2 2 5 A O2' O 0.026 6.340 -2.119 1.00 . B B . 22 A O2' 1 1
1 542 2 2 5 A O3' O 1.820 7.992 -2.732 1.00 . B B . 22 A O3' 1 1
1 543 2 2 5 A O4' O 1.800 4.698 -3.982 1.00 . B B . 22 A O4' 1 1
1 544 2 2 5 A O5' O 4.519 5.427 -4.305 1.00 . B B . 22 A O5' 1 1
1 545 2 2 5 A OP1 O 5.054 7.549 -3.032 1.00 . B B . 22 A OP1 1 1
1 546 2 2 5 A OP2 O 5.707 5.269 -2.075 1.00 . B B . 22 A OP2 1 1
1 547 2 2 5 A P P 5.521 6.161 -3.240 1.00 . B B . 22 A P 1 1
1 548 2 2 6 C C1' C 1.634 6.077 2.837 1.00 . B B . 23 C C1' 1 1
1 549 2 2 6 C C2 C 3.665 4.701 2.851 1.00 . B B . 23 C C2 1 1
1 550 2 2 6 C C2' C 1.703 7.478 3.437 1.00 . B B . 23 C C2' 1 1
1 551 2 2 6 C C3' C 1.089 8.366 2.351 1.00 . B B . 23 C C3' 1 1
1 552 2 2 6 C C4 C 5.228 4.821 1.112 1.00 . B B . 23 C C4 1 1
1 553 2 2 6 C C4' C 0.112 7.455 1.662 1.00 . B B . 23 C C4' 1 1
1 554 2 2 6 C C5 C 4.458 5.826 0.455 1.00 . B B . 23 C C5 1 1
1 555 2 2 6 C C5' C 0.154 7.800 0.174 1.00 . B B . 23 C C5' 1 1
1 556 2 2 6 C C6 C 3.313 6.220 1.038 1.00 . B B . 23 C C6 1 1
1 557 2 2 6 C H1' H 1.359 5.341 3.594 1.00 . B B . 23 C H1' 1 1
1 558 2 2 6 C H2' H 2.738 7.761 3.620 1.00 . B B . 23 C H2' 1 1
1 559 2 2 6 C H3' H 1.837 8.782 1.676 1.00 . B B . 23 C H3' 1 1
1 560 2 2 6 C H4' H -0.900 7.549 2.057 1.00 . B B . 23 C H4' 1 1
1 561 2 2 6 C H41 H 6.905 3.673 1.083 1.00 . B B . 23 C H41 1 1
1 562 2 2 6 C H42 H 6.679 4.715 -0.306 1.00 . B B . 23 C H42 1 1
1 563 2 2 6 C H5 H 4.782 6.267 -0.485 1.00 . B B . 23 C H5 1 1
1 564 2 2 6 C H5' H -0.322 7.007 -0.403 1.00 . B B . 23 C H5' 1 1
1 565 2 2 6 C H5'' H -0.366 8.743 0.002 1.00 . B B . 23 C H5'' 1 1
1 566 2 2 6 C H6 H 2.714 7.004 0.581 1.00 . B B . 23 C H6 1 1
1 567 2 2 6 C HO2' H 0.384 8.333 4.581 1.00 . B B . 23 C HO2' 1 1
1 568 2 2 6 C N1 N 2.909 5.673 2.213 1.00 . B B . 23 C N1 1 1
1 569 2 2 6 C N3 N 4.826 4.294 2.271 1.00 . B B . 23 C N3 1 1
1 570 2 2 6 C N4 N 6.361 4.368 0.588 1.00 . B B . 23 C N4 1 1
1 571 2 2 6 C O2 O 3.303 4.237 3.929 1.00 . B B . 23 C O2 1 1
1 572 2 2 6 C O2' O 0.930 7.544 4.639 1.00 . B B . 23 C O2' 1 1
1 573 2 2 6 C O3' O 0.411 9.393 3.088 1.00 . B B . 23 C O3' 1 1
1 574 2 2 6 C O4' O 0.610 6.123 1.837 1.00 . B B . 23 C O4' 1 1
1 575 2 2 6 C O5' O 1.549 7.933 -0.216 1.00 . B B . 23 C O5' 1 1
1 576 2 2 6 C OP1 O 1.196 10.077 -1.484 1.00 . B B . 23 C OP1 1 1
