NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
594753 |
2mvs   |
25220 | cing | 4-filtered-FRED | STAR | entry | full | 454 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mvs
# This FRED archive file contains, for PDB entry <2mvs>:
#
# - 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.PDB_coordinate_file_version .
_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_2mvs
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 2mvs
_Assembly.Number_of_components 2
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 6329.79
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 $N_6_Methyl_Adenosine_RNA A . 1 1
2 . 1 $N_6_Methyl_Adenosine_RNA B . 1 1
stop_
save_
save_N_6_Methyl_Adenosine_RNA
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "N 6 Methyl Adenosine RNA"
_Entity.Type polymer
_Entity.Polymer_type polyribonucleotide
_Entity.Polymer_seq_one_letter_code GGXCUAGUCC
_Entity.Number_of_monomers 10
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 6MZ $6MZ 1 1
4 C . 1 1
5 U . 1 1
6 A . 1 1
7 G . 1 1
8 U . 1 1
9 C . 1 1
10 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
6MZ 3 3 1 1
C 4 4 1 1
U 5 5 1 1
A 6 6 1 1
G 7 7 1 1
U 8 8 1 1
C 9 9 1 1
C 10 10 1 1
stop_
save_
save_6MZ
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID 6MZ
_Chem_comp.Type non-polymer
save_
save_CNS/XPLOR_distance_constraints_9_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
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32 1 . . . 1 1
33 1 . . . 1 1
34 1 . . . 1 1
35 1 . . . 1 1
36 1 . . . 1 1
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40 1 . . . 1 1
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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
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54 1 . . . 1 1
55 1 . . . 1 1
56 1 . . . 1 1
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60 1 . . . 1 1
61 1 . . . 1 1
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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
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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
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110 1 . . . 1 1
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112 1 . . . 1 1
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114 1 . . . 1 1
115 1 . . . 1 1
116 1 . . . 1 1
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120 1 . . . 1 1
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122 1 . . . 1 1
123 1 . . . 1 1
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125 1 . . . 1 1
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127 1 . . . 1 1
128 1 . . . 1 1
129 1 . . . 1 1
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131 1 . . . 1 1
132 1 . . . 1 1
133 1 . . . 1 1
134 1 . . . 1 1
135 1 . . . 1 1
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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
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148 1 . . . 1 1
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150 1 . . . 1 1
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153 1 . . . 1 1
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155 1 . . . 1 1
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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
189 1 . . . 1 1
190 1 . . . 1 1
191 1 . . . 1 1
192 1 . . . 1 1
193 1 . . . 1 1
194 1 . . . 1 1
195 1 . . . 1 1
196 1 . . . 1 1
197 1 . . . 1 1
198 1 . . . 1 1
199 1 . . . 1 1
200 1 . . . 1 1
201 1 . . . 1 1
202 1 . . . 1 1
203 1 . . . 1 1
204 1 . . . 1 1
205 1 . . . 1 1
206 1 . . . 1 1
207 1 . . . 1 1
208 1 . . . 1 1
209 1 . . . 1 1
210 1 . . . 1 1
211 1 . . . 1 1
212 1 . . . 1 1
213 1 . . . 1 1
214 1 . . . 1 1
215 1 . . . 1 1
216 1 . . . 1 1
217 1 . . . 1 1
218 1 . . . 1 1
219 1 . . . 1 1
220 1 . . . 1 1
221 1 . . . 1 1
222 1 . . . 1 1
223 1 . . . 1 1
224 1 . . . 1 1
225 1 . . . 1 1
226 1 . . . 1 1
227 1 . . . 1 1
228 1 . . . 1 1
229 1 . . . 1 1
230 1 . . . 1 1
231 1 . . . 1 1
232 1 . . . 1 1
233 1 . . . 1 1
234 1 . . . 1 1
235 1 . . . 1 1
236 1 . . . 1 1
237 1 . . . 1 1
238 1 . . . 1 1
239 1 . . . 1 1
240 1 . . . 1 1
241 1 . . . 1 1
242 1 . . . 1 1
243 1 . . . 1 1
244 1 . . . 1 1
245 1 . . . 1 1
246 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 3 6MZ H2 . 3 . H2 1 1
1 1 2 2 1 7 G H1 . 17 . H1 1 1
2 1 1 1 1 4 C H41 . 4 . H41 1 1
2 1 2 1 1 5 U H3 . 5 . H3 1 1
3 1 1 1 1 4 C H42 . 4 . H42 1 1
3 1 2 2 1 8 U H3 . 18 . H3 1 1
4 1 1 1 1 7 G H21 . 7 . H21 1 1
4 1 2 1 1 8 U H3 . 8 . H3 1 1
5 1 1 1 1 7 G H1 . 7 . H1 1 1
5 1 2 1 1 8 U H3 . 8 . H3 1 1
6 1 1 2 1 2 G H1 . 12 . H1 1 1
6 1 2 2 1 3 6MZ H1' . 13 . H1' 1 1
7 1 1 2 1 2 G H1 . 12 . H1 1 1
7 1 2 2 1 3 6MZ H2 . 13 . H2 1 1
8 1 1 1 1 7 G H1 . 7 . H1 1 1
8 1 2 2 1 4 C H1' . 14 . H1' 1 1
9 1 1 1 1 6 A H8 . 6 . H8 1 1
9 1 2 2 1 4 C Q4 . 14 . H42 1 1
10 1 1 2 1 4 C Q4 . 14 . H42 1 1
10 1 2 2 1 5 U H3 . 15 . H3 1 1
11 1 1 1 1 7 G H1 . 7 . H1 1 1
11 1 2 2 1 5 U H3 . 15 . H3 1 1
12 1 1 2 1 5 U H3 . 15 . H3 1 1
12 1 2 2 1 6 A H1' . 16 . H1' 1 1
13 1 1 1 1 5 U H3 . 5 . H3 1 1
13 1 2 2 1 7 G H1' . 17 . H1' 1 1
14 1 1 2 1 7 G H1 . 17 . H1 1 1
14 1 2 2 1 8 U H1' . 18 . H1' 1 1
15 1 1 2 1 8 U H1' . 18 . H1' 1 1
15 1 2 2 1 8 U H3 . 18 . H3 1 1
16 1 1 1 1 2 G H1 . 2 . H1 1 1
16 1 2 2 1 8 U H3 . 18 . H3 1 1
17 1 1 2 1 8 U H3 . 18 . H3 1 1
17 1 2 2 1 9 C H1' . 19 . H1' 1 1
18 1 1 2 1 8 U H3 . 18 . H3 1 1
18 1 2 2 1 9 C H41 . 19 . H41 1 1
19 1 1 2 1 8 U H3 . 18 . H3 1 1
19 1 2 2 1 9 C H42 . 19 . H42 1 1
20 1 1 1 1 2 G H1 . 2 . H1 1 1
20 1 2 2 1 10 C H1' . 20 . H1' 1 1
21 1 1 2 1 9 C H41 . 19 . H41 1 1
21 1 2 2 1 10 C H41 . 20 . H41 1 1
22 1 1 1 1 1 G H1' . 1 . H1' 1 1
22 1 2 1 1 1 G H8 . 1 . H8 1 1
23 1 1 1 1 1 G H1' . 1 . H1' 1 1
23 1 2 1 1 2 G H8 . 2 . H8 1 1
24 1 1 1 1 1 G H1' . 1 . H1' 1 1
24 1 2 1 1 1 G H3' . 1 . H3' 1 1
25 1 1 1 1 1 G H3' . 1 . H3' 1 1
25 1 2 1 1 1 G H8 . 1 . H8 1 1
26 1 1 1 1 1 G H3' . 1 . H3' 1 1
26 1 2 1 1 2 G H8 . 2 . H8 1 1
27 1 1 1 1 1 G H1' . 1 . H1' 1 1
27 1 2 1 1 1 G H4' . 1 . H4' 1 1
28 1 1 1 1 1 G H4' . 1 . H4' 1 1
28 1 2 1 1 1 G H8 . 1 . H8 1 1
29 1 1 1 1 1 G H1' . 1 . H1' 1 1
29 1 2 1 1 1 G H5' . 1 . H5' 1 1
30 1 1 1 1 1 G H5' . 1 . H5' 1 1
30 1 2 1 1 1 G H8 . 1 . H8 1 1
31 1 1 1 1 1 G H5'' . 1 . H5'' 1 1
31 1 2 1 1 1 G H8 . 1 . H8 1 1
32 1 1 1 1 2 G H1' . 2 . H1' 1 1
32 1 2 1 1 2 G H8 . 2 . H8 1 1
33 1 1 1 1 2 G H1' . 2 . H1' 1 1
33 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
34 1 1 1 1 2 G H1' . 2 . H1' 1 1
34 1 2 1 1 2 G H3' . 2 . H3' 1 1
35 1 1 1 1 2 G H3' . 2 . H3' 1 1
35 1 2 1 1 2 G H8 . 2 . H8 1 1
36 1 1 1 1 2 G H3' . 2 . H3' 1 1
36 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
37 1 1 1 1 2 G H1' . 2 . H1' 1 1
37 1 2 1 1 2 G H4' . 2 . H4' 1 1
38 1 1 1 1 2 G H1' . 2 . H1' 1 1
38 1 2 1 1 2 G H5' . 2 . H5' 1 1
39 1 1 1 1 2 G H5' . 2 . H5' 1 1
39 1 2 1 1 2 G H8 . 2 . H8 1 1
40 1 1 1 1 3 6MZ H1' . 3 . H1' 1 1
40 1 2 1 1 3 6MZ H2 . 3 . H2 1 1
41 1 1 1 1 3 6MZ H1' . 3 . H1' 1 1
41 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
42 1 1 1 1 3 6MZ H1' . 3 . H1' 1 1
42 1 2 1 1 4 C H6 . 4 . H6 1 1
43 1 1 1 1 3 6MZ H2 . 3 . H2 1 1
43 1 2 1 1 4 C H1' . 4 . H1' 1 1
44 1 1 1 1 3 6MZ H1' . 3 . H1' 1 1
44 1 2 1 1 3 6MZ H3' . 3 . H3' 1 1
45 1 1 1 1 3 6MZ H3' . 3 . H3' 1 1
45 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
46 1 1 1 1 3 6MZ H3' . 3 . H3' 1 1
46 1 2 1 1 4 C H6 . 4 . H6 1 1
47 1 1 1 1 3 6MZ H1' . 3 . H1' 1 1
47 1 2 1 1 3 6MZ H4' . 3 . H4' 1 1
48 1 1 1 1 3 6MZ H4' . 3 . H4' 1 1
48 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
49 1 1 1 1 2 G H8 . 2 . H8 1 1
49 1 2 1 1 3 6MZ H8 . 3 . H8 1 1
50 1 1 1 1 3 6MZ H8 . 3 . H8 1 1
50 1 2 1 1 4 C H6 . 4 . H6 1 1
51 1 1 1 1 3 6MZ H8 . 3 . H8 1 1
51 1 2 1 1 4 C H5 . 4 . H5 1 1
52 1 1 1 1 4 C H1' . 4 . H1' 1 1
52 1 2 1 1 4 C H6 . 4 . H6 1 1
53 1 1 1 1 4 C H1' . 4 . H1' 1 1
53 1 2 1 1 5 U H6 . 5 . H6 1 1
54 1 1 1 1 4 C H1' . 4 . H1' 1 1
54 1 2 1 1 4 C H3' . 4 . H3' 1 1
55 1 1 1 1 4 C H3' . 4 . H3' 1 1
55 1 2 1 1 4 C H6 . 4 . H6 1 1
56 1 1 1 1 4 C H3' . 4 . H3' 1 1
56 1 2 1 1 5 U H5 . 5 . H5 1 1
57 1 1 1 1 4 C H3' . 4 . H3' 1 1
57 1 2 1 1 5 U H6 . 5 . H6 1 1
58 1 1 1 1 4 C H1' . 4 . H1' 1 1
58 1 2 1 1 4 C H4' . 4 . H4' 1 1
59 1 1 1 1 4 C H4' . 4 . H4' 1 1
59 1 2 1 1 4 C H6 . 4 . H6 1 1
60 1 1 1 1 4 C H1' . 4 . H1' 1 1
60 1 2 1 1 4 C H5' . 4 . H5' 1 1
61 1 1 1 1 4 C H5' . 4 . H5' 1 1
61 1 2 1 1 4 C H6 . 4 . H6 1 1
62 1 1 1 1 4 C H6 . 4 . H6 1 1
62 1 2 1 1 5 U H5 . 5 . H5 1 1
63 1 1 1 1 4 C H5 . 4 . H5 1 1
63 1 2 1 1 5 U H5 . 5 . H5 1 1
64 1 1 1 1 5 U H1' . 5 . H1' 1 1
64 1 2 1 1 5 U H6 . 5 . H6 1 1
65 1 1 1 1 5 U H1' . 5 . H1' 1 1
65 1 2 1 1 6 A H8 . 6 . H8 1 1
66 1 1 1 1 5 U H1' . 5 . H1' 1 1
66 1 2 1 1 5 U H3' . 5 . H3' 1 1
67 1 1 1 1 5 U H3' . 5 . H3' 1 1
67 1 2 1 1 5 U H6 . 5 . H6 1 1
68 1 1 1 1 5 U H3' . 5 . H3' 1 1
68 1 2 1 1 5 U H5 . 5 . H5 1 1
69 1 1 1 1 5 U H3' . 5 . H3' 1 1
69 1 2 1 1 6 A H8 . 6 . H8 1 1
70 1 1 1 1 5 U H1' . 5 . H1' 1 1
70 1 2 1 1 5 U H4' . 5 . H4' 1 1
71 1 1 1 1 5 U H4' . 5 . H4' 1 1
71 1 2 1 1 5 U H6 . 5 . H6 1 1
72 1 1 1 1 5 U H1' . 5 . H1' 1 1
72 1 2 1 1 5 U H5' . 5 . H5' 1 1
73 1 1 1 1 5 U H5' . 5 . H5' 1 1
73 1 2 1 1 5 U H6 . 5 . H6 1 1
74 1 1 1 1 6 A H1' . 6 . H1' 1 1
74 1 2 1 1 6 A H8 . 6 . H8 1 1
75 1 1 1 1 6 A H1' . 6 . H1' 1 1
75 1 2 1 1 7 G H8 . 7 . H8 1 1
76 1 1 1 1 6 A H2 . 6 . H2 1 1
76 1 2 2 1 6 A H1' . 16 . H1' 1 1
77 1 1 1 1 6 A H2 . 6 . H2 1 1
77 1 2 1 1 7 G H1' . 7 . H1' 1 1
78 1 1 1 1 6 A H1' . 6 . H1' 1 1
78 1 2 1 1 6 A H3' . 6 . H3' 1 1
79 1 1 1 1 6 A H3' . 6 . H3' 1 1
79 1 2 1 1 6 A H8 . 6 . H8 1 1
80 1 1 1 1 6 A H3' . 6 . H3' 1 1
80 1 2 1 1 7 G H8 . 7 . H8 1 1
81 1 1 1 1 6 A H1' . 6 . H1' 1 1
81 1 2 1 1 6 A H4' . 6 . H4' 1 1
82 1 1 1 1 6 A H4' . 6 . H4' 1 1
82 1 2 1 1 6 A H8 . 6 . H8 1 1
83 1 1 1 1 6 A H1' . 6 . H1' 1 1
83 1 2 1 1 6 A H5' . 6 . H5' 1 1
84 1 1 1 1 6 A H5' . 6 . H5' 1 1
84 1 2 1 1 6 A H8 . 6 . H8 1 1
85 1 1 1 1 5 U H6 . 5 . H6 1 1
85 1 2 1 1 6 A H8 . 6 . H8 1 1
86 1 1 1 1 6 A H8 . 6 . H8 1 1
86 1 2 1 1 7 G H8 . 7 . H8 1 1
87 1 1 1 1 7 G H1' . 7 . H1' 1 1
87 1 2 1 1 7 G H8 . 7 . H8 1 1
88 1 1 1 1 7 G H1' . 7 . H1' 1 1
88 1 2 1 1 8 U H6 . 8 . H6 1 1
89 1 1 1 1 7 G H1' . 7 . H1' 1 1
89 1 2 1 1 7 G H3' . 7 . H3' 1 1
90 1 1 1 1 7 G H3' . 7 . H3' 1 1
90 1 2 1 1 8 U H5 . 8 . H5 1 1
91 1 1 1 1 7 G H3' . 7 . H3' 1 1
91 1 2 1 1 8 U H6 . 8 . H6 1 1
92 1 1 1 1 7 G H3' . 7 . H3' 1 1
92 1 2 1 1 7 G H8 . 7 . H8 1 1
93 1 1 1 1 7 G H1' . 7 . H1' 1 1
93 1 2 1 1 7 G H4' . 7 . H4' 1 1
94 1 1 1 1 7 G H1' . 7 . H1' 1 1
94 1 2 1 1 7 G H5' . 7 . H5' 1 1
95 1 1 1 1 7 G H5' . 7 . H5' 1 1
95 1 2 1 1 7 G H8 . 7 . H8 1 1
96 1 1 1 1 7 G H8 . 7 . H8 1 1
96 1 2 1 1 8 U H5 . 8 . H5 1 1
97 1 1 1 1 8 U H1' . 8 . H1' 1 1
97 1 2 1 1 8 U H6 . 8 . H6 1 1
98 1 1 1 1 8 U H1' . 8 . H1' 1 1
98 1 2 1 1 9 C H6 . 9 . H6 1 1
99 1 1 1 1 8 U H1' . 8 . H1' 1 1
99 1 2 1 1 8 U H3' . 8 . H3' 1 1
100 1 1 1 1 8 U H3' . 8 . H3' 1 1
100 1 2 1 1 8 U H6 . 8 . H6 1 1
101 1 1 1 1 8 U H3' . 8 . H3' 1 1
101 1 2 1 1 9 C H6 . 9 . H6 1 1
102 1 1 1 1 8 U H3' . 8 . H3' 1 1
102 1 2 1 1 9 C H5 . 9 . H5 1 1
103 1 1 1 1 8 U H4' . 8 . H4' 1 1
103 1 2 1 1 8 U H6 . 8 . H6 1 1
104 1 1 1 1 8 U H5 . 8 . H5 1 1
104 1 2 1 1 9 C H5 . 9 . H5 1 1
105 1 1 1 1 8 U H1' . 8 . H1' 1 1
105 1 2 1 1 8 U H5' . 8 . H5' 1 1
106 1 1 1 1 8 U H5' . 8 . H5' 1 1
106 1 2 1 1 8 U H6 . 8 . H6 1 1
107 1 1 1 1 8 U H6 . 8 . H6 1 1
107 1 2 1 1 9 C H5 . 9 . H5 1 1
108 1 1 1 1 9 C H1' . 9 . H1' 1 1
108 1 2 1 1 9 C H6 . 9 . H6 1 1
109 1 1 1 1 9 C H1' . 9 . H1' 1 1
109 1 2 1 1 10 C H6 . 10 . H6 1 1
110 1 1 1 1 9 C H1' . 9 . H1' 1 1
110 1 2 2 1 3 6MZ H2 . 13 . H2 1 1
111 1 1 1 1 9 C H1' . 9 . H1' 1 1
111 1 2 1 1 9 C H3' . 9 . H3' 1 1
112 1 1 1 1 9 C H3' . 9 . H3' 1 1
112 1 2 1 1 10 C H5 . 10 . H5 1 1
113 1 1 1 1 9 C H3' . 9 . H3' 1 1
113 1 2 1 1 9 C H6 . 9 . H6 1 1
114 1 1 1 1 9 C H3' . 9 . H3' 1 1
114 1 2 1 1 10 C H6 . 10 . H6 1 1
115 1 1 1 1 9 C H1' . 9 . H1' 1 1
115 1 2 1 1 9 C H4' . 9 . H4' 1 1
116 1 1 1 1 9 C H1' . 9 . H1' 1 1
116 1 2 1 1 9 C H5' . 9 . H5' 1 1
117 1 1 1 1 9 C H5' . 9 . H5' 1 1
117 1 2 1 1 9 C H6 . 9 . H6 1 1
118 1 1 1 1 9 C H6 . 9 . H6 1 1
118 1 2 1 1 10 C H5 . 10 . H5 1 1
119 1 1 1 1 9 C H5 . 9 . H5 1 1
119 1 2 1 1 10 C H5 . 10 . H5 1 1
120 1 1 1 1 10 C H1' . 10 . H1' 1 1
120 1 2 1 1 10 C H6 . 10 . H6 1 1
121 1 1 1 1 10 C H1' . 10 . H1' 1 1
121 1 2 1 1 10 C H3' . 10 . H3' 1 1
122 1 1 1 1 10 C H3' . 10 . H3' 1 1
122 1 2 1 1 10 C H5 . 10 . H5 1 1
123 1 1 1 1 10 C H3' . 10 . H3' 1 1
123 1 2 1 1 10 C H6 . 10 . H6 1 1
124 1 1 1 1 7 G H1 . 7 . H1 1 1
124 1 2 2 1 3 6MZ H2 . 13 . H2 1 1
125 1 1 1 1 8 U H3 . 8 . H3 1 1
125 1 2 2 1 4 C Q4 . 14 . H42 1 1
126 1 1 2 1 7 G H21 . 17 . H21 1 1
126 1 2 2 1 8 U H3 . 18 . H3 1 1
127 1 1 2 1 7 G H1 . 17 . H1 1 1
127 1 2 2 1 8 U H3 . 18 . H3 1 1
128 1 1 1 1 2 G H1 . 2 . H1 1 1
128 1 2 1 1 3 6MZ H1' . 3 . H1' 1 1
129 1 1 1 1 2 G H1 . 2 . H1 1 1
129 1 2 1 1 3 6MZ H2 . 3 . H2 1 1
130 1 1 1 1 4 C H1' . 4 . H1' 1 1
130 1 2 2 1 7 G H1 . 17 . H1 1 1
131 1 1 1 1 4 C H42 . 4 . H42 1 1
131 1 2 2 1 6 A H8 . 16 . H8 1 1
132 1 1 1 1 4 C H42 . 4 . H42 1 1
132 1 2 1 1 5 U H3 . 5 . H3 1 1
133 1 1 1 1 5 U H3 . 5 . H3 1 1
133 1 2 2 1 7 G H1 . 17 . H1 1 1
134 1 1 1 1 5 U H3 . 5 . H3 1 1
134 1 2 1 1 6 A H1' . 6 . H1' 1 1
135 1 1 1 1 7 G H1' . 7 . H1' 1 1
135 1 2 2 1 5 U H3 . 15 . H3 1 1
136 1 1 1 1 7 G H1 . 7 . H1 1 1
136 1 2 1 1 8 U H1' . 8 . H1' 1 1
137 1 1 1 1 8 U H1' . 8 . H1' 1 1
137 1 2 1 1 8 U H3 . 8 . H3 1 1
138 1 1 1 1 8 U H3 . 8 . H3 1 1
138 1 2 2 1 2 G H1 . 12 . H1 1 1
139 1 1 1 1 8 U H3 . 8 . H3 1 1
139 1 2 1 1 9 C H1' . 9 . H1' 1 1
140 1 1 1 1 8 U H3 . 8 . H3 1 1
140 1 2 1 1 9 C H41 . 9 . H41 1 1
141 1 1 1 1 8 U H6 . 8 . H6 1 1
141 1 2 1 1 9 C H42 . 9 . H42 1 1
142 1 1 1 1 8 U H3 . 8 . H3 1 1
142 1 2 1 1 9 C H42 . 9 . H42 1 1
143 1 1 1 1 10 C H1' . 10 . H1' 1 1
143 1 2 2 1 2 G H1 . 12 . H1 1 1
144 1 1 1 1 9 C H41 . 9 . H41 1 1
144 1 2 1 1 10 C H41 . 10 . H41 1 1
145 1 1 2 1 1 G H1' . 11 . H1' 1 1
145 1 2 2 1 1 G H8 . 11 . H8 1 1
146 1 1 2 1 1 G H1' . 11 . H1' 1 1
146 1 2 2 1 2 G H8 . 12 . H8 1 1
147 1 1 2 1 1 G H1' . 11 . H1' 1 1
147 1 2 2 1 1 G H3' . 11 . H3' 1 1
148 1 1 2 1 1 G H3' . 11 . H3' 1 1
148 1 2 2 1 1 G H8 . 11 . H8 1 1
149 1 1 2 1 1 G H3' . 11 . H3' 1 1
149 1 2 2 1 2 G H8 . 12 . H8 1 1
150 1 1 2 1 1 G H1' . 11 . H1' 1 1
150 1 2 2 1 1 G H4' . 11 . H4' 1 1
151 1 1 2 1 1 G H4' . 11 . H4' 1 1
151 1 2 2 1 1 G H8 . 11 . H8 1 1
152 1 1 2 1 1 G H1' . 11 . H1' 1 1
152 1 2 2 1 1 G H5' . 11 . H5' 1 1
153 1 1 2 1 1 G H5' . 11 . H5' 1 1
153 1 2 2 1 1 G H8 . 11 . H8 1 1
154 1 1 2 1 1 G H5'' . 11 . H5'' 1 1
154 1 2 2 1 1 G H8 . 11 . H8 1 1
155 1 1 2 1 2 G H1' . 12 . H1' 1 1
155 1 2 2 1 2 G H8 . 12 . H8 1 1
156 1 1 2 1 2 G H1' . 12 . H1' 1 1
156 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
157 1 1 2 1 2 G H1' . 12 . H1' 1 1
157 1 2 2 1 2 G H3' . 12 . H3' 1 1
158 1 1 2 1 2 G H3' . 12 . H3' 1 1
158 1 2 2 1 2 G H8 . 12 . H8 1 1
159 1 1 2 1 2 G H3' . 12 . H3' 1 1
159 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
160 1 1 2 1 2 G H1' . 12 . H1' 1 1
160 1 2 2 1 2 G H4' . 12 . H4' 1 1
161 1 1 2 1 2 G H1' . 12 . H1' 1 1
161 1 2 2 1 2 G H5' . 12 . H5' 1 1
162 1 1 2 1 2 G H5' . 12 . H5' 1 1
162 1 2 2 1 2 G H8 . 12 . H8 1 1
163 1 1 2 1 3 6MZ H1' . 13 . H1' 1 1
163 1 2 2 1 3 6MZ H2 . 13 . H2 1 1
164 1 1 2 1 3 6MZ H1' . 13 . H1' 1 1
164 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
165 1 1 2 1 3 6MZ H1' . 13 . H1' 1 1
165 1 2 2 1 4 C H6 . 14 . H6 1 1
166 1 1 2 1 3 6MZ H2 . 13 . H2 1 1
166 1 2 2 1 4 C H1' . 14 . H1' 1 1
167 1 1 2 1 3 6MZ H1' . 13 . H1' 1 1
167 1 2 2 1 3 6MZ H3' . 13 . H3' 1 1
168 1 1 2 1 3 6MZ H3' . 13 . H3' 1 1
168 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
169 1 1 2 1 3 6MZ H3' . 13 . H3' 1 1
169 1 2 2 1 4 C H6 . 14 . H6 1 1
170 1 1 2 1 3 6MZ H1' . 13 . H1' 1 1
170 1 2 2 1 3 6MZ H4' . 13 . H4' 1 1
171 1 1 2 1 3 6MZ H4' . 13 . H4' 1 1
171 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
172 1 1 2 1 2 G H8 . 12 . H8 1 1
172 1 2 2 1 3 6MZ H8 . 13 . H8 1 1
173 1 1 2 1 3 6MZ H8 . 13 . H8 1 1
173 1 2 2 1 4 C H6 . 14 . H6 1 1
174 1 1 2 1 3 6MZ H8 . 13 . H8 1 1
174 1 2 2 1 4 C H5 . 14 . H5 1 1
175 1 1 2 1 4 C H1' . 14 . H1' 1 1
175 1 2 2 1 4 C H6 . 14 . H6 1 1
176 1 1 2 1 4 C H1' . 14 . H1' 1 1
176 1 2 2 1 5 U H6 . 15 . H6 1 1
177 1 1 2 1 4 C H1' . 14 . H1' 1 1
177 1 2 2 1 4 C H3' . 14 . H3' 1 1
178 1 1 2 1 4 C H3' . 14 . H3' 1 1
178 1 2 2 1 4 C H6 . 14 . H6 1 1
179 1 1 2 1 4 C H3' . 14 . H3' 1 1
179 1 2 2 1 5 U H5 . 15 . H5 1 1
180 1 1 2 1 4 C H3' . 14 . H3' 1 1
180 1 2 2 1 5 U H6 . 15 . H6 1 1
181 1 1 2 1 4 C H1' . 14 . H1' 1 1
181 1 2 2 1 4 C H4' . 14 . H4' 1 1
182 1 1 2 1 4 C H4' . 14 . H4' 1 1
182 1 2 2 1 4 C H6 . 14 . H6 1 1
183 1 1 2 1 4 C H1' . 14 . H1' 1 1
183 1 2 2 1 4 C H5' . 14 . H5' 1 1
184 1 1 2 1 4 C H5' . 14 . H5' 1 1
184 1 2 2 1 4 C H6 . 14 . H6 1 1
185 1 1 2 1 4 C H6 . 14 . H6 1 1
185 1 2 2 1 5 U H5 . 15 . H5 1 1
186 1 1 2 1 4 C H5 . 14 . H5 1 1
186 1 2 2 1 5 U H5 . 15 . H5 1 1
187 1 1 2 1 5 U H1' . 15 . H1' 1 1
187 1 2 2 1 5 U H6 . 15 . H6 1 1
188 1 1 2 1 5 U H1' . 15 . H1' 1 1
188 1 2 2 1 6 A H8 . 16 . H8 1 1
189 1 1 2 1 5 U H1' . 15 . H1' 1 1
189 1 2 2 1 5 U H3' . 15 . H3' 1 1
190 1 1 2 1 5 U H3' . 15 . H3' 1 1
190 1 2 2 1 5 U H6 . 15 . H6 1 1
191 1 1 2 1 5 U H3' . 15 . H3' 1 1
191 1 2 2 1 5 U H5 . 15 . H5 1 1
192 1 1 2 1 5 U H3' . 15 . H3' 1 1
192 1 2 2 1 6 A H8 . 16 . H8 1 1
193 1 1 2 1 5 U H1' . 15 . H1' 1 1
193 1 2 2 1 5 U H4' . 15 . H4' 1 1
194 1 1 2 1 5 U H4' . 15 . H4' 1 1
194 1 2 2 1 5 U H6 . 15 . H6 1 1
195 1 1 2 1 5 U H1' . 15 . H1' 1 1
195 1 2 2 1 5 U H5' . 15 . H5' 1 1
196 1 1 2 1 5 U H5' . 15 . H5' 1 1
196 1 2 2 1 5 U H6 . 15 . H6 1 1
197 1 1 2 1 6 A H1' . 16 . H1' 1 1
197 1 2 2 1 6 A H8 . 16 . H8 1 1
198 1 1 2 1 6 A H1' . 16 . H1' 1 1
198 1 2 2 1 7 G H8 . 17 . H8 1 1
199 1 1 1 1 6 A H1' . 6 . H1' 1 1
199 1 2 2 1 6 A H2 . 16 . H2 1 1
200 1 1 2 1 6 A H2 . 16 . H2 1 1
200 1 2 2 1 7 G H1' . 17 . H1' 1 1
201 1 1 2 1 6 A H1' . 16 . H1' 1 1
201 1 2 2 1 6 A H3' . 16 . H3' 1 1
202 1 1 2 1 6 A H3' . 16 . H3' 1 1
202 1 2 2 1 6 A H8 . 16 . H8 1 1
203 1 1 2 1 6 A H3' . 16 . H3' 1 1
203 1 2 2 1 7 G H8 . 17 . H8 1 1
204 1 1 2 1 6 A H1' . 16 . H1' 1 1
204 1 2 2 1 6 A H4' . 16 . H4' 1 1
205 1 1 2 1 6 A H4' . 16 . H4' 1 1
205 1 2 2 1 6 A H8 . 16 . H8 1 1
206 1 1 2 1 6 A H1' . 16 . H1' 1 1
206 1 2 2 1 6 A H5' . 16 . H5' 1 1
207 1 1 2 1 6 A H5' . 16 . H5' 1 1
207 1 2 2 1 6 A H8 . 16 . H8 1 1
208 1 1 2 1 5 U H6 . 15 . H6 1 1
208 1 2 2 1 6 A H8 . 16 . H8 1 1
209 1 1 2 1 6 A H8 . 16 . H8 1 1
209 1 2 2 1 7 G H8 . 17 . H8 1 1
210 1 1 2 1 7 G H1' . 17 . H1' 1 1
210 1 2 2 1 7 G H8 . 17 . H8 1 1
211 1 1 2 1 7 G H1' . 17 . H1' 1 1
211 1 2 2 1 8 U H6 . 18 . H6 1 1
212 1 1 2 1 7 G H1' . 17 . H1' 1 1
212 1 2 2 1 7 G H3' . 17 . H3' 1 1
213 1 1 2 1 7 G H3' . 17 . H3' 1 1
213 1 2 2 1 8 U H5 . 18 . H5 1 1
214 1 1 2 1 7 G H3' . 17 . H3' 1 1
214 1 2 2 1 8 U H6 . 18 . H6 1 1
215 1 1 2 1 7 G H3' . 17 . H3' 1 1
215 1 2 2 1 7 G H8 . 17 . H8 1 1
216 1 1 2 1 7 G H1' . 17 . H1' 1 1
216 1 2 2 1 7 G H4' . 17 . H4' 1 1
217 1 1 2 1 7 G H1' . 17 . H1' 1 1
217 1 2 2 1 7 G H5' . 17 . H5' 1 1
218 1 1 2 1 7 G H5' . 17 . H5' 1 1
218 1 2 2 1 7 G H8 . 17 . H8 1 1
219 1 1 2 1 7 G H8 . 17 . H8 1 1
219 1 2 2 1 8 U H5 . 18 . H5 1 1
220 1 1 2 1 8 U H1' . 18 . H1' 1 1
220 1 2 2 1 8 U H6 . 18 . H6 1 1
221 1 1 2 1 8 U H1' . 18 . H1' 1 1
221 1 2 2 1 9 C H6 . 19 . H6 1 1
222 1 1 2 1 8 U H1' . 18 . H1' 1 1
222 1 2 2 1 8 U H3' . 18 . H3' 1 1
223 1 1 2 1 8 U H3' . 18 . H3' 1 1
223 1 2 2 1 8 U H6 . 18 . H6 1 1
224 1 1 2 1 8 U H3' . 18 . H3' 1 1
224 1 2 2 1 9 C H6 . 19 . H6 1 1
225 1 1 2 1 8 U H3' . 18 . H3' 1 1
225 1 2 2 1 9 C H5 . 19 . H5 1 1
226 1 1 2 1 8 U H4' . 18 . H4' 1 1
226 1 2 2 1 8 U H6 . 18 . H6 1 1
227 1 1 2 1 8 U H5 . 18 . H5 1 1
227 1 2 2 1 9 C H5 . 19 . H5 1 1
228 1 1 2 1 8 U H1' . 18 . H1' 1 1
228 1 2 2 1 8 U H5' . 18 . H5' 1 1
229 1 1 2 1 8 U H5' . 18 . H5' 1 1
229 1 2 2 1 8 U H6 . 18 . H6 1 1
230 1 1 2 1 8 U H6 . 18 . H6 1 1
230 1 2 2 1 9 C H5 . 19 . H5 1 1
231 1 1 2 1 9 C H1' . 19 . H1' 1 1
231 1 2 2 1 9 C H6 . 19 . H6 1 1
232 1 1 2 1 9 C H1' . 19 . H1' 1 1
232 1 2 2 1 10 C H6 . 20 . H6 1 1
233 1 1 1 1 3 6MZ H2 . 3 . H2 1 1
233 1 2 2 1 9 C H1' . 19 . H1' 1 1
234 1 1 2 1 9 C H1' . 19 . H1' 1 1
234 1 2 2 1 9 C H3' . 19 . H3' 1 1
235 1 1 2 1 9 C H3' . 19 . H3' 1 1
235 1 2 2 1 10 C H5 . 20 . H5 1 1
236 1 1 2 1 9 C H3' . 19 . H3' 1 1
236 1 2 2 1 9 C H6 . 19 . H6 1 1
237 1 1 2 1 9 C H3' . 19 . H3' 1 1
237 1 2 2 1 10 C H6 . 20 . H6 1 1
238 1 1 2 1 9 C H1' . 19 . H1' 1 1
238 1 2 2 1 9 C H4' . 19 . H4' 1 1
239 1 1 2 1 9 C H1' . 19 . H1' 1 1
239 1 2 2 1 9 C H5' . 19 . H5' 1 1
240 1 1 2 1 9 C H5' . 19 . H5' 1 1
240 1 2 2 1 9 C H6 . 19 . H6 1 1
241 1 1 2 1 9 C H6 . 19 . H6 1 1
241 1 2 2 1 10 C H5 . 20 . H5 1 1
242 1 1 2 1 9 C H5 . 19 . H5 1 1
242 1 2 2 1 10 C H5 . 20 . H5 1 1
243 1 1 2 1 10 C H1' . 20 . H1' 1 1
243 1 2 2 1 10 C H6 . 20 . H6 1 1
244 1 1 2 1 10 C H1' . 20 . H1' 1 1
244 1 2 2 1 10 C H3' . 20 . H3' 1 1
245 1 1 2 1 10 C H3' . 20 . H3' 1 1
245 1 2 2 1 10 C H5 . 20 . H5 1 1
246 1 1 2 1 10 C H3' . 20 . H3' 1 1
246 1 2 2 1 10 C H6 . 20 . H6 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.0 2.0 7.0 1 1
2 1 . . . . . 2.0 2.0 7.0 1 1
3 1 . . . . . 2.0 2.0 7.0 1 1
4 1 . . . . . 2.0 2.0 7.0 1 1
5 1 . . . . . 2.0 2.0 7.0 1 1
6 1 . . . . . 2.0 2.0 7.0 1 1
7 1 . . . . . 2.0 2.0 7.0 1 1
8 1 . . . . . 2.0 2.0 7.0 1 1
9 1 . . . . . 2.0 2.0 7.0 1 1
10 1 . . . . . 2.0 2.0 7.0 1 1
11 1 . . . . . 2.0 2.0 7.0 1 1
12 1 . . . . . 2.0 2.0 7.0 1 1
13 1 . . . . . 2.0 2.0 7.0 1 1
14 1 . . . . . 2.0 2.0 7.0 1 1
15 1 . . . . . 2.0 2.0 7.0 1 1
16 1 . . . . . 2.0 2.0 7.0 1 1
17 1 . . . . . 2.0 2.0 7.0 1 1
18 1 . . . . . 2.0 2.0 7.0 1 1
19 1 . . . . . 2.0 2.0 7.0 1 1
20 1 . . . . . 2.0 2.0 7.0 1 1
21 1 . . . . . 2.0 2.0 7.0 1 1
22 1 . . . . . 3.0 3.0 5.0 1 1
23 1 . . . . . 3.0 3.0 5.0 1 1
24 1 . . . . . 3.0 3.0 5.0 1 1
25 1 . . . . . 2.5 2.5 4.0 1 1
26 1 . . . . . 2.3 2.3 3.5 1 1
27 1 . . . . . 3.0 3.0 5.0 1 1
28 1 . . . . . 3.0 3.0 5.0 1 1
29 1 . . . . . 3.0 3.0 5.0 1 1
30 1 . . . . . 2.5 2.5 4.0 1 1
31 1 . . . . . 3.0 3.0 5.0 1 1
32 1 . . . . . 3.0 3.0 5.0 1 1
33 1 . . . . . 3.0 3.0 5.0 1 1
34 1 . . . . . 2.5 2.5 5.0 1 1
35 1 . . . . . 2.5 2.5 4.0 1 1
36 1 . . . . . 1.8 1.8 4.0 1 1
37 1 . . . . . 2.5 2.5 4.0 1 1
38 1 . . . . . 3.0 3.0 5.0 1 1
39 1 . . . . . 3.0 3.0 5.0 1 1
40 1 . . . . . 3.0 3.0 5.0 1 1
41 1 . . . . . 3.0 3.0 5.0 1 1
42 1 . . . . . 3.0 3.0 5.0 1 1
43 1 . . . . . 2.5 2.5 4.0 1 1
44 1 . . . . . 2.5 2.5 4.0 1 1
45 1 . . . . . 1.8 1.8 4.0 1 1
46 1 . . . . . 2.5 2.5 4.0 1 1
47 1 . . . . . 2.5 2.5 4.0 1 1
48 1 . . . . . 3.0 3.0 5.0 1 1
49 1 . . . . . 3.0 3.0 5.0 1 1
50 1 . . . . . 3.0 3.0 5.0 1 1
51 1 . . . . . 3.0 3.0 5.0 1 1
52 1 . . . . . 3.0 3.0 5.0 1 1
53 1 . . . . . 3.0 3.0 5.0 1 1
54 1 . . . . . 3.0 3.0 5.0 1 1
55 1 . . . . . 2.3 2.3 3.5 1 1
56 1 . . . . . 3.0 3.0 5.0 1 1
57 1 . . . . . 3.0 3.0 5.0 1 1
58 1 . . . . . 2.5 2.5 4.0 1 1
59 1 . . . . . 3.0 3.0 5.0 1 1
60 1 . . . . . 3.0 3.0 5.0 1 1
61 1 . . . . . 3.0 3.0 5.0 1 1
62 1 . . . . . 3.0 3.0 5.0 1 1
63 1 . . . . . 3.0 3.0 5.0 1 1
64 1 . . . . . 3.0 3.0 5.0 1 1
65 1 . . . . . 3.0 3.0 5.0 1 1
66 1 . . . . . 3.0 3.0 5.0 1 1
67 1 . . . . . 2.3 2.3 3.5 1 1
68 1 . . . . . 3.0 3.0 5.0 1 1
69 1 . . . . . 2.5 2.5 4.0 1 1
70 1 . . . . . 2.5 2.5 5.0 1 1
71 1 . . . . . 3.0 3.0 5.0 1 1
72 1 . . . . . 3.0 3.0 5.0 1 1
73 1 . . . . . 3.0 3.0 5.0 1 1
74 1 . . . . . 3.0 3.0 5.0 1 1
75 1 . . . . . 3.0 3.0 5.0 1 1
76 1 . . . . . 2.5 2.5 4.0 1 1
77 1 . . . . . 2.5 2.5 4.0 1 1
78 1 . . . . . 2.5 2.5 5.0 1 1
79 1 . . . . . 2.5 2.5 4.0 1 1
80 1 . . . . . 2.5 2.5 5.0 1 1
81 1 . . . . . 2.5 2.5 4.0 1 1
82 1 . . . . . 3.0 3.0 5.0 1 1
83 1 . . . . . 3.0 3.0 5.0 1 1
84 1 . . . . . 3.0 3.0 5.0 1 1
85 1 . . . . . 3.0 3.0 5.0 1 1
86 1 . . . . . 3.0 3.0 5.0 1 1
87 1 . . . . . 3.0 3.0 5.0 1 1
88 1 . . . . . 3.0 3.0 5.0 1 1
89 1 . . . . . 3.0 3.0 5.0 1 1
90 1 . . . . . 3.0 3.0 5.0 1 1
91 1 . . . . . 2.5 2.5 5.0 1 1
92 1 . . . . . 2.5 2.5 5.0 1 1
93 1 . . . . . 2.5 2.5 4.0 1 1
94 1 . . . . . 3.0 3.0 5.0 1 1
95 1 . . . . . 3.0 3.0 5.0 1 1
96 1 . . . . . 3.0 3.0 5.0 1 1
97 1 . . . . . 3.0 3.0 5.0 1 1
98 1 . . . . . 3.0 3.0 5.0 1 1
99 1 . . . . . 2.5 2.5 5.0 1 1
100 1 . . . . . 2.3 2.3 3.5 1 1
101 1 . . . . . 1.8 1.8 4.0 1 1
102 1 . . . . . 2.5 2.5 5.0 1 1
103 1 . . . . . 3.0 3.0 5.0 1 1
104 1 . . . . . 3.0 3.0 5.0 1 1
105 1 . . . . . 3.0 3.0 5.0 1 1
106 1 . . . . . 3.0 3.0 5.0 1 1
107 1 . . . . . 3.0 3.0 5.0 1 1
108 1 . . . . . 3.0 3.0 5.0 1 1
109 1 . . . . . 3.0 3.0 5.0 1 1
110 1 . . . . . 2.5 2.5 4.0 1 1
111 1 . . . . . 2.5 2.5 5.0 1 1
112 1 . . . . . 2.5 2.5 5.0 1 1
113 1 . . . . . 2.3 2.3 3.5 1 1
114 1 . . . . . 2.5 2.5 4.0 1 1
115 1 . . . . . 2.5 2.5 4.0 1 1
116 1 . . . . . 3.0 3.0 5.0 1 1
117 1 . . . . . 3.0 3.0 5.0 1 1
118 1 . . . . . 3.0 3.0 5.0 1 1
119 1 . . . . . 3.0 3.0 5.0 1 1
120 1 . . . . . 3.0 3.0 5.0 1 1
121 1 . . . . . 2.5 2.5 4.0 1 1
122 1 . . . . . 3.0 3.0 5.0 1 1
123 1 . . . . . 1.8 1.8 4.0 1 1
124 1 . . . . . 2.0 2.0 7.0 1 1
125 1 . . . . . 2.0 2.0 7.0 1 1
126 1 . . . . . 2.0 2.0 7.0 1 1
127 1 . . . . . 2.0 2.0 7.0 1 1
128 1 . . . . . 2.0 2.0 7.0 1 1
129 1 . . . . . 2.0 2.0 7.0 1 1
130 1 . . . . . 2.0 2.0 7.0 1 1
131 1 . . . . . 2.0 2.0 7.0 1 1
132 1 . . . . . 2.0 2.0 7.0 1 1
133 1 . . . . . 2.0 2.0 7.0 1 1
134 1 . . . . . 2.0 2.0 7.0 1 1
135 1 . . . . . 2.0 2.0 7.0 1 1
136 1 . . . . . 2.0 2.0 7.0 1 1
137 1 . . . . . 2.0 2.0 7.0 1 1
138 1 . . . . . 2.0 2.0 7.0 1 1
139 1 . . . . . 2.0 2.0 7.0 1 1
140 1 . . . . . 2.0 2.0 7.0 1 1
141 1 . . . . . 2.0 2.0 7.0 1 1
142 1 . . . . . 2.0 2.0 7.0 1 1
143 1 . . . . . 2.0 2.0 7.0 1 1
144 1 . . . . . 2.0 2.0 7.0 1 1
145 1 . . . . . 3.0 3.0 5.0 1 1
146 1 . . . . . 3.0 3.0 5.0 1 1
147 1 . . . . . 3.0 3.0 5.0 1 1
148 1 . . . . . 2.5 2.5 4.0 1 1
149 1 . . . . . 2.3 2.3 3.5 1 1
150 1 . . . . . 3.0 3.0 5.0 1 1
151 1 . . . . . 3.0 3.0 5.0 1 1
152 1 . . . . . 3.0 3.0 5.0 1 1
153 1 . . . . . 2.5 2.5 4.0 1 1
154 1 . . . . . 3.0 3.0 5.0 1 1
155 1 . . . . . 3.0 3.0 5.0 1 1
156 1 . . . . . 3.0 3.0 5.0 1 1
157 1 . . . . . 2.5 2.5 5.0 1 1
158 1 . . . . . 2.5 2.5 4.0 1 1
159 1 . . . . . 1.8 1.8 4.0 1 1
160 1 . . . . . 2.5 2.5 4.0 1 1
161 1 . . . . . 3.0 3.0 5.0 1 1
162 1 . . . . . 3.0 3.0 5.0 1 1
163 1 . . . . . 3.0 3.0 5.0 1 1
164 1 . . . . . 3.0 3.0 5.0 1 1
165 1 . . . . . 3.0 3.0 5.0 1 1
166 1 . . . . . 2.5 2.5 4.0 1 1
167 1 . . . . . 2.5 2.5 4.0 1 1
168 1 . . . . . 1.8 1.8 4.0 1 1
169 1 . . . . . 2.5 2.5 4.0 1 1
170 1 . . . . . 2.5 2.5 4.0 1 1
171 1 . . . . . 3.0 3.0 5.0 1 1
172 1 . . . . . 3.0 3.0 5.0 1 1
173 1 . . . . . 3.0 3.0 5.0 1 1
174 1 . . . . . 3.0 3.0 5.0 1 1
175 1 . . . . . 3.0 3.0 5.0 1 1
176 1 . . . . . 3.0 3.0 5.0 1 1
177 1 . . . . . 3.0 3.0 5.0 1 1
178 1 . . . . . 2.3 2.3 3.5 1 1
179 1 . . . . . 3.0 3.0 5.0 1 1
180 1 . . . . . 3.0 3.0 5.0 1 1
181 1 . . . . . 2.5 2.5 4.0 1 1
182 1 . . . . . 3.0 3.0 5.0 1 1
183 1 . . . . . 3.0 3.0 5.0 1 1
184 1 . . . . . 3.0 3.0 5.0 1 1
185 1 . . . . . 3.0 3.0 5.0 1 1
186 1 . . . . . 3.0 3.0 5.0 1 1
187 1 . . . . . 3.0 3.0 5.0 1 1
188 1 . . . . . 3.0 3.0 5.0 1 1
189 1 . . . . . 3.0 3.0 5.0 1 1
190 1 . . . . . 2.3 2.3 3.5 1 1
191 1 . . . . . 3.0 3.0 5.0 1 1
192 1 . . . . . 2.5 2.5 4.0 1 1
193 1 . . . . . 2.5 2.5 5.0 1 1
194 1 . . . . . 3.0 3.0 5.0 1 1
195 1 . . . . . 3.0 3.0 5.0 1 1
196 1 . . . . . 3.0 3.0 5.0 1 1
197 1 . . . . . 3.0 3.0 5.0 1 1
198 1 . . . . . 3.0 3.0 5.0 1 1
199 1 . . . . . 2.5 2.5 4.0 1 1
200 1 . . . . . 2.5 2.5 4.0 1 1
201 1 . . . . . 2.5 2.5 5.0 1 1
202 1 . . . . . 2.5 2.5 4.0 1 1
203 1 . . . . . 2.5 2.5 5.0 1 1
204 1 . . . . . 2.5 2.5 4.0 1 1
205 1 . . . . . 3.0 3.0 5.0 1 1
206 1 . . . . . 3.0 3.0 5.0 1 1
207 1 . . . . . 3.0 3.0 5.0 1 1
208 1 . . . . . 3.0 3.0 5.0 1 1
209 1 . . . . . 3.0 3.0 5.0 1 1
210 1 . . . . . 3.0 3.0 5.0 1 1
211 1 . . . . . 3.0 3.0 5.0 1 1
212 1 . . . . . 3.0 3.0 5.0 1 1
213 1 . . . . . 3.0 3.0 5.0 1 1
214 1 . . . . . 2.5 2.5 5.0 1 1
215 1 . . . . . 2.5 2.5 5.0 1 1
216 1 . . . . . 2.5 2.5 4.0 1 1
217 1 . . . . . 3.0 3.0 5.0 1 1
218 1 . . . . . 3.0 3.0 5.0 1 1
219 1 . . . . . 3.0 3.0 5.0 1 1
220 1 . . . . . 3.0 3.0 5.0 1 1
221 1 . . . . . 3.0 3.0 5.0 1 1
222 1 . . . . . 2.5 2.5 5.0 1 1
223 1 . . . . . 2.3 2.3 3.5 1 1
224 1 . . . . . 1.8 1.8 4.0 1 1
225 1 . . . . . 2.5 2.5 5.0 1 1
226 1 . . . . . 3.0 3.0 5.0 1 1
227 1 . . . . . 3.0 3.0 5.0 1 1
228 1 . . . . . 3.0 3.0 5.0 1 1
229 1 . . . . . 3.0 3.0 5.0 1 1
230 1 . . . . . 3.0 3.0 5.0 1 1
231 1 . . . . . 3.0 3.0 5.0 1 1
232 1 . . . . . 3.0 3.0 5.0 1 1
233 1 . . . . . 2.5 2.5 4.0 1 1
234 1 . . . . . 2.5 2.5 5.0 1 1
235 1 . . . . . 2.5 2.5 5.0 1 1
236 1 . . . . . 2.3 2.3 3.5 1 1
237 1 . . . . . 2.5 2.5 4.0 1 1
238 1 . . . . . 2.5 2.5 4.0 1 1
239 1 . . . . . 3.0 3.0 5.0 1 1
240 1 . . . . . 3.0 3.0 5.0 1 1
241 1 . . . . . 3.0 3.0 5.0 1 1
242 1 . . . . . 3.0 3.0 5.0 1 1
243 1 . . . . . 3.0 3.0 5.0 1 1
244 1 . . . . . 2.5 2.5 4.0 1 1
245 1 . . . . . 3.0 3.0 5.0 1 1
246 1 . . . . . 1.8 1.8 4.0 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_8_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
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 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 . 1 . H1 1 2
1 1 2 2 1 10 C N3 . 20 . N3 1 2
2 1 1 1 1 1 G H21 . 1 . H21 1 2
2 1 2 2 1 10 C O2 . 20 . O2 1 2
3 1 1 1 1 1 G H21 . 1 . H21 1 2
3 1 2 2 1 10 C N3 . 20 . N3 1 2
4 1 1 1 1 1 G O6 . 1 . O6 1 2
4 1 2 2 1 10 C H41 . 20 . H41 1 2
5 1 1 1 1 2 G H1 . 2 . H1 1 2
5 1 2 2 1 9 C N3 . 19 . N3 1 2
6 1 1 1 1 2 G H21 . 2 . H21 1 2
6 1 2 2 1 9 C O2 . 19 . O2 1 2
7 1 1 1 1 2 G H21 . 2 . H21 1 2
7 1 2 2 1 9 C N3 . 19 . N3 1 2
8 1 1 1 1 2 G O6 . 2 . O6 1 2
8 1 2 2 1 9 C H41 . 19 . H41 1 2
9 1 1 1 1 3 6MZ H2 . 3 . H2 1 2
9 1 2 2 1 8 U O2 . 18 . O2 1 2
10 1 1 1 1 3 6MZ N1 . 3 . N1 1 2
10 1 2 2 1 8 U H3 . 18 . H3 1 2
11 1 1 1 1 3 6MZ H2 . 3 . H2 1 2
11 1 2 2 1 8 U H3 . 18 . H3 1 2
12 1 1 1 1 4 C N3 . 4 . N3 1 2
12 1 2 2 1 7 G H1 . 17 . H1 1 2
13 1 1 1 1 4 C O2 . 4 . O2 1 2
13 1 2 2 1 7 G H21 . 17 . H21 1 2
14 1 1 1 1 4 C N3 . 4 . N3 1 2
14 1 2 2 1 7 G H21 . 17 . H21 1 2
15 1 1 1 1 4 C H41 . 4 . H41 1 2
15 1 2 2 1 7 G O6 . 17 . O6 1 2
16 1 1 1 1 5 U O2 . 5 . O2 1 2
16 1 2 2 1 6 A H2 . 16 . H2 1 2
17 1 1 1 1 5 U H3 . 5 . H3 1 2
17 1 2 2 1 6 A N1 . 16 . N1 1 2
18 1 1 1 1 5 U O4 . 5 . O4 1 2
18 1 2 2 1 6 A H61 . 16 . H61 1 2
19 1 1 1 1 5 U H3 . 5 . H3 1 2
19 1 2 2 1 6 A H2 . 16 . H2 1 2
20 1 1 1 1 6 A H2 . 6 . H2 1 2
20 1 2 2 1 5 U O2 . 15 . O2 1 2
21 1 1 1 1 6 A N1 . 6 . N1 1 2
21 1 2 2 1 5 U H3 . 15 . H3 1 2
22 1 1 1 1 6 A H61 . 6 . H61 1 2
22 1 2 2 1 5 U O4 . 15 . O4 1 2
23 1 1 1 1 6 A H2 . 6 . H2 1 2
23 1 2 2 1 5 U H3 . 15 . H3 1 2
24 1 1 1 1 7 G H1 . 7 . H1 1 2
24 1 2 2 1 4 C N3 . 14 . N3 1 2
25 1 1 1 1 7 G H21 . 7 . H21 1 2
25 1 2 2 1 4 C O2 . 14 . O2 1 2
26 1 1 1 1 7 G H21 . 7 . H21 1 2
26 1 2 2 1 4 C N3 . 14 . N3 1 2
27 1 1 1 1 7 G O6 . 7 . O6 1 2
27 1 2 2 1 4 C Q4 . 14 . H41 1 2
28 1 1 1 1 8 U O2 . 8 . O2 1 2
28 1 2 2 1 3 6MZ H2 . 13 . H2 1 2
29 1 1 1 1 8 U H3 . 8 . H3 1 2
29 1 2 2 1 3 6MZ N1 . 13 . N1 1 2
30 1 1 1 1 8 U H3 . 8 . H3 1 2
30 1 2 2 1 3 6MZ H2 . 13 . H2 1 2
31 1 1 1 1 9 C N3 . 9 . N3 1 2
31 1 2 2 1 2 G H1 . 12 . H1 1 2
32 1 1 1 1 9 C O2 . 9 . O2 1 2
32 1 2 2 1 2 G H21 . 12 . H21 1 2
33 1 1 1 1 9 C N3 . 9 . N3 1 2
33 1 2 2 1 2 G H21 . 12 . H21 1 2
34 1 1 1 1 9 C H41 . 9 . H41 1 2
34 1 2 2 1 2 G O6 . 12 . O6 1 2
35 1 1 1 1 10 C N3 . 10 . N3 1 2
35 1 2 2 1 1 G H1 . 11 . H1 1 2
36 1 1 1 1 10 C O2 . 10 . O2 1 2
36 1 2 2 1 1 G H21 . 11 . H21 1 2
37 1 1 1 1 10 C N3 . 10 . N3 1 2
37 1 2 2 1 1 G H21 . 11 . H21 1 2
38 1 1 1 1 10 C H41 . 10 . H41 1 2
38 1 2 2 1 1 G O6 . 11 . O6 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 . . . . . 3.0 2.9 3.1 1 2
4 1 . . . . . 1.7 1.6 1.8 1 2
5 1 . . . . . 1.9 1.8 2.0 1 2
6 1 . . . . . 2.0 1.9 2.1 1 2
7 1 . . . . . 3.0 2.9 3.1 1 2
8 1 . . . . . 1.7 1.6 1.8 1 2
9 1 . . . . . 3.2 3.1 3.3 1 2
10 1 . . . . . 1.9 1.8 2.0 1 2
11 1 . . . . . 2.9 2.8 3.0 1 2
12 1 . . . . . 1.9 1.8 2.0 1 2
13 1 . . . . . 2.0 1.9 2.1 1 2
14 1 . . . . . 3.0 2.9 3.1 1 2
15 1 . . . . . 1.7 1.6 1.8 1 2
16 1 . . . . . 3.2 3.1 3.3 1 2
17 1 . . . . . 1.9 1.8 2.0 1 2
18 1 . . . . . 1.8 1.7 1.9 1 2
19 1 . . . . . 2.9 2.8 3.0 1 2
20 1 . . . . . 3.2 3.1 3.3 1 2
21 1 . . . . . 1.9 1.8 2.0 1 2
22 1 . . . . . 1.8 1.7 1.9 1 2
23 1 . . . . . 2.9 2.8 3.0 1 2
24 1 . . . . . 1.9 1.8 2.0 1 2
25 1 . . . . . 2.0 1.9 2.1 1 2
26 1 . . . . . 3.0 2.9 3.1 1 2
27 1 . . . . . 1.7 1.6 1.8 1 2
28 1 . . . . . 3.2 3.1 3.3 1 2
29 1 . . . . . 1.9 1.8 2.0 1 2
30 1 . . . . . 2.9 2.8 3.0 1 2
31 1 . . . . . 1.9 1.8 2.0 1 2
32 1 . . . . . 2.0 1.9 2.1 1 2
33 1 . . . . . 3.0 2.9 3.1 1 2
34 1 . . . . . 1.7 1.6 1.8 1 2
35 1 . . . . . 1.9 1.8 2.0 1 2
36 1 . . . . . 2.0 1.9 2.1 1 2
37 1 . . . . . 3.0 2.9 3.1 1 2
38 1 . . . . . 1.7 1.6 1.8 1 2
stop_
save_
save_CNS/XPLOR_dihedral_3
_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 C4' 1 1 1 G O4' 1 1 1 G C1' 1 1 1 G C2' -5.0 5.0 . 1 . C4' . 1 . O4' . 1 . C1' . 1 . C2' 1 1
2 . 1 1 1 G O4' 1 1 1 G C1' 1 1 1 G C2' 1 1 1 G C3' -26.999998 -17.0 . 1 . O4' . 1 . C1' . 1 . C2' . 1 . C3' 1 1
3 . 1 1 1 G C1' 1 1 1 G C2' 1 1 1 G C3' 1 1 1 G C4' 30.999998 41.0 . 1 . C1' . 1 . C2' . 1 . C3' . 1 . C4' 1 1
4 . 1 1 1 G C2' 1 1 1 G C3' 1 1 1 G C4' 1 1 1 G O4' -41.0 -30.999998 . 1 . C2' . 1 . C3' . 1 . C4' . 1 . O4' 1 1
5 . 1 1 2 G C4' 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G C2' -5.0 5.0 . 2 . C4' . 2 . O4' . 2 . C1' . 2 . C2' 1 1
6 . 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G C2' 1 1 2 G C3' -26.999998 -17.0 . 2 . O4' . 2 . C1' . 2 . C2' . 2 . C3' 1 1
7 . 1 1 2 G C1' 1 1 2 G C2' 1 1 2 G C3' 1 1 2 G C4' 30.999998 41.0 . 2 . C1' . 2 . C2' . 2 . C3' . 2 . C4' 1 1
8 . 1 1 2 G C2' 1 1 2 G C3' 1 1 2 G C4' 1 1 2 G O4' -41.0 -30.999998 . 2 . C2' . 2 . C3' . 2 . C4' . 2 . O4' 1 1
9 . 1 1 3 6MZ C4' 1 1 3 6MZ O4' 1 1 3 6MZ C1' 1 1 3 6MZ C2' -5.0 5.0 . 3 . C4' . 3 . O4' . 3 . C1' . 3 . C2' 1 1
10 . 1 1 3 6MZ O4' 1 1 3 6MZ C1' 1 1 3 6MZ C2' 1 1 3 6MZ C3' -26.999998 -17.0 . 3 . O4' . 3 . C1' . 3 . C2' . 3 . C3' 1 1
11 . 1 1 3 6MZ C1' 1 1 3 6MZ C2' 1 1 3 6MZ C3' 1 1 3 6MZ C4' 30.999998 41.0 . 3 . C1' . 3 . C2' . 3 . C3' . 3 . C4' 1 1
12 . 1 1 3 6MZ C2' 1 1 3 6MZ C3' 1 1 3 6MZ C4' 1 1 3 6MZ O4' -41.0 -30.999998 . 3 . C2' . 3 . C3' . 3 . C4' . 3 . O4' 1 1
13 . 1 1 4 C C4' 1 1 4 C O4' 1 1 4 C C1' 1 1 4 C C2' -5.0 5.0 . 4 . C4' . 4 . O4' . 4 . C1' . 4 . C2' 1 1
14 . 1 1 4 C O4' 1 1 4 C C1' 1 1 4 C C2' 1 1 4 C C3' -26.999998 -17.0 . 4 . O4' . 4 . C1' . 4 . C2' . 4 . C3' 1 1
15 . 1 1 4 C C1' 1 1 4 C C2' 1 1 4 C C3' 1 1 4 C C4' 30.999998 41.0 . 4 . C1' . 4 . C2' . 4 . C3' . 4 . C4' 1 1
16 . 1 1 4 C C2' 1 1 4 C C3' 1 1 4 C C4' 1 1 4 C O4' -41.0 -30.999998 . 4 . C2' . 4 . C3' . 4 . C4' . 4 . O4' 1 1
17 . 1 1 5 U C4' 1 1 5 U O4' 1 1 5 U C1' 1 1 5 U C2' -5.0 5.0 . 5 . C4' . 5 . O4' . 5 . C1' . 5 . C2' 1 1
18 . 1 1 5 U O4' 1 1 5 U C1' 1 1 5 U C2' 1 1 5 U C3' -26.999998 -17.0 . 5 . O4' . 5 . C1' . 5 . C2' . 5 . C3' 1 1
19 . 1 1 5 U C1' 1 1 5 U C2' 1 1 5 U C3' 1 1 5 U C4' 30.999998 41.0 . 5 . C1' . 5 . C2' . 5 . C3' . 5 . C4' 1 1
20 . 1 1 5 U C2' 1 1 5 U C3' 1 1 5 U C4' 1 1 5 U O4' -41.0 -30.999998 . 5 . C2' . 5 . C3' . 5 . C4' . 5 . O4' 1 1
21 . 1 1 6 A C4' 1 1 6 A O4' 1 1 6 A C1' 1 1 6 A C2' -5.0 5.0 . 6 . C4' . 6 . O4' . 6 . C1' . 6 . C2' 1 1
22 . 1 1 6 A O4' 1 1 6 A C1' 1 1 6 A C2' 1 1 6 A C3' -26.999998 -17.0 . 6 . O4' . 6 . C1' . 6 . C2' . 6 . C3' 1 1
23 . 1 1 6 A C1' 1 1 6 A C2' 1 1 6 A C3' 1 1 6 A C4' 30.999998 41.0 . 6 . C1' . 6 . C2' . 6 . C3' . 6 . C4' 1 1
24 . 1 1 6 A C2' 1 1 6 A C3' 1 1 6 A C4' 1 1 6 A O4' -41.0 -30.999998 . 6 . C2' . 6 . C3' . 6 . C4' . 6 . O4' 1 1
25 . 1 1 7 G C4' 1 1 7 G O4' 1 1 7 G C1' 1 1 7 G C2' -5.0 5.0 . 7 . C4' . 7 . O4' . 7 . C1' . 7 . C2' 1 1
26 . 1 1 7 G O4' 1 1 7 G C1' 1 1 7 G C2' 1 1 7 G C3' -26.999998 -17.0 . 7 . O4' . 7 . C1' . 7 . C2' . 7 . C3' 1 1
27 . 1 1 7 G C1' 1 1 7 G C2' 1 1 7 G C3' 1 1 7 G C4' 30.999998 41.0 . 7 . C1' . 7 . C2' . 7 . C3' . 7 . C4' 1 1
28 . 1 1 7 G C2' 1 1 7 G C3' 1 1 7 G C4' 1 1 7 G O4' -41.0 -30.999998 . 7 . C2' . 7 . C3' . 7 . C4' . 7 . O4' 1 1
29 . 1 1 8 U C4' 1 1 8 U O4' 1 1 8 U C1' 1 1 8 U C2' -5.0 5.0 . 8 . C4' . 8 . O4' . 8 . C1' . 8 . C2' 1 1
30 . 1 1 8 U O4' 1 1 8 U C1' 1 1 8 U C2' 1 1 8 U C3' -26.999998 -17.0 . 8 . O4' . 8 . C1' . 8 . C2' . 8 . C3' 1 1
31 . 1 1 8 U C1' 1 1 8 U C2' 1 1 8 U C3' 1 1 8 U C4' 30.999998 41.0 . 8 . C1' . 8 . C2' . 8 . C3' . 8 . C4' 1 1
32 . 1 1 8 U C2' 1 1 8 U C3' 1 1 8 U C4' 1 1 8 U O4' -41.0 -30.999998 . 8 . C2' . 8 . C3' . 8 . C4' . 8 . O4' 1 1
33 . 1 1 9 C C4' 1 1 9 C O4' 1 1 9 C C1' 1 1 9 C C2' -5.0 5.0 . 9 . C4' . 9 . O4' . 9 . C1' . 9 . C2' 1 1
34 . 1 1 9 C O4' 1 1 9 C C1' 1 1 9 C C2' 1 1 9 C C3' -26.999998 -17.0 . 9 . O4' . 9 . C1' . 9 . C2' . 9 . C3' 1 1
35 . 1 1 9 C C1' 1 1 9 C C2' 1 1 9 C C3' 1 1 9 C C4' 30.999998 41.0 . 9 . C1' . 9 . C2' . 9 . C3' . 9 . C4' 1 1
36 . 1 1 9 C C2' 1 1 9 C C3' 1 1 9 C C4' 1 1 9 C O4' -41.0 -30.999998 . 9 . C2' . 9 . C3' . 9 . C4' . 9 . O4' 1 1
37 . 1 1 10 C C4' 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C C2' -5.0 5.0 . 10 . C4' . 10 . O4' . 10 . C1' . 10 . C2' 1 1
38 . 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C C2' 1 1 10 C C3' -26.999998 -17.0 . 10 . O4' . 10 . C1' . 10 . C2' . 10 . C3' 1 1
39 . 1 1 10 C C1' 1 1 10 C C2' 1 1 10 C C3' 1 1 10 C C4' 30.999998 41.0 . 10 . C1' . 10 . C2' . 10 . C3' . 10 . C4' 1 1
40 . 1 1 10 C C2' 1 1 10 C C3' 1 1 10 C C4' 1 1 10 C O4' -41.0 -30.999998 . 10 . C2' . 10 . C3' . 10 . C4' . 10 . O4' 1 1
41 . 2 1 1 G C4' 2 1 1 G O4' 2 1 1 G C1' 2 1 1 G C2' -5.0 5.0 . 11 . C4' . 11 . O4' . 11 . C1' . 11 . C2' 1 1
42 . 2 1 1 G O4' 2 1 1 G C1' 2 1 1 G C2' 2 1 1 G C3' -26.999998 -17.0 . 11 . O4' . 11 . C1' . 11 . C2' . 11 . C3' 1 1
43 . 2 1 1 G C1' 2 1 1 G C2' 2 1 1 G C3' 2 1 1 G C4' 30.999998 41.0 . 11 . C1' . 11 . C2' . 11 . C3' . 11 . C4' 1 1
44 . 2 1 1 G C2' 2 1 1 G C3' 2 1 1 G C4' 2 1 1 G O4' -41.0 -30.999998 . 11 . C2' . 11 . C3' . 11 . C4' . 11 . O4' 1 1
45 . 2 1 2 G C4' 2 1 2 G O4' 2 1 2 G C1' 2 1 2 G C2' -5.0 5.0 . 12 . C4' . 12 . O4' . 12 . C1' . 12 . C2' 1 1
46 . 2 1 2 G O4' 2 1 2 G C1' 2 1 2 G C2' 2 1 2 G C3' -26.999998 -17.0 . 12 . O4' . 12 . C1' . 12 . C2' . 12 . C3' 1 1
47 . 2 1 2 G C1' 2 1 2 G C2' 2 1 2 G C3' 2 1 2 G C4' 30.999998 41.0 . 12 . C1' . 12 . C2' . 12 . C3' . 12 . C4' 1 1
48 . 2 1 2 G C2' 2 1 2 G C3' 2 1 2 G C4' 2 1 2 G O4' -41.0 -30.999998 . 12 . C2' . 12 . C3' . 12 . C4' . 12 . O4' 1 1
49 . 2 1 3 6MZ C4' 2 1 3 6MZ O4' 2 1 3 6MZ C1' 2 1 3 6MZ C2' -5.0 5.0 . 13 . C4' . 13 . O4' . 13 . C1' . 13 . C2' 1 1
50 . 2 1 3 6MZ O4' 2 1 3 6MZ C1' 2 1 3 6MZ C2' 2 1 3 6MZ C3' -26.999998 -17.0 . 13 . O4' . 13 . C1' . 13 . C2' . 13 . C3' 1 1
51 . 2 1 3 6MZ C1' 2 1 3 6MZ C2' 2 1 3 6MZ C3' 2 1 3 6MZ C4' 30.999998 41.0 . 13 . C1' . 13 . C2' . 13 . C3' . 13 . C4' 1 1
52 . 2 1 3 6MZ C2' 2 1 3 6MZ C3' 2 1 3 6MZ C4' 2 1 3 6MZ O4' -41.0 -30.999998 . 13 . C2' . 13 . C3' . 13 . C4' . 13 . O4' 1 1
53 . 2 1 4 C C4' 2 1 4 C O4' 2 1 4 C C1' 2 1 4 C C2' -5.0 5.0 . 14 . C4' . 14 . O4' . 14 . C1' . 14 . C2' 1 1
54 . 2 1 4 C O4' 2 1 4 C C1' 2 1 4 C C2' 2 1 4 C C3' -26.999998 -17.0 . 14 . O4' . 14 . C1' . 14 . C2' . 14 . C3' 1 1
55 . 2 1 4 C C1' 2 1 4 C C2' 2 1 4 C C3' 2 1 4 C C4' 30.999998 41.0 . 14 . C1' . 14 . C2' . 14 . C3' . 14 . C4' 1 1
56 . 2 1 4 C C2' 2 1 4 C C3' 2 1 4 C C4' 2 1 4 C O4' -41.0 -30.999998 . 14 . C2' . 14 . C3' . 14 . C4' . 14 . O4' 1 1
57 . 2 1 5 U C4' 2 1 5 U O4' 2 1 5 U C1' 2 1 5 U C2' -5.0 5.0 . 15 . C4' . 15 . O4' . 15 . C1' . 15 . C2' 1 1
58 . 2 1 5 U O4' 2 1 5 U C1' 2 1 5 U C2' 2 1 5 U C3' -26.999998 -17.0 . 15 . O4' . 15 . C1' . 15 . C2' . 15 . C3' 1 1
59 . 2 1 5 U C1' 2 1 5 U C2' 2 1 5 U C3' 2 1 5 U C4' 30.999998 41.0 . 15 . C1' . 15 . C2' . 15 . C3' . 15 . C4' 1 1
60 . 2 1 5 U C2' 2 1 5 U C3' 2 1 5 U C4' 2 1 5 U O4' -41.0 -30.999998 . 15 . C2' . 15 . C3' . 15 . C4' . 15 . O4' 1 1
61 . 2 1 6 A C4' 2 1 6 A O4' 2 1 6 A C1' 2 1 6 A C2' -5.0 5.0 . 16 . C4' . 16 . O4' . 16 . C1' . 16 . C2' 1 1
62 . 2 1 6 A O4' 2 1 6 A C1' 2 1 6 A C2' 2 1 6 A C3' -26.999998 -17.0 . 16 . O4' . 16 . C1' . 16 . C2' . 16 . C3' 1 1
63 . 2 1 6 A C1' 2 1 6 A C2' 2 1 6 A C3' 2 1 6 A C4' 30.999998 41.0 . 16 . C1' . 16 . C2' . 16 . C3' . 16 . C4' 1 1
64 . 2 1 6 A C2' 2 1 6 A C3' 2 1 6 A C4' 2 1 6 A O4' -41.0 -30.999998 . 16 . C2' . 16 . C3' . 16 . C4' . 16 . O4' 1 1
65 . 2 1 7 G C4' 2 1 7 G O4' 2 1 7 G C1' 2 1 7 G C2' -5.0 5.0 . 17 . C4' . 17 . O4' . 17 . C1' . 17 . C2' 1 1
66 . 2 1 7 G O4' 2 1 7 G C1' 2 1 7 G C2' 2 1 7 G C3' -26.999998 -17.0 . 17 . O4' . 17 . C1' . 17 . C2' . 17 . C3' 1 1
67 . 2 1 7 G C1' 2 1 7 G C2' 2 1 7 G C3' 2 1 7 G C4' 30.999998 41.0 . 17 . C1' . 17 . C2' . 17 . C3' . 17 . C4' 1 1
68 . 2 1 7 G C2' 2 1 7 G C3' 2 1 7 G C4' 2 1 7 G O4' -41.0 -30.999998 . 17 . C2' . 17 . C3' . 17 . C4' . 17 . O4' 1 1
69 . 2 1 8 U C4' 2 1 8 U O4' 2 1 8 U C1' 2 1 8 U C2' -5.0 5.0 . 18 . C4' . 18 . O4' . 18 . C1' . 18 . C2' 1 1
70 . 2 1 8 U O4' 2 1 8 U C1' 2 1 8 U C2' 2 1 8 U C3' -26.999998 -17.0 . 18 . O4' . 18 . C1' . 18 . C2' . 18 . C3' 1 1
71 . 2 1 8 U C1' 2 1 8 U C2' 2 1 8 U C3' 2 1 8 U C4' 30.999998 41.0 . 18 . C1' . 18 . C2' . 18 . C3' . 18 . C4' 1 1
72 . 2 1 8 U C2' 2 1 8 U C3' 2 1 8 U C4' 2 1 8 U O4' -41.0 -30.999998 . 18 . C2' . 18 . C3' . 18 . C4' . 18 . O4' 1 1
73 . 2 1 9 C C4' 2 1 9 C O4' 2 1 9 C C1' 2 1 9 C C2' -5.0 5.0 . 19 . C4' . 19 . O4' . 19 . C1' . 19 . C2' 1 1
74 . 2 1 9 C O4' 2 1 9 C C1' 2 1 9 C C2' 2 1 9 C C3' -26.999998 -17.0 . 19 . O4' . 19 . C1' . 19 . C2' . 19 . C3' 1 1
75 . 2 1 9 C C1' 2 1 9 C C2' 2 1 9 C C3' 2 1 9 C C4' 30.999998 41.0 . 19 . C1' . 19 . C2' . 19 . C3' . 19 . C4' 1 1
76 . 2 1 9 C C2' 2 1 9 C C3' 2 1 9 C C4' 2 1 9 C O4' -41.0 -30.999998 . 19 . C2' . 19 . C3' . 19 . C4' . 19 . O4' 1 1
77 . 2 1 10 C C4' 2 1 10 C O4' 2 1 10 C C1' 2 1 10 C C2' -5.0 5.0 . 20 . C4' . 20 . O4' . 20 . C1' . 20 . C2' 1 1
78 . 2 1 10 C O4' 2 1 10 C C1' 2 1 10 C C2' 2 1 10 C C3' -26.999998 -17.0 . 20 . O4' . 20 . C1' . 20 . C2' . 20 . C3' 1 1
79 . 2 1 10 C C1' 2 1 10 C C2' 2 1 10 C C3' 2 1 10 C C4' 30.999998 41.0 . 20 . C1' . 20 . C2' . 20 . C3' . 20 . C4' 1 1
80 . 2 1 10 C C2' 2 1 10 C C3' 2 1 10 C C4' 2 1 10 C O4' -41.0 -30.999998 . 20 . C2' . 20 . C3' . 20 . C4' . 20 . O4' 1 1
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 2
_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 2 G P 1 1 2 G O5' 1 1 2 G C5' 1 1 2 G C4' 160.0 200.0 . 2 . P . 2 . O5' . 2 . C5' . 2 . C4' 1 2
2 . 1 1 3 6MZ P 1 1 3 6MZ O5' 1 1 3 6MZ C5' 1 1 3 6MZ C4' 160.0 200.0 . 3 . P . 3 . O5' . 3 . C5' . 3 . C4' 1 2
3 . 1 1 4 C P 1 1 4 C O5' 1 1 4 C C5' 1 1 4 C C4' 160.0 200.0 . 4 . P . 4 . O5' . 4 . C5' . 4 . C4' 1 2
4 . 1 1 5 U P 1 1 5 U O5' 1 1 5 U C5' 1 1 5 U C4' 160.0 200.0 . 5 . P . 5 . O5' . 5 . C5' . 5 . C4' 1 2
5 . 1 1 6 A P 1 1 6 A O5' 1 1 6 A C5' 1 1 6 A C4' 160.0 200.0 . 6 . P . 6 . O5' . 6 . C5' . 6 . C4' 1 2
6 . 1 1 7 G P 1 1 7 G O5' 1 1 7 G C5' 1 1 7 G C4' 160.0 200.0 . 7 . P . 7 . O5' . 7 . C5' . 7 . C4' 1 2
7 . 1 1 8 U P 1 1 8 U O5' 1 1 8 U C5' 1 1 8 U C4' 160.0 200.0 . 8 . P . 8 . O5' . 8 . C5' . 8 . C4' 1 2
8 . 1 1 9 C P 1 1 9 C O5' 1 1 9 C C5' 1 1 9 C C4' 160.0 200.0 . 9 . P . 9 . O5' . 9 . C5' . 9 . C4' 1 2
9 . 1 1 10 C P 1 1 10 C O5' 1 1 10 C C5' 1 1 10 C C4' 160.0 200.0 . 10 . P . 10 . O5' . 10 . C5' . 10 . C4' 1 2
10 . 2 1 2 G P 2 1 2 G O5' 2 1 2 G C5' 2 1 2 G C4' 160.0 200.0 . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' 1 2
11 . 2 1 3 6MZ P 2 1 3 6MZ O5' 2 1 3 6MZ C5' 2 1 3 6MZ C4' 160.0 200.0 . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' 1 2
12 . 2 1 4 C P 2 1 4 C O5' 2 1 4 C C5' 2 1 4 C C4' 160.0 200.0 . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' 1 2
13 . 2 1 5 U P 2 1 5 U O5' 2 1 5 U C5' 2 1 5 U C4' 160.0 200.0 . 15 . P . 15 . O5' . 15 . C5' . 15 . C4' 1 2
14 . 2 1 6 A P 2 1 6 A O5' 2 1 6 A C5' 2 1 6 A C4' 160.0 200.0 . 16 . P . 16 . O5' . 16 . C5' . 16 . C4' 1 2
15 . 2 1 7 G P 2 1 7 G O5' 2 1 7 G C5' 2 1 7 G C4' 160.0 200.0 . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' 1 2
16 . 2 1 8 U P 2 1 8 U O5' 2 1 8 U C5' 2 1 8 U C4' 160.0 200.0 . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' 1 2
17 . 2 1 9 C P 2 1 9 C O5' 2 1 9 C C5' 2 1 9 C C4' 160.0 200.0 . 19 . P . 19 . O5' . 19 . C5' . 19 . C4' 1 2
18 . 2 1 10 C P 2 1 10 C O5' 2 1 10 C C5' 2 1 10 C C4' 160.0 200.0 . 20 . P . 20 . O5' . 20 . C5' . 20 . C4' 1 2
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 3
_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 O5' 1 1 1 G C5' 1 1 1 G C4' 1 1 1 G C3' 35.0 75.0 . 1 . O5' . 1 . C5' . 1 . C4' . 1 . C3' 1 3
2 . 1 1 2 G O5' 1 1 2 G C5' 1 1 2 G C4' 1 1 2 G C3' 35.0 75.0 . 2 . O5' . 2 . C5' . 2 . C4' . 2 . C3' 1 3
3 . 1 1 3 6MZ O5' 1 1 3 6MZ C5' 1 1 3 6MZ C4' 1 1 3 6MZ C3' 35.0 75.0 . 3 . O5' . 3 . C5' . 3 . C4' . 3 . C3' 1 3
4 . 1 1 4 C O5' 1 1 4 C C5' 1 1 4 C C4' 1 1 4 C C3' 35.0 75.0 . 4 . O5' . 4 . C5' . 4 . C4' . 4 . C3' 1 3
5 . 1 1 5 U O5' 1 1 5 U C5' 1 1 5 U C4' 1 1 5 U C3' 35.0 75.0 . 5 . O5' . 5 . C5' . 5 . C4' . 5 . C3' 1 3
6 . 1 1 6 A O5' 1 1 6 A C5' 1 1 6 A C4' 1 1 6 A C3' 35.0 75.0 . 6 . O5' . 6 . C5' . 6 . C4' . 6 . C3' 1 3
7 . 1 1 7 G O5' 1 1 7 G C5' 1 1 7 G C4' 1 1 7 G C3' 35.0 75.0 . 7 . O5' . 7 . C5' . 7 . C4' . 7 . C3' 1 3
8 . 1 1 8 U O5' 1 1 8 U C5' 1 1 8 U C4' 1 1 8 U C3' 35.0 75.0 . 8 . O5' . 8 . C5' . 8 . C4' . 8 . C3' 1 3
9 . 1 1 9 C O5' 1 1 9 C C5' 1 1 9 C C4' 1 1 9 C C3' 35.0 75.0 . 9 . O5' . 9 . C5' . 9 . C4' . 9 . C3' 1 3
10 . 1 1 10 C O5' 1 1 10 C C5' 1 1 10 C C4' 1 1 10 C C3' 35.0 75.0 . 10 . O5' . 10 . C5' . 10 . C4' . 10 . C3' 1 3
11 . 2 1 1 G O5' 2 1 1 G C5' 2 1 1 G C4' 2 1 1 G C3' 35.0 75.0 . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' 1 3
12 . 2 1 2 G O5' 2 1 2 G C5' 2 1 2 G C4' 2 1 2 G C3' 35.0 75.0 . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' 1 3
13 . 2 1 3 6MZ O5' 2 1 3 6MZ C5' 2 1 3 6MZ C4' 2 1 3 6MZ C3' 35.0 75.0 . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' 1 3
14 . 2 1 4 C O5' 2 1 4 C C5' 2 1 4 C C4' 2 1 4 C C3' 35.0 75.0 . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' 1 3
15 . 2 1 5 U O5' 2 1 5 U C5' 2 1 5 U C4' 2 1 5 U C3' 35.0 75.0 . 15 . O5' . 15 . C5' . 15 . C4' . 15 . C3' 1 3
16 . 2 1 6 A O5' 2 1 6 A C5' 2 1 6 A C4' 2 1 6 A C3' 160.0 200.0 . 16 . O5' . 16 . C5' . 16 . C4' . 16 . C3' 1 3
17 . 2 1 7 G O5' 2 1 7 G C5' 2 1 7 G C4' 2 1 7 G C3' 35.0 75.0 . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' 1 3
18 . 2 1 8 U O5' 2 1 8 U C5' 2 1 8 U C4' 2 1 8 U C3' 35.0 75.0 . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' 1 3
19 . 2 1 9 C O5' 2 1 9 C C5' 2 1 9 C C4' 2 1 9 C C3' 35.0 75.0 . 19 . O5' . 19 . C5' . 19 . C4' . 19 . C3' 1 3
20 . 2 1 10 C O5' 2 1 10 C C5' 2 1 10 C C4' 2 1 10 C C3' 35.0 75.0 . 20 . O5' . 20 . C5' . 20 . C4' . 20 . C3' 1 3
stop_
save_
save_CNS/XPLOR_dihedral_7
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 4
_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 C4' 1 1 1 G C3' 1 1 1 G O3' 1 1 2 G P -174.99998 -135.0 . 1 . C4' . 1 . C3' . 1 . O3' . 2 . P 1 4
2 . 1 1 2 G C4' 1 1 2 G C3' 1 1 2 G O3' 1 1 3 6MZ P -174.99998 -135.0 . 2 . C4' . 2 . C3' . 2 . O3' . 3 . P 1 4
3 . 1 1 3 6MZ C4' 1 1 3 6MZ C3' 1 1 3 6MZ O3' 1 1 4 C P -174.99998 -135.0 . 3 . C4' . 3 . C3' . 3 . O3' . 4 . P 1 4
4 . 1 1 4 C C4' 1 1 4 C C3' 1 1 4 C O3' 1 1 5 U P -174.99998 -135.0 . 4 . C4' . 4 . C3' . 4 . O3' . 5 . P 1 4
5 . 1 1 5 U C4' 1 1 5 U C3' 1 1 5 U O3' 1 1 6 A P -174.99998 -135.0 . 5 . C4' . 5 . C3' . 5 . O3' . 6 . P 1 4
6 . 1 1 6 A C4' 1 1 6 A C3' 1 1 6 A O3' 1 1 7 G P -174.99998 -135.0 . 6 . C4' . 6 . C3' . 6 . O3' . 7 . P 1 4
7 . 1 1 7 G C4' 1 1 7 G C3' 1 1 7 G O3' 1 1 8 U P -174.99998 -135.0 . 7 . C4' . 7 . C3' . 7 . O3' . 8 . P 1 4
8 . 1 1 8 U C4' 1 1 8 U C3' 1 1 8 U O3' 1 1 9 C P -174.99998 -135.0 . 8 . C4' . 8 . C3' . 8 . O3' . 9 . P 1 4
9 . 1 1 9 C C4' 1 1 9 C C3' 1 1 9 C O3' 1 1 10 C P -174.99998 -135.0 . 9 . C4' . 9 . C3' . 9 . O3' . 10 . P 1 4
10 . 2 1 1 G C4' 2 1 1 G C3' 2 1 1 G O3' 2 1 2 G P -174.99998 -135.0 . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P 1 4
11 . 2 1 2 G C4' 2 1 2 G C3' 2 1 2 G O3' 2 1 3 6MZ P -174.99998 -135.0 . 12 . C4' . 12 . C3' . 12 . O3' . 13 . P 1 4
12 . 2 1 3 6MZ C4' 2 1 3 6MZ C3' 2 1 3 6MZ O3' 2 1 4 C P -174.99998 -135.0 . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P 1 4
13 . 2 1 4 C C4' 2 1 4 C C3' 2 1 4 C O3' 2 1 5 U P -115.00001 -75.0 . 14 . C4' . 14 . C3' . 14 . O3' . 15 . P 1 4
14 . 2 1 5 U C4' 2 1 5 U C3' 2 1 5 U O3' 2 1 6 A P -174.99998 -135.0 . 15 . C4' . 15 . C3' . 15 . O3' . 16 . P 1 4
15 . 2 1 6 A C4' 2 1 6 A C3' 2 1 6 A O3' 2 1 7 G P -174.99998 -135.0 . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P 1 4
16 . 2 1 7 G C4' 2 1 7 G C3' 2 1 7 G O3' 2 1 8 U P -174.99998 -135.0 . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P 1 4
17 . 2 1 8 U C4' 2 1 8 U C3' 2 1 8 U O3' 2 1 9 C P -174.99998 -135.0 . 18 . C4' . 18 . C3' . 18 . O3' . 19 . P 1 4
18 . 2 1 9 C C4' 2 1 9 C C3' 2 1 9 C O3' 2 1 10 C P -174.99998 -135.0 . 19 . C4' . 19 . C3' . 19 . O3' . 20 . P 1 4
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 5
_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 O4' 1 1 1 G C1' 1 1 1 G N9 1 1 1 G C4 -179.99998 -40.0 . 1 . O4' . 1 . C1' . 1 . N9 . 1 . C4 1 5
2 . 1 1 2 G O4' 1 1 2 G C1' 1 1 2 G N9 1 1 2 G C4 -179.99998 -40.0 . 2 . O4' . 2 . C1' . 2 . N9 . 2 . C4 1 5
3 . 1 1 3 6MZ O4' 1 1 3 6MZ C1' 1 1 3 6MZ N9 1 1 3 6MZ C4 -179.99998 -40.0 . 3 . O4' . 3 . C1' . 3 . N9 . 3 . C4 1 5
4 . 1 1 4 C O4' 1 1 4 C C1' 1 1 4 C N1 1 1 4 C C2 -179.99998 -40.0 . 4 . O4' . 4 . C1' . 4 . N1 . 4 . C2 1 5
5 . 1 1 5 U O4' 1 1 5 U C1' 1 1 5 U N1 1 1 5 U C2 -179.99998 -40.0 . 5 . O4' . 5 . C1' . 5 . N1 . 5 . C2 1 5
6 . 1 1 6 A O4' 1 1 6 A C1' 1 1 6 A N9 1 1 6 A C4 -179.99998 -40.0 . 6 . O4' . 6 . C1' . 6 . N9 . 6 . C4 1 5
7 . 1 1 7 G O4' 1 1 7 G C1' 1 1 7 G N9 1 1 7 G C4 -179.99998 -80.0 . 7 . O4' . 7 . C1' . 7 . N9 . 7 . C4 1 5
8 . 1 1 8 U O4' 1 1 8 U C1' 1 1 8 U N1 1 1 8 U C2 -179.99998 -40.0 . 8 . O4' . 8 . C1' . 8 . N1 . 8 . C2 1 5
9 . 1 1 9 C O4' 1 1 9 C C1' 1 1 9 C N1 1 1 9 C C2 -179.99998 -40.0 . 9 . O4' . 9 . C1' . 9 . N1 . 9 . C2 1 5
10 . 1 1 10 C O4' 1 1 10 C C1' 1 1 10 C N1 1 1 10 C C2 -179.99998 -40.0 . 10 . O4' . 10 . C1' . 10 . N1 . 10 . C2 1 5
11 . 2 1 1 G O4' 2 1 1 G C1' 2 1 1 G N9 2 1 1 G C4 -179.99998 -40.0 . 11 . O4' . 11 . C1' . 11 . N9 . 11 . C4 1 5
12 . 2 1 2 G O4' 2 1 2 G C1' 2 1 2 G N9 2 1 2 G C4 -179.99998 -40.0 . 12 . O4' . 12 . C1' . 12 . N9 . 12 . C4 1 5
13 . 2 1 3 6MZ O4' 2 1 3 6MZ C1' 2 1 3 6MZ N9 2 1 3 6MZ C4 -179.99998 -40.0 . 13 . O4' . 13 . C1' . 13 . N9 . 13 . C4 1 5
14 . 2 1 4 C O4' 2 1 4 C C1' 2 1 4 C N1 2 1 4 C C2 -179.99998 -40.0 . 14 . O4' . 14 . C1' . 14 . N1 . 14 . C2 1 5
15 . 2 1 5 U O4' 2 1 5 U C1' 2 1 5 U N1 2 1 5 U C2 -179.99998 -40.0 . 15 . O4' . 15 . C1' . 15 . N1 . 15 . C2 1 5
16 . 2 1 6 A O4' 2 1 6 A C1' 2 1 6 A N9 2 1 6 A C4 -179.99998 -40.0 . 16 . O4' . 16 . C1' . 16 . N9 . 16 . C4 1 5
17 . 2 1 7 G O4' 2 1 7 G C1' 2 1 7 G N9 2 1 7 G C4 -179.99998 -80.0 . 17 . O4' . 17 . C1' . 17 . N9 . 17 . C4 1 5
18 . 2 1 8 U O4' 2 1 8 U C1' 2 1 8 U N1 2 1 8 U C2 -179.99998 -40.0 . 18 . O4' . 18 . C1' . 18 . N1 . 18 . C2 1 5
19 . 2 1 9 C O4' 2 1 9 C C1' 2 1 9 C N1 2 1 9 C C2 -179.99998 -40.0 . 19 . O4' . 19 . C1' . 19 . N1 . 19 . C2 1 5
20 . 2 1 10 C O4' 2 1 10 C C1' 2 1 10 C N1 2 1 10 C C2 -179.99998 -40.0 . 20 . O4' . 20 . C1' . 20 . N1 . 20 . C2 1 5
stop_
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 6
_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 . 1 . H22 . 1 . N2 . 1 . C2 . 1 . N3 1 6
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 . 2 . H22 . 2 . N2 . 2 . C2 . 2 . N3 1 6
3 . 1 1 4 C H42 1 1 4 C N4 1 1 4 C C4 1 1 4 C C5 -5.0 5.0 . 4 . H42 . 4 . N4 . 4 . C4 . 4 . C5 1 6
4 . 1 1 6 A H62 1 1 6 A N6 1 1 6 A C6 1 1 6 A C5 -5.0 5.0 . 6 . H62 . 6 . N6 . 6 . C6 . 6 . C5 1 6
5 . 1 1 7 G H22 1 1 7 G N2 1 1 7 G C2 1 1 7 G N3 -5.0 5.0 . 7 . H22 . 7 . N2 . 7 . C2 . 7 . N3 1 6
6 . 1 1 9 C H42 1 1 9 C N4 1 1 9 C C4 1 1 9 C C5 -5.0 5.0 . 9 . H42 . 9 . N4 . 9 . C4 . 9 . C5 1 6
7 . 1 1 10 C H42 1 1 10 C N4 1 1 10 C C4 1 1 10 C C5 -5.0 5.0 . 10 . H42 . 10 . N4 . 10 . C4 . 10 . C5 1 6
8 . 2 1 1 G H22 2 1 1 G N2 2 1 1 G C2 2 1 1 G N3 -5.0 5.0 . 11 . H22 . 11 . N2 . 11 . C2 . 11 . N3 1 6
9 . 2 1 2 G H22 2 1 2 G N2 2 1 2 G C2 2 1 2 G N3 -5.0 5.0 . 12 . H22 . 12 . N2 . 12 . C2 . 12 . N3 1 6
10 . 2 1 4 C H42 2 1 4 C N4 2 1 4 C C4 2 1 4 C C5 -5.0 5.0 . 14 . H42 . 14 . N4 . 14 . C4 . 14 . C5 1 6
11 . 2 1 6 A H62 2 1 6 A N6 2 1 6 A C6 2 1 6 A C5 -5.0 5.0 . 16 . H62 . 16 . N6 . 16 . C6 . 16 . C5 1 6
12 . 2 1 7 G H22 2 1 7 G N2 2 1 7 G C2 2 1 7 G N3 -5.0 5.0 . 17 . H22 . 17 . N2 . 17 . C2 . 17 . N3 1 6
13 . 2 1 9 C H42 2 1 9 C N4 2 1 9 C C4 2 1 9 C C5 -5.0 5.0 . 19 . H42 . 19 . N4 . 19 . C4 . 19 . C5 1 6
14 . 2 1 10 C H42 2 1 10 C N4 2 1 10 C C4 2 1 10 C C5 -5.0 5.0 . 20 . H42 . 20 . N4 . 20 . C4 . 20 . C5 1 6
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 11.974 -0.065 -9.146 1.00 . A 1 . 1 G C1' 1 1
1 2 1 1 1 G C2 C 12.644 2.252 -5.528 1.00 . A 1 . 1 G C2 1 1
1 3 1 1 1 G C2' C 11.034 -1.010 -8.399 1.00 . A 1 . 1 G C2' 1 1
1 4 1 1 1 G C3' C 9.911 -1.200 -9.406 1.00 . A 1 . 1 G C3' 1 1
1 5 1 1 1 G C4 C 11.968 1.971 -7.635 1.00 . A 1 . 1 G C4 1 1
1 6 1 1 1 G C4' C 10.634 -1.184 -10.742 1.00 . A 1 . 1 G C4' 1 1
1 7 1 1 1 G C5 C 11.565 3.275 -7.789 1.00 . A 1 . 1 G C5 1 1
1 8 1 1 1 G C5' C 9.791 -0.700 -11.917 1.00 . A 1 . 1 G C5' 1 1
1 9 1 1 1 G C6 C 11.707 4.185 -6.706 1.00 . A 1 . 1 G C6 1 1
1 10 1 1 1 G C8 C 11.161 2.317 -9.641 1.00 . A 1 . 1 G C8 1 1
1 11 1 1 1 G H1 H 12.405 4.148 -4.776 1.00 . A 1 . 1 G H1 1 1
1 12 1 1 1 G H1' H 13.016 -0.294 -8.922 1.00 . A 1 . 1 G H1' 1 1
1 13 1 1 1 G H2' H 10.664 -0.551 -7.482 1.00 . A 1 . 1 G H2' 1 1
1 14 1 1 1 G H21 H 13.312 2.483 -3.619 1.00 . A 1 . 1 G H21 1 1
1 15 1 1 1 G H22 H 13.418 0.859 -4.261 1.00 . A 1 . 1 G H22 1 1
1 16 1 1 1 G H3' H 9.128 -0.447 -9.328 1.00 . A 1 . 1 G H3' 1 1
1 17 1 1 1 G H4' H 11.029 -2.173 -10.976 1.00 . A 1 . 1 G H4' 1 1
1 18 1 1 1 G H5' H 10.389 -0.745 -12.827 1.00 . A 1 . 1 G H5' 1 1
1 19 1 1 1 G H5'' H 8.925 -1.353 -12.027 1.00 . A 1 . 1 G H5'' 1 1
1 20 1 1 1 G H8 H 10.846 2.128 -10.667 1.00 . A 1 . 1 G H8 1 1
1 21 1 1 1 G HO2' H 11.262 -2.922 -8.678 1.00 . A 1 . 1 G HO2' 1 1
1 22 1 1 1 G HO5' H 8.409 0.602 -11.490 1.00 . A 1 . 1 G HO5' 1 1
1 23 1 1 1 G N1 N 12.267 3.574 -5.595 1.00 . A 1 . 1 G N1 1 1
1 24 1 1 1 G N2 N 13.167 1.830 -4.376 1.00 . A 1 . 1 G N2 1 1
1 25 1 1 1 G N3 N 12.514 1.388 -6.539 1.00 . A 1 . 1 G N3 1 1
1 26 1 1 1 G N7 N 11.054 3.482 -9.066 1.00 . A 1 . 1 G N7 1 1
1 27 1 1 1 G N9 N 11.706 1.351 -8.834 1.00 . A 1 . 1 G N9 1 1
1 28 1 1 1 G O2' O 11.683 -2.256 -8.130 1.00 . A 1 . 1 G O2' 1 1
1 29 1 1 1 G O3' O 9.400 -2.523 -9.221 1.00 . A 1 . 1 G O3' 1 1
1 30 1 1 1 G O4' O 11.727 -0.281 -10.545 1.00 . A 1 . 1 G O4' 1 1
1 31 1 1 1 G O5' O 9.340 0.644 -11.722 1.00 . A 1 . 1 G O5' 1 1
1 32 1 1 1 G O6 O 11.404 5.376 -6.666 1.00 . A 1 . 1 G O6 1 1
1 33 1 1 2 G C1' C 10.384 -1.132 -3.901 1.00 . A 1 . 2 G C1' 1 1
1 34 1 1 2 G C2 C 10.535 2.945 -2.397 1.00 . A 1 . 2 G C2 1 1
1 35 1 1 2 G C2' C 9.274 -1.775 -3.071 1.00 . A 1 . 2 G C2' 1 1
1 36 1 1 2 G C3' C 8.615 -2.696 -4.085 1.00 . A 1 . 2 G C3' 1 1
1 37 1 1 2 G C4 C 10.065 1.383 -3.919 1.00 . A 1 . 2 G C4 1 1
1 38 1 1 2 G C4' C 9.781 -3.173 -4.934 1.00 . A 1 . 2 G C4' 1 1
1 39 1 1 2 G C5 C 9.557 2.276 -4.831 1.00 . A 1 . 2 G C5 1 1
1 40 1 1 2 G C5' C 9.415 -3.546 -6.367 1.00 . A 1 . 2 G C5' 1 1
1 41 1 1 2 G C6 C 9.525 3.661 -4.512 1.00 . A 1 . 2 G C6 1 1
1 42 1 1 2 G C8 C 9.399 0.363 -5.738 1.00 . A 1 . 2 G C8 1 1
1 43 1 1 2 G H1 H 10.060 4.868 -2.940 1.00 . A 1 . 2 G H1 1 1
1 44 1 1 2 G H1' H 11.277 -0.968 -3.298 1.00 . A 1 . 2 G H1' 1 1
1 45 1 1 2 G H2' H 8.572 -1.025 -2.709 1.00 . A 1 . 2 G H2' 1 1
1 46 1 1 2 G H21 H 10.935 4.338 -0.968 1.00 . A 1 . 2 G H21 1 1
1 47 1 1 2 G H22 H 11.409 2.700 -0.575 1.00 . A 1 . 2 G H22 1 1
1 48 1 1 2 G H3' H 7.828 -2.211 -4.662 1.00 . A 1 . 2 G H3' 1 1
1 49 1 1 2 G H4' H 10.274 -4.023 -4.463 1.00 . A 1 . 2 G H4' 1 1
1 50 1 1 2 G H5' H 10.311 -3.501 -6.986 1.00 . A 1 . 2 G H5' 1 1
1 51 1 1 2 G H5'' H 9.023 -4.563 -6.381 1.00 . A 1 . 2 G H5'' 1 1
1 52 1 1 2 G H8 H 9.189 -0.438 -6.447 1.00 . A 1 . 2 G H8 1 1
1 53 1 1 2 G HO2' H 9.200 -2.496 -1.267 1.00 . A 1 . 2 G HO2' 1 1
1 54 1 1 2 G N1 N 10.044 3.907 -3.250 1.00 . A 1 . 2 G N1 1 1
1 55 1 1 2 G N2 N 10.997 3.361 -1.218 1.00 . A 1 . 2 G N2 1 1
1 56 1 1 2 G N3 N 10.570 1.641 -2.687 1.00 . A 1 . 2 G N3 1 1
1 57 1 1 2 G N7 N 9.138 1.617 -5.981 1.00 . A 1 . 2 G N7 1 1
1 58 1 1 2 G N9 N 9.962 0.145 -4.507 1.00 . A 1 . 2 G N9 1 1
1 59 1 1 2 G O2' O 9.828 -2.532 -1.992 1.00 . A 1 . 2 G O2' 1 1
1 60 1 1 2 G O3' O 8.126 -3.831 -3.366 1.00 . A 1 . 2 G O3' 1 1
1 61 1 1 2 G O4' O 10.685 -2.063 -4.954 1.00 . A 1 . 2 G O4' 1 1
1 62 1 1 2 G O5' O 8.430 -2.660 -6.906 1.00 . A 1 . 2 G O5' 1 1
1 63 1 1 2 G O6 O 9.110 4.592 -5.198 1.00 . A 1 . 2 G O6 1 1
1 64 1 1 2 G OP1 O 7.555 -4.143 -8.725 1.00 . A 1 . 2 G OP1 1 1
1 65 1 1 2 G OP2 O 7.108 -1.620 -8.762 1.00 . A 1 . 2 G OP2 1 1
1 66 1 1 2 G P P 8.003 -2.759 -8.455 1.00 . A 1 . 2 G P 1 1
1 67 1 1 3 6MZ C1' C 7.584 0.214 0.200 1.00 . A 1 . 3 6MZ C1' 1 1
1 68 1 1 3 6MZ C2 C 7.481 4.334 -1.157 1.00 . A 1 . 3 6MZ C2 1 1
1 69 1 1 3 6MZ C2' C 6.390 0.082 1.143 1.00 . A 1 . 3 6MZ C2' 1 1
1 70 1 1 3 6MZ C3' C 5.902 -1.325 0.842 1.00 . A 1 . 3 6MZ C3' 1 1
1 71 1 1 3 6MZ C4 C 7.229 2.164 -1.381 1.00 . A 1 . 3 6MZ C4 1 1
1 72 1 1 3 6MZ C4' C 7.186 -2.089 0.567 1.00 . A 1 . 3 6MZ C4' 1 1
1 73 1 1 3 6MZ C5 C 6.814 2.278 -2.677 1.00 . A 1 . 3 6MZ C5 1 1
1 74 1 1 3 6MZ C5' C 7.031 -3.281 -0.371 1.00 . A 1 . 3 6MZ C5' 1 1
1 75 1 1 3 6MZ C6 C 6.750 3.577 -3.204 1.00 . A 1 . 3 6MZ C6 1 1
1 76 1 1 3 6MZ C8 C 6.786 0.201 -2.240 1.00 . A 1 . 3 6MZ C8 1 1
1 77 1 1 3 6MZ C9 C 5.927 2.831 -5.277 1.00 . A 1 . 3 6MZ C9 1 1
1 78 1 1 3 6MZ H1' H 8.381 0.799 0.658 1.00 . A 1 . 3 6MZ H1' 1 1
1 79 1 1 3 6MZ H2 H 7.749 5.203 -0.556 1.00 . A 1 . 3 6MZ H2 1 1
1 80 1 1 3 6MZ H2' H 5.623 0.821 0.910 1.00 . A 1 . 3 6MZ H2' 1 1
1 81 1 1 3 6MZ H3' H 5.188 -1.368 0.020 1.00 . A 1 . 3 6MZ H3' 1 1
1 82 1 1 3 6MZ H4' H 7.635 -2.430 1.500 1.00 . A 1 . 3 6MZ H4' 1 1
1 83 1 1 3 6MZ H5'1 H 7.998 -3.769 -0.490 1.00 . A 1 . 3 6MZ H5'1 1 1
1 84 1 1 3 6MZ H5'2 H 6.327 -3.989 0.067 1.00 . A 1 . 3 6MZ H5'2 1 1
1 85 1 1 3 6MZ H6 H 6.393 4.800 -4.792 1.00 . A 1 . 3 6MZ H6 1 1
1 86 1 1 3 6MZ H8 H 6.669 -0.879 -2.326 1.00 . A 1 . 3 6MZ H8 1 1
1 87 1 1 3 6MZ H9 H 5.715 1.944 -4.680 1.00 . A 1 . 3 6MZ H9 1 1
1 88 1 1 3 6MZ H9C1 H 6.700 2.599 -6.009 1.00 . A 1 . 3 6MZ H9C1 1 1
1 89 1 1 3 6MZ H9C2 H 5.020 3.146 -5.794 1.00 . A 1 . 3 6MZ H9C2 1 1
1 90 1 1 3 6MZ HA H 7.551 0.800 2.529 1.00 . A 1 . 3 6MZ HA 1 1
1 91 1 1 3 6MZ N1 N 7.096 4.595 -2.400 1.00 . A 1 . 3 6MZ N1 1 1
1 92 1 1 3 6MZ N3 N 7.584 3.163 -0.545 1.00 . A 1 . 3 6MZ N3 1 1
1 93 1 1 3 6MZ N6 N 6.365 3.849 -4.451 1.00 . A 1 . 3 6MZ N6 1 1
1 94 1 1 3 6MZ N7 N 6.535 1.027 -3.218 1.00 . A 1 . 3 6MZ N7 1 1
1 95 1 1 3 6MZ N9 N 7.212 0.821 -1.092 1.00 . A 1 . 3 6MZ N9 1 1
1 96 1 1 3 6MZ O1P O 6.321 -5.265 -2.386 1.00 . A 1 . 3 6MZ O1P 1 1
1 97 1 1 3 6MZ O2' O 6.813 0.186 2.505 1.00 . A 1 . 3 6MZ O2' 1 1
1 98 1 1 3 6MZ O2P O 5.748 -3.345 -3.984 1.00 . A 1 . 3 6MZ O2P 1 1
1 99 1 1 3 6MZ O3' O 5.353 -1.848 2.054 1.00 . A 1 . 3 6MZ O3' 1 1
1 100 1 1 3 6MZ O4' O 8.052 -1.123 -0.040 1.00 . A 1 . 3 6MZ O4' 1 1
1 101 1 1 3 6MZ O5' O 6.549 -2.880 -1.656 1.00 . A 1 . 3 6MZ O5' 1 1
1 102 1 1 3 6MZ P P 6.587 -3.902 -2.899 1.00 . A 1 . 3 6MZ P 1 1
1 103 1 1 4 C C1' C 4.787 3.685 2.248 1.00 . A 1 . 4 C C1' 1 1
1 104 1 1 4 C C2 C 4.509 4.344 -0.091 1.00 . A 1 . 4 C C2 1 1
1 105 1 1 4 C C2' C 3.604 4.057 3.140 1.00 . A 1 . 4 C C2' 1 1
1 106 1 1 4 C C3' C 3.251 2.721 3.771 1.00 . A 1 . 4 C C3' 1 1
1 107 1 1 4 C C4 C 3.633 2.864 -1.689 1.00 . A 1 . 4 C C4 1 1
1 108 1 1 4 C C4' C 4.602 2.049 3.946 1.00 . A 1 . 4 C C4' 1 1
1 109 1 1 4 C C5 C 3.487 1.842 -0.699 1.00 . A 1 . 4 C C5 1 1
1 110 1 1 4 C C5' C 4.564 0.524 3.924 1.00 . A 1 . 4 C C5' 1 1
1 111 1 1 4 C C6 C 3.865 2.130 0.561 1.00 . A 1 . 4 C C6 1 1
1 112 1 1 4 C H1' H 5.524 4.488 2.221 1.00 . A 1 . 4 C H1' 1 1
1 113 1 1 4 C H2' H 2.774 4.443 2.549 1.00 . A 1 . 4 C H2' 1 1
1 114 1 1 4 C H3' H 2.549 2.134 3.178 1.00 . A 1 . 4 C H3' 1 1
1 115 1 1 4 C H4' H 5.074 2.376 4.873 1.00 . A 1 . 4 C H4' 1 1
1 116 1 1 4 C H41 H 3.448 3.364 -3.653 1.00 . A 1 . 4 C H41 1 1
1 117 1 1 4 C H42 H 2.844 1.780 -3.220 1.00 . A 1 . 4 C H42 1 1
1 118 1 1 4 C H5 H 3.084 0.860 -0.947 1.00 . A 1 . 4 C H5 1 1
1 119 1 1 4 C H5' H 5.585 0.143 3.899 1.00 . A 1 . 4 C H5' 1 1
1 120 1 1 4 C H5'' H 4.073 0.167 4.829 1.00 . A 1 . 4 C H5'' 1 1
1 121 1 1 4 C H6 H 3.767 1.373 1.340 1.00 . A 1 . 4 C H6 1 1
1 122 1 1 4 C HO2' H 3.284 5.617 4.258 1.00 . A 1 . 4 C HO2' 1 1
1 123 1 1 4 C N1 N 4.370 3.358 0.872 1.00 . A 1 . 4 C N1 1 1
1 124 1 1 4 C N3 N 4.130 4.067 -1.370 1.00 . A 1 . 4 C N3 1 1
1 125 1 1 4 C N4 N 3.280 2.652 -2.957 1.00 . A 1 . 4 C N4 1 1
1 126 1 1 4 C O2 O 4.966 5.444 0.212 1.00 . A 1 . 4 C O2 1 1
1 127 1 1 4 C O2' O 4.006 4.995 4.143 1.00 . A 1 . 4 C O2' 1 1
1 128 1 1 4 C O3' O 2.744 2.994 5.080 1.00 . A 1 . 4 C O3' 1 1
1 129 1 1 4 C O4' O 5.379 2.516 2.838 1.00 . A 1 . 4 C O4' 1 1
1 130 1 1 4 C O5' O 3.854 0.033 2.783 1.00 . A 1 . 4 C O5' 1 1
1 131 1 1 4 C OP1 O 3.521 -2.270 3.709 1.00 . A 1 . 4 C OP1 1 1
1 132 1 1 4 C OP2 O 2.979 -1.752 1.259 1.00 . A 1 . 4 C OP2 1 1
1 133 1 1 4 C P P 3.824 -1.543 2.456 1.00 . A 1 . 4 C P 1 1
1 134 1 1 5 U C1' C 0.870 7.615 2.748 1.00 . A 1 . 5 U C1' 1 1
1 135 1 1 5 U C2 C 0.552 7.065 0.390 1.00 . A 1 . 5 U C2 1 1
1 136 1 1 5 U C2' C -0.452 8.026 3.396 1.00 . A 1 . 5 U C2' 1 1
1 137 1 1 5 U C3' C -0.533 7.076 4.579 1.00 . A 1 . 5 U C3' 1 1
1 138 1 1 5 U C4 C 0.328 4.730 -0.364 1.00 . A 1 . 5 U C4 1 1
1 139 1 1 5 U C4' C 0.916 6.934 5.013 1.00 . A 1 . 5 U C4' 1 1
1 140 1 1 5 U C5 C 0.473 4.332 1.018 1.00 . A 1 . 5 U C5 1 1
1 141 1 1 5 U C5' C 1.251 5.612 5.696 1.00 . A 1 . 5 U C5' 1 1
1 142 1 1 5 U C6 C 0.644 5.270 1.983 1.00 . A 1 . 5 U C6 1 1
1 143 1 1 5 U H1' H 1.389 8.481 2.337 1.00 . A 1 . 5 U H1' 1 1
1 144 1 1 5 U H2' H -1.287 7.872 2.712 1.00 . A 1 . 5 U H2' 1 1
1 145 1 1 5 U H3 H 0.282 6.412 -1.532 1.00 . A 1 . 5 U H3 1 1
1 146 1 1 5 U H3' H -1.008 6.125 4.340 1.00 . A 1 . 5 U H3' 1 1
1 147 1 1 5 U H4' H 1.200 7.754 5.673 1.00 . A 1 . 5 U H4' 1 1
1 148 1 1 5 U H5 H 0.446 3.275 1.286 1.00 . A 1 . 5 U H5 1 1
1 149 1 1 5 U H5' H 2.334 5.516 5.773 1.00 . A 1 . 5 U H5' 1 1
1 150 1 1 5 U H5'' H 0.821 5.611 6.698 1.00 . A 1 . 5 U H5'' 1 1
1 151 1 1 5 U H6 H 0.752 4.952 3.020 1.00 . A 1 . 5 U H6 1 1
1 152 1 1 5 U HO2' H 0.534 9.637 3.861 1.00 . A 1 . 5 U HO2' 1 1
1 153 1 1 5 U N1 N 0.684 6.607 1.688 1.00 . A 1 . 5 U N1 1 1
1 154 1 1 5 U N3 N 0.380 6.094 -0.578 1.00 . A 1 . 5 U N3 1 1
1 155 1 1 5 U O2 O 0.585 8.260 0.105 1.00 . A 1 . 5 U O2 1 1
1 156 1 1 5 U O2' O -0.391 9.383 3.844 1.00 . A 1 . 5 U O2' 1 1
1 157 1 1 5 U O3' O -1.220 7.767 5.626 1.00 . A 1 . 5 U O3' 1 1
1 158 1 1 5 U O4 O 0.170 3.964 -1.311 1.00 . A 1 . 5 U O4 1 1
1 159 1 1 5 U O4' O 1.664 7.037 3.797 1.00 . A 1 . 5 U O4' 1 1
1 160 1 1 5 U O5' O 0.733 4.497 4.965 1.00 . A 1 . 5 U O5' 1 1
1 161 1 1 5 U OP1 O 0.943 2.817 6.811 1.00 . A 1 . 5 U OP1 1 1
1 162 1 1 5 U OP2 O 0.519 2.067 4.398 1.00 . A 1 . 5 U OP2 1 1
1 163 1 1 5 U P P 1.158 2.995 5.358 1.00 . A 1 . 5 U P 1 1
1 164 1 1 6 A C1' C -3.204 10.007 0.597 1.00 . A 1 . 6 A C1' 1 1
1 165 1 1 6 A C2 C -3.307 7.866 -3.175 1.00 . A 1 . 6 A C2 1 1
1 166 1 1 6 A C2' C -4.655 10.341 0.936 1.00 . A 1 . 6 A C2' 1 1
1 167 1 1 6 A C3' C -4.671 10.184 2.448 1.00 . A 1 . 6 A C3' 1 1
1 168 1 1 6 A C4 C -3.082 8.040 -0.998 1.00 . A 1 . 6 A C4 1 1
1 169 1 1 6 A C4' C -3.295 10.674 2.865 1.00 . A 1 . 6 A C4' 1 1
1 170 1 1 6 A C5 C -2.857 6.702 -0.846 1.00 . A 1 . 6 A C5 1 1
1 171 1 1 6 A C5' C -2.762 10.058 4.154 1.00 . A 1 . 6 A C5' 1 1
1 172 1 1 6 A C6 C -2.871 5.926 -2.016 1.00 . A 1 . 6 A C6 1 1
1 173 1 1 6 A C8 C -2.760 7.531 1.105 1.00 . A 1 . 6 A C8 1 1
1 174 1 1 6 A H1' H -2.845 10.621 -0.229 1.00 . A 1 . 6 A H1' 1 1
1 175 1 1 6 A H2 H -3.490 8.316 -4.151 1.00 . A 1 . 6 A H2 1 1
1 176 1 1 6 A H2' H -5.340 9.638 0.462 1.00 . A 1 . 6 A H2' 1 1
1 177 1 1 6 A H3' H -4.886 9.166 2.775 1.00 . A 1 . 6 A H3' 1 1
1 178 1 1 6 A H4' H -3.290 11.760 2.964 1.00 . A 1 . 6 A H4' 1 1
1 179 1 1 6 A H5' H -1.675 10.140 4.164 1.00 . A 1 . 6 A H5' 1 1
1 180 1 1 6 A H5'' H -3.168 10.605 5.004 1.00 . A 1 . 6 A H5'' 1 1
1 181 1 1 6 A H61 H -2.676 4.106 -2.906 1.00 . A 1 . 6 A H61 1 1
1 182 1 1 6 A H62 H -2.507 4.113 -1.164 1.00 . A 1 . 6 A H62 1 1
1 183 1 1 6 A H8 H -2.653 7.643 2.184 1.00 . A 1 . 6 A H8 1 1
1 184 1 1 6 A HO2' H -4.721 11.794 -0.355 1.00 . A 1 . 6 A HO2' 1 1
1 185 1 1 6 A N1 N -3.104 6.554 -3.179 1.00 . A 1 . 6 A N1 1 1
1 186 1 1 6 A N3 N -3.319 8.704 -2.149 1.00 . A 1 . 6 A N3 1 1
1 187 1 1 6 A N6 N -2.668 4.609 -2.030 1.00 . A 1 . 6 A N6 1 1
1 188 1 1 6 A N7 N -2.653 6.384 0.492 1.00 . A 1 . 6 A N7 1 1
1 189 1 1 6 A N9 N -3.021 8.582 0.263 1.00 . A 1 . 6 A N9 1 1
1 190 1 1 6 A O2' O -4.960 11.689 0.569 1.00 . A 1 . 6 A O2' 1 1
1 191 1 1 6 A O3' O -5.624 11.120 2.958 1.00 . A 1 . 6 A O3' 1 1
1 192 1 1 6 A O4' O -2.440 10.303 1.778 1.00 . A 1 . 6 A O4' 1 1
1 193 1 1 6 A O5' O -3.126 8.680 4.268 1.00 . A 1 . 6 A O5' 1 1
1 194 1 1 6 A OP1 O -3.242 8.704 6.770 1.00 . A 1 . 6 A OP1 1 1
1 195 1 1 6 A OP2 O -3.374 6.498 5.473 1.00 . A 1 . 6 A OP2 1 1
1 196 1 1 6 A P P -2.827 7.865 5.623 1.00 . A 1 . 6 A P 1 1
1 197 1 1 7 G C1' C -7.391 9.466 -2.088 1.00 . A 1 . 7 G C1' 1 1
1 198 1 1 7 G C2 C -6.209 5.635 -3.771 1.00 . A 1 . 7 G C2 1 1
1 199 1 1 7 G C2' C -8.914 9.453 -2.199 1.00 . A 1 . 7 G C2' 1 1
1 200 1 1 7 G C3' C -9.330 10.171 -0.925 1.00 . A 1 . 7 G C3' 1 1
1 201 1 1 7 G C4 C -6.526 7.083 -2.104 1.00 . A 1 . 7 G C4 1 1
1 202 1 1 7 G C4' C -8.241 11.214 -0.741 1.00 . A 1 . 7 G C4' 1 1
1 203 1 1 7 G C5 C -6.088 6.218 -1.130 1.00 . A 1 . 7 G C5 1 1
1 204 1 1 7 G C5' C -7.993 11.629 0.706 1.00 . A 1 . 7 G C5' 1 1
1 205 1 1 7 G C6 C -5.659 4.912 -1.495 1.00 . A 1 . 7 G C6 1 1
1 206 1 1 7 G C8 C -6.614 8.012 -0.123 1.00 . A 1 . 7 G C8 1 1
1 207 1 1 7 G H1 H -5.471 3.802 -3.211 1.00 . A 1 . 7 G H1 1 1
1 208 1 1 7 G H1' H -6.929 9.590 -3.068 1.00 . A 1 . 7 G H1' 1 1
1 209 1 1 7 G H2' H -9.297 8.433 -2.216 1.00 . A 1 . 7 G H2' 1 1
1 210 1 1 7 G H21 H -5.994 4.318 -5.308 1.00 . A 1 . 7 G H21 1 1
1 211 1 1 7 G H22 H -6.497 5.931 -5.764 1.00 . A 1 . 7 G H22 1 1
1 212 1 1 7 G H3' H -9.440 9.505 -0.069 1.00 . A 1 . 7 G H3' 1 1
1 213 1 1 7 G H4' H -8.461 12.105 -1.330 1.00 . A 1 . 7 G H4' 1 1
1 214 1 1 7 G H5' H -7.213 12.389 0.729 1.00 . A 1 . 7 G H5' 1 1
1 215 1 1 7 G H5'' H -8.911 12.048 1.118 1.00 . A 1 . 7 G H5'' 1 1
1 216 1 1 7 G H8 H -6.786 8.756 0.655 1.00 . A 1 . 7 G H8 1 1
1 217 1 1 7 G HO2' H -8.745 10.933 -3.450 1.00 . A 1 . 7 G HO2' 1 1
1 218 1 1 7 G N1 N -5.756 4.705 -2.862 1.00 . A 1 . 7 G N1 1 1
1 219 1 1 7 G N2 N -6.235 5.265 -5.051 1.00 . A 1 . 7 G N2 1 1
1 220 1 1 7 G N3 N -6.614 6.864 -3.439 1.00 . A 1 . 7 G N3 1 1
1 221 1 1 7 G N7 N -6.149 6.819 0.122 1.00 . A 1 . 7 G N7 1 1
1 222 1 1 7 G N9 N -6.866 8.244 -1.451 1.00 . A 1 . 7 G N9 1 1
1 223 1 1 7 G O2' O -9.341 10.187 -3.350 1.00 . A 1 . 7 G O2' 1 1
1 224 1 1 7 G O3' O -10.541 10.873 -1.214 1.00 . A 1 . 7 G O3' 1 1
1 225 1 1 7 G O4' O -7.060 10.593 -1.260 1.00 . A 1 . 7 G O4' 1 1
1 226 1 1 7 G O5' O -7.586 10.518 1.509 1.00 . A 1 . 7 G O5' 1 1
1 227 1 1 7 G O6 O -5.241 4.016 -0.765 1.00 . A 1 . 7 G O6 1 1
1 228 1 1 7 G OP1 O -7.923 11.903 3.568 1.00 . A 1 . 7 G OP1 1 1
1 229 1 1 7 G OP2 O -7.293 9.425 3.744 1.00 . A 1 . 7 G OP2 1 1
1 230 1 1 7 G P P -7.183 10.730 3.053 1.00 . A 1 . 7 G P 1 1
1 231 1 1 8 U C1' C -10.499 6.362 -4.832 1.00 . A 1 . 8 U C1' 1 1
1 232 1 1 8 U C2 C -9.265 4.605 -3.668 1.00 . A 1 . 8 U C2 1 1
1 233 1 1 8 U C2' C -11.973 6.066 -5.098 1.00 . A 1 . 8 U C2' 1 1
1 234 1 1 8 U C3' C -12.656 7.276 -4.482 1.00 . A 1 . 8 U C3' 1 1
1 235 1 1 8 U C4 C -9.099 4.565 -1.211 1.00 . A 1 . 8 U C4 1 1
1 236 1 1 8 U C4' C -11.685 8.408 -4.769 1.00 . A 1 . 8 U C4' 1 1
1 237 1 1 8 U C5 C -9.898 5.769 -1.196 1.00 . A 1 . 8 U C5 1 1
1 238 1 1 8 U C5' C -11.729 9.555 -3.765 1.00 . A 1 . 8 U C5' 1 1
1 239 1 1 8 U C6 C -10.328 6.316 -2.361 1.00 . A 1 . 8 U C6 1 1
1 240 1 1 8 U H1' H -9.876 6.017 -5.657 1.00 . A 1 . 8 U H1' 1 1
1 241 1 1 8 U H2' H -12.284 5.146 -4.602 1.00 . A 1 . 8 U H2' 1 1
1 242 1 1 8 U H3 H -8.281 3.222 -2.523 1.00 . A 1 . 8 U H3 1 1
1 243 1 1 8 U H3' H -12.879 7.154 -3.422 1.00 . A 1 . 8 U H3' 1 1
1 244 1 1 8 U H4' H -11.848 8.809 -5.769 1.00 . A 1 . 8 U H4' 1 1
1 245 1 1 8 U H5 H -10.157 6.239 -0.247 1.00 . A 1 . 8 U H5 1 1
1 246 1 1 8 U H5' H -10.825 10.155 -3.870 1.00 . A 1 . 8 U H5' 1 1
1 247 1 1 8 U H5'' H -12.597 10.180 -3.976 1.00 . A 1 . 8 U H5'' 1 1
1 248 1 1 8 U H6 H -10.930 7.224 -2.331 1.00 . A 1 . 8 U H6 1 1
1 249 1 1 8 U HO2' H -11.780 5.229 -6.844 1.00 . A 1 . 8 U HO2' 1 1
1 250 1 1 8 U N1 N -10.024 5.756 -3.574 1.00 . A 1 . 8 U N1 1 1
1 251 1 1 8 U N3 N -8.837 4.063 -2.472 1.00 . A 1 . 8 U N3 1 1
1 252 1 1 8 U O2 O -8.982 4.088 -4.747 1.00 . A 1 . 8 U O2 1 1
1 253 1 1 8 U O2' O -12.228 6.007 -6.504 1.00 . A 1 . 8 U O2' 1 1
1 254 1 1 8 U O3' O -13.836 7.529 -5.250 1.00 . A 1 . 8 U O3' 1 1
1 255 1 1 8 U O4 O -8.661 3.991 -0.217 1.00 . A 1 . 8 U O4 1 1
1 256 1 1 8 U O4' O -10.393 7.791 -4.720 1.00 . A 1 . 8 U O4' 1 1
1 257 1 1 8 U O5' O -11.816 9.075 -2.421 1.00 . A 1 . 8 U O5' 1 1
1 258 1 1 8 U OP1 O -13.018 11.081 -1.524 1.00 . A 1 . 8 U OP1 1 1
1 259 1 1 8 U OP2 O -12.039 9.323 0.062 1.00 . A 1 . 8 U OP2 1 1
1 260 1 1 8 U P P -11.956 10.105 -1.192 1.00 . A 1 . 8 U P 1 1
1 261 1 1 9 C C1' C -13.143 1.926 -5.829 1.00 . A 1 . 9 C C1' 1 1
1 262 1 1 9 C C2 C -11.811 1.298 -3.875 1.00 . A 1 . 9 C C2 1 1
1 263 1 1 9 C C2' C -14.546 1.329 -5.924 1.00 . A 1 . 9 C C2' 1 1
1 264 1 1 9 C C3' C -15.407 2.570 -6.090 1.00 . A 1 . 9 C C3' 1 1
1 265 1 1 9 C C4 C -11.907 2.526 -1.877 1.00 . A 1 . 9 C C4 1 1
1 266 1 1 9 C C4' C -14.536 3.490 -6.928 1.00 . A 1 . 9 C C4' 1 1
1 267 1 1 9 C C5 C -12.857 3.430 -2.448 1.00 . A 1 . 9 C C5 1 1
1 268 1 1 9 C C5' C -14.797 4.978 -6.720 1.00 . A 1 . 9 C C5' 1 1
1 269 1 1 9 C C6 C -13.240 3.216 -3.721 1.00 . A 1 . 9 C C6 1 1
1 270 1 1 9 C H1' H -12.411 1.280 -6.314 1.00 . A 1 . 9 C H1' 1 1
1 271 1 1 9 C H2' H -14.805 0.791 -5.012 1.00 . A 1 . 9 C H2' 1 1
1 272 1 1 9 C H3' H -15.718 3.011 -5.143 1.00 . A 1 . 9 C H3' 1 1
1 273 1 1 9 C H4' H -14.643 3.258 -7.988 1.00 . A 1 . 9 C H4' 1 1
1 274 1 1 9 C H41 H -10.805 2.030 -0.239 1.00 . A 1 . 9 C H41 1 1
1 275 1 1 9 C H42 H -11.836 3.431 -0.055 1.00 . A 1 . 9 C H42 1 1
1 276 1 1 9 C H5 H -13.263 4.266 -1.880 1.00 . A 1 . 9 C H5 1 1
1 277 1 1 9 C H5' H -13.950 5.545 -7.106 1.00 . A 1 . 9 C H5' 1 1
1 278 1 1 9 C H5'' H -15.695 5.262 -7.270 1.00 . A 1 . 9 C H5'' 1 1
1 279 1 1 9 C H6 H -13.962 3.886 -4.187 1.00 . A 1 . 9 C H6 1 1
1 280 1 1 9 C HO2' H -13.853 -0.041 -7.118 1.00 . A 1 . 9 C HO2' 1 1
1 281 1 1 9 C N1 N -12.732 2.170 -4.434 1.00 . A 1 . 9 C N1 1 1
1 282 1 1 9 C N3 N -11.416 1.502 -2.588 1.00 . A 1 . 9 C N3 1 1
1 283 1 1 9 C N4 N -11.482 2.674 -0.622 1.00 . A 1 . 9 C N4 1 1
1 284 1 1 9 C O2 O -11.367 0.362 -4.536 1.00 . A 1 . 9 C O2 1 1
1 285 1 1 9 C O2' O -14.656 0.484 -7.072 1.00 . A 1 . 9 C O2' 1 1
1 286 1 1 9 C O3' O -16.527 2.199 -6.898 1.00 . A 1 . 9 C O3' 1 1
1 287 1 1 9 C O4' O -13.199 3.186 -6.518 1.00 . A 1 . 9 C O4' 1 1
1 288 1 1 9 C O5' O -14.978 5.292 -5.337 1.00 . A 1 . 9 C O5' 1 1
1 289 1 1 9 C OP1 O -16.292 7.390 -5.720 1.00 . A 1 . 9 C OP1 1 1
1 290 1 1 9 C OP2 O -15.369 6.828 -3.397 1.00 . A 1 . 9 C OP2 1 1
1 291 1 1 9 C P P -15.227 6.813 -4.870 1.00 . A 1 . 9 C P 1 1
1 292 1 1 10 C C1' C -14.967 -2.305 -4.012 1.00 . A 1 . 10 C C1' 1 1
1 293 1 1 10 C C2 C -13.949 -1.420 -1.970 1.00 . A 1 . 10 C C2 1 1
1 294 1 1 10 C C2' C -16.176 -3.203 -3.765 1.00 . A 1 . 10 C C2' 1 1
1 295 1 1 10 C C3' C -17.256 -2.515 -4.589 1.00 . A 1 . 10 C C3' 1 1
1 296 1 1 10 C C4 C -14.556 0.676 -1.103 1.00 . A 1 . 10 C C4 1 1
1 297 1 1 10 C C4' C -16.469 -2.067 -5.812 1.00 . A 1 . 10 C C4' 1 1
1 298 1 1 10 C C5 C -15.488 0.875 -2.170 1.00 . A 1 . 10 C C5 1 1
1 299 1 1 10 C C5' C -17.064 -0.873 -6.551 1.00 . A 1 . 10 C C5' 1 1
1 300 1 1 10 C C6 C -15.602 -0.097 -3.094 1.00 . A 1 . 10 C C6 1 1
1 301 1 1 10 C H1' H -14.045 -2.885 -4.031 1.00 . A 1 . 10 C H1' 1 1
1 302 1 1 10 C H2' H -16.442 -3.221 -2.708 1.00 . A 1 . 10 C H2' 1 1
1 303 1 1 10 C H3' H -17.673 -1.661 -4.055 1.00 . A 1 . 10 C H3' 1 1
1 304 1 1 10 C H4' H -16.351 -2.893 -6.514 1.00 . A 1 . 10 C H4' 1 1
1 305 1 1 10 C H41 H -13.695 1.455 0.568 1.00 . A 1 . 10 C H41 1 1
1 306 1 1 10 C H42 H -14.954 2.431 -0.153 1.00 . A 1 . 10 C H42 1 1
1 307 1 1 10 C H5 H -16.089 1.782 -2.241 1.00 . A 1 . 10 C H5 1 1
1 308 1 1 10 C H5' H -16.343 -0.514 -7.285 1.00 . A 1 . 10 C H5' 1 1
1 309 1 1 10 C H5'' H -17.970 -1.191 -7.067 1.00 . A 1 . 10 C H5'' 1 1
1 310 1 1 10 C H6 H -16.303 0.023 -3.920 1.00 . A 1 . 10 C H6 1 1
1 311 1 1 10 C HO2' H -16.617 -5.092 -3.904 1.00 . A 1 . 10 C HO2' 1 1
1 312 1 1 10 C HO3' H -18.967 -3.392 -4.295 1.00 . A 1 . 10 C HO3' 1 1
1 313 1 1 10 C N1 N -14.850 -1.232 -3.006 1.00 . A 1 . 10 C N1 1 1
1 314 1 1 10 C N3 N -13.823 -0.444 -1.029 1.00 . A 1 . 10 C N3 1 1
1 315 1 1 10 C N4 N -14.388 1.595 -0.153 1.00 . A 1 . 10 C N4 1 1
1 316 1 1 10 C O2 O -13.282 -2.450 -1.911 1.00 . A 1 . 10 C O2 1 1
1 317 1 1 10 C O2' O -15.931 -4.522 -4.260 1.00 . A 1 . 10 C O2' 1 1
1 318 1 1 10 C O3' O -18.276 -3.446 -4.959 1.00 . A 1 . 10 C O3' 1 1
1 319 1 1 10 C O4' O -15.183 -1.707 -5.297 1.00 . A 1 . 10 C O4' 1 1
1 320 1 1 10 C O5' O -17.387 0.192 -5.654 1.00 . A 1 . 10 C O5' 1 1
1 321 1 1 10 C OP1 O -18.862 1.383 -7.291 1.00 . A 1 . 10 C OP1 1 1
1 322 1 1 10 C OP2 O -18.215 2.483 -5.069 1.00 . A 1 . 10 C OP2 1 1
1 323 1 1 10 C P P -17.868 1.620 -6.221 1.00 . A 1 . 10 C P 1 1
1 324 2 1 1 G C1' C -10.302 -3.537 5.258 1.00 . B 2 . 11 G C1' 1 1
1 325 2 1 1 G C2 C -11.910 -2.747 1.296 1.00 . B 2 . 11 G C2 1 1
1 326 2 1 1 G C2' C -8.991 -4.069 4.681 1.00 . B 2 . 11 G C2' 1 1
1 327 2 1 1 G C3' C -7.963 -3.463 5.622 1.00 . B 2 . 11 G C3' 1 1
1 328 2 1 1 G C4 C -11.225 -2.164 3.338 1.00 . B 2 . 11 G C4 1 1
1 329 2 1 1 G C4' C -8.668 -3.479 6.968 1.00 . B 2 . 11 G C4' 1 1
1 330 2 1 1 G C5 C -11.488 -0.827 3.157 1.00 . B 2 . 11 G C5 1 1
1 331 2 1 1 G C5' C -8.214 -2.394 7.938 1.00 . B 2 . 11 G C5' 1 1
1 332 2 1 1 G C6 C -12.021 -0.379 1.917 1.00 . B 2 . 11 G C6 1 1
1 333 2 1 1 G C8 C -10.719 -1.010 5.128 1.00 . B 2 . 11 G C8 1 1
1 334 2 1 1 G H1 H -12.578 -1.201 0.120 1.00 . B 2 . 11 G H1 1 1
1 335 2 1 1 G H1' H -11.097 -4.277 5.167 1.00 . B 2 . 11 G H1' 1 1
1 336 2 1 1 G H2' H -8.841 -3.719 3.660 1.00 . B 2 . 11 G H2' 1 1
1 337 2 1 1 G H21 H -12.555 -3.319 -0.548 1.00 . B 2 . 11 G H21 1 1
1 338 2 1 1 G H22 H -11.920 -4.602 0.458 1.00 . B 2 . 11 G H22 1 1
1 339 2 1 1 G H3' H -7.630 -2.470 5.319 1.00 . B 2 . 11 G H3' 1 1
1 340 2 1 1 G H4' H -8.554 -4.451 7.448 1.00 . B 2 . 11 G H4' 1 1
1 341 2 1 1 G H5' H -8.734 -2.525 8.887 1.00 . B 2 . 11 G H5' 1 1
1 342 2 1 1 G H5'' H -7.141 -2.490 8.104 1.00 . B 2 . 11 G H5'' 1 1
1 343 2 1 1 G H8 H -10.374 -0.777 6.135 1.00 . B 2 . 11 G H8 1 1
1 344 2 1 1 G HO2' H -9.463 -5.832 4.008 1.00 . B 2 . 11 G HO2' 1 1
1 345 2 1 1 G HO5' H -7.736 -0.816 6.905 1.00 . B 2 . 11 G HO5' 1 1
1 346 2 1 1 G N1 N -12.202 -1.428 1.030 1.00 . B 2 . 11 G N1 1 1
1 347 2 1 1 G N2 N -12.148 -3.627 0.323 1.00 . B 2 . 11 G N2 1 1
1 348 2 1 1 G N3 N -11.409 -3.179 2.457 1.00 . B 2 . 11 G N3 1 1
1 349 2 1 1 G N7 N -11.163 -0.106 4.300 1.00 . B 2 . 11 G N7 1 1
1 350 2 1 1 G N9 N -10.728 -2.281 4.614 1.00 . B 2 . 11 G N9 1 1
1 351 2 1 1 G O2' O -8.954 -5.497 4.750 1.00 . B 2 . 11 G O2' 1 1
1 352 2 1 1 G O3' O -6.874 -4.387 5.707 1.00 . B 2 . 11 G O3' 1 1
1 353 2 1 1 G O4' O -10.049 -3.277 6.648 1.00 . B 2 . 11 G O4' 1 1
1 354 2 1 1 G O5' O -8.492 -1.086 7.431 1.00 . B 2 . 11 G O5' 1 1
1 355 2 1 1 G O6 O -12.314 0.767 1.583 1.00 . B 2 . 11 G O6 1 1
1 356 2 1 2 G C1' C -8.254 -5.002 0.417 1.00 . B 2 . 12 G C1' 1 1
1 357 2 1 2 G C2 C -10.324 -1.960 -1.899 1.00 . B 2 . 12 G C2 1 1
1 358 2 1 2 G C2' C -6.991 -5.228 -0.412 1.00 . B 2 . 12 G C2' 1 1
1 359 2 1 2 G C3' C -5.941 -5.449 0.664 1.00 . B 2 . 12 G C3' 1 1
1 360 2 1 2 G C4 C -9.177 -2.707 -0.138 1.00 . B 2 . 12 G C4 1 1
1 361 2 1 2 G C4' C -6.703 -6.194 1.748 1.00 . B 2 . 12 G C4' 1 1
1 362 2 1 2 G C5 C -9.165 -1.491 0.502 1.00 . B 2 . 12 G C5 1 1
1 363 2 1 2 G C5' C -6.167 -5.987 3.160 1.00 . B 2 . 12 G C5' 1 1
1 364 2 1 2 G C6 C -9.796 -0.373 -0.108 1.00 . B 2 . 12 G C6 1 1
1 365 2 1 2 G C8 C -8.118 -2.830 1.775 1.00 . B 2 . 12 G C8 1 1
1 366 2 1 2 G H1 H -10.831 0.029 -1.835 1.00 . B 2 . 12 G H1 1 1
1 367 2 1 2 G H1' H -9.127 -5.432 -0.075 1.00 . B 2 . 12 G H1' 1 1
1 368 2 1 2 G H2' H -6.756 -4.350 -1.014 1.00 . B 2 . 12 G H2' 1 1
1 369 2 1 2 G H21 H -11.329 -1.302 -3.543 1.00 . B 2 . 12 G H21 1 1
1 370 2 1 2 G H22 H -10.962 -3.012 -3.521 1.00 . B 2 . 12 G H22 1 1
1 371 2 1 2 G H3' H -5.480 -4.526 1.016 1.00 . B 2 . 12 G H3' 1 1
1 372 2 1 2 G H4' H -6.726 -7.262 1.532 1.00 . B 2 . 12 G H4' 1 1
1 373 2 1 2 G H5' H -6.915 -6.327 3.877 1.00 . B 2 . 12 G H5' 1 1
1 374 2 1 2 G H5'' H -5.259 -6.576 3.286 1.00 . B 2 . 12 G H5'' 1 1
1 375 2 1 2 G H8 H -7.557 -3.244 2.612 1.00 . B 2 . 12 G H8 1 1
1 376 2 1 2 G HO2' H -6.245 -6.659 -1.498 1.00 . B 2 . 12 G HO2' 1 1
1 377 2 1 2 G N1 N -10.360 -0.707 -1.330 1.00 . B 2 . 12 G N1 1 1
1 378 2 1 2 G N2 N -10.920 -2.103 -3.083 1.00 . B 2 . 12 G N2 1 1
1 379 2 1 2 G N3 N -9.734 -3.017 -1.335 1.00 . B 2 . 12 G N3 1 1
1 380 2 1 2 G N7 N -8.491 -1.582 1.714 1.00 . B 2 . 12 G N7 1 1
1 381 2 1 2 G N9 N -8.499 -3.573 0.687 1.00 . B 2 . 12 G N9 1 1
1 382 2 1 2 G O2' O -7.128 -6.394 -1.227 1.00 . B 2 . 12 G O2' 1 1
1 383 2 1 2 G O3' O -4.975 -6.357 0.129 1.00 . B 2 . 12 G O3' 1 1
1 384 2 1 2 G O4' O -8.034 -5.674 1.669 1.00 . B 2 . 12 G O4' 1 1
1 385 2 1 2 G O5' O -5.870 -4.611 3.414 1.00 . B 2 . 12 G O5' 1 1
1 386 2 1 2 G O6 O -9.883 0.778 0.314 1.00 . B 2 . 12 G O6 1 1
1 387 2 1 2 G OP1 O -4.462 -5.010 5.447 1.00 . B 2 . 12 G OP1 1 1
1 388 2 1 2 G OP2 O -5.278 -2.653 4.859 1.00 . B 2 . 12 G OP2 1 1
1 389 2 1 2 G P P -5.507 -4.115 4.902 1.00 . B 2 . 12 G P 1 1
1 390 2 1 3 6MZ C1' C -6.610 -3.441 -4.198 1.00 . B 2 . 13 6MZ C1' 1 1
1 391 2 1 3 6MZ C2 C -8.410 0.473 -3.688 1.00 . B 2 . 13 6MZ C2 1 1
1 392 2 1 3 6MZ C2' C -5.518 -3.214 -5.242 1.00 . B 2 . 13 6MZ C2' 1 1
1 393 2 1 3 6MZ C3' C -4.411 -4.128 -4.746 1.00 . B 2 . 13 6MZ C3' 1 1
1 394 2 1 3 6MZ C4 C -7.179 -1.239 -3.077 1.00 . B 2 . 13 6MZ C4 1 1
1 395 2 1 3 6MZ C4' C -5.167 -5.315 -4.175 1.00 . B 2 . 13 6MZ C4' 1 1
1 396 2 1 3 6MZ C5 C -6.849 -0.664 -1.883 1.00 . B 2 . 13 6MZ C5 1 1
1 397 2 1 3 6MZ C5' C -4.440 -6.057 -3.058 1.00 . B 2 . 13 6MZ C5' 1 1
1 398 2 1 3 6MZ C6 C -7.388 0.608 -1.630 1.00 . B 2 . 13 6MZ C6 1 1
1 399 2 1 3 6MZ C8 C -5.868 -2.545 -1.910 1.00 . B 2 . 13 6MZ C8 1 1
1 400 2 1 3 6MZ C9 C -6.270 0.810 0.430 1.00 . B 2 . 13 6MZ C9 1 1
1 401 2 1 3 6MZ H1' H -7.599 -3.410 -4.653 1.00 . B 2 . 13 6MZ H1' 1 1
1 402 2 1 3 6MZ H2 H -9.056 0.969 -4.412 1.00 . B 2 . 13 6MZ H2 1 1
1 403 2 1 3 6MZ H2' H -5.194 -2.173 -5.250 1.00 . B 2 . 13 6MZ H2' 1 1
1 404 2 1 3 6MZ H3' H -3.745 -3.651 -4.026 1.00 . B 2 . 13 6MZ H3' 1 1
1 405 2 1 3 6MZ H4' H -5.418 -6.024 -4.964 1.00 . B 2 . 13 6MZ H4' 1 1
1 406 2 1 3 6MZ H5'1 H -5.060 -6.887 -2.719 1.00 . B 2 . 13 6MZ H5'1 1 1
1 407 2 1 3 6MZ H5'2 H -3.500 -6.449 -3.445 1.00 . B 2 . 13 6MZ H5'2 1 1
1 408 2 1 3 6MZ H6 H -7.632 2.174 -0.353 1.00 . B 2 . 13 6MZ H6 1 1
1 409 2 1 3 6MZ H8 H -5.263 -3.407 -1.629 1.00 . B 2 . 13 6MZ H8 1 1
1 410 2 1 3 6MZ H9 H -5.353 1.399 0.403 1.00 . B 2 . 13 6MZ H9 1 1
1 411 2 1 3 6MZ H9C1 H -6.039 -0.232 0.207 1.00 . B 2 . 13 6MZ H9C1 1 1
1 412 2 1 3 6MZ H9C2 H -6.717 0.879 1.421 1.00 . B 2 . 13 6MZ H9C2 1 1
1 413 2 1 3 6MZ HA H -6.853 -3.274 -6.656 1.00 . B 2 . 13 6MZ HA 1 1
1 414 2 1 3 6MZ N1 N -8.175 1.152 -2.572 1.00 . B 2 . 13 6MZ N1 1 1
1 415 2 1 3 6MZ N3 N -7.966 -0.723 -4.045 1.00 . B 2 . 13 6MZ N3 1 1
1 416 2 1 3 6MZ N6 N -7.158 1.297 -0.512 1.00 . B 2 . 13 6MZ N6 1 1
1 417 2 1 3 6MZ N7 N -6.017 -1.498 -1.146 1.00 . B 2 . 13 6MZ N7 1 1
1 418 2 1 3 6MZ N9 N -6.546 -2.458 -3.099 1.00 . B 2 . 13 6MZ N9 1 1
1 419 2 1 3 6MZ O1P O -3.111 -4.689 0.266 1.00 . B 2 . 13 6MZ O1P 1 1
1 420 2 1 3 6MZ O2' O -5.968 -3.626 -6.536 1.00 . B 2 . 13 6MZ O2' 1 1
1 421 2 1 3 6MZ O2P O -2.756 -6.961 -0.863 1.00 . B 2 . 13 6MZ O2P 1 1
1 422 2 1 3 6MZ O3' O -3.703 -4.595 -5.898 1.00 . B 2 . 13 6MZ O3' 1 1
1 423 2 1 3 6MZ O4' O -6.376 -4.751 -3.655 1.00 . B