1 577 2 2 6 C OP2 O 3.538 9.064 -1.243 1.00 . B B . 23 C OP2 1 1
1 578 2 2 6 C P P 2.077 8.891 -1.414 1.00 . B B . 23 C P 1 1
1 579 2 2 7 C C1' C 5.366 8.960 5.105 1.00 . B B . 24 C C1' 1 1
1 580 2 2 7 C C2 C 6.916 7.921 3.518 1.00 . B B . 24 C C2 1 1
1 581 2 2 7 C C2' C 5.948 10.303 5.565 1.00 . B B . 24 C C2' 1 1
1 582 2 2 7 C C3' C 4.792 11.253 5.282 1.00 . B B . 24 C C3' 1 1
1 583 2 2 7 C C4 C 6.530 7.953 1.210 1.00 . B B . 24 C C4 1 1
1 584 2 2 7 C C4' C 3.618 10.395 5.720 1.00 . B B . 24 C C4' 1 1
1 585 2 2 7 C C5 C 5.312 8.680 1.395 1.00 . B B . 24 C C5 1 1
1 586 2 2 7 C C5' C 2.258 10.843 5.198 1.00 . B B . 24 C C5' 1 1
1 587 2 2 7 C C6 C 4.954 8.993 2.656 1.00 . B B . 24 C C6 1 1
1 588 2 2 7 C H1' H 5.683 8.154 5.767 1.00 . B B . 24 C H1' 1 1
1 589 2 2 7 C H2' H 6.831 10.570 4.985 1.00 . B B . 24 C H2' 1 1
1 590 2 2 7 C H3' H 4.731 11.490 4.219 1.00 . B B . 24 C H3' 1 1
1 591 2 2 7 C H4' H 3.577 10.330 6.807 1.00 . B B . 24 C H4' 1 1
1 592 2 2 7 C H41 H 7.775 7.016 -0.100 1.00 . B B . 24 C H41 1 1
1 593 2 2 7 C H42 H 6.447 7.905 -0.822 1.00 . B B . 24 C H42 1 1
1 594 2 2 7 C H5 H 4.688 8.976 0.551 1.00 . B B . 24 C H5 1 1
1 595 2 2 7 C H5' H 1.504 10.117 5.504 1.00 . B B . 24 C H5' 1 1
1 596 2 2 7 C H5'' H 2.013 11.813 5.632 1.00 . B B . 24 C H5'' 1 1
1 597 2 2 7 C H6 H 4.026 9.538 2.835 1.00 . B B . 24 C H6 1 1
1 598 2 2 7 C HO2' H 6.198 11.175 7.287 1.00 . B B . 24 C HO2' 1 1
1 599 2 2 7 C HO3' H 4.057 12.909 5.995 1.00 . B B . 24 C HO3' 1 1
1 600 2 2 7 C N1 N 5.738 8.625 3.712 1.00 . B B . 24 C N1 1 1
1 601 2 2 7 C N3 N 7.285 7.599 2.252 1.00 . B B . 24 C N3 1 1
1 602 2 2 7 C N4 N 6.950 7.597 -0.002 1.00 . B B . 24 C N4 1 1
1 603 2 2 7 C O2 O 7.612 7.599 4.476 1.00 . B B . 24 C O2 1 1
1 604 2 2 7 C O2' O 6.239 10.269 6.967 1.00 . B B . 24 C O2' 1 1
1 605 2 2 7 C O3' O 4.890 12.439 6.079 1.00 . B B . 24 C O3' 1 1
1 606 2 2 7 C O4' O 3.938 9.107 5.189 1.00 . B B . 24 C O4' 1 1
1 607 2 2 7 C O5' O 2.250 10.957 3.770 1.00 . B B . 24 C O5' 1 1
1 608 2 2 7 C OP1 O -0.119 11.773 3.672 1.00 . B B . 24 C OP1 1 1
1 609 2 2 7 C OP2 O 1.166 11.204 1.528 1.00 . B B . 24 C OP2 1 1
1 610 2 2 7 C P P 0.864 10.933 2.951 1.00 . B B . 24 C P 1 1
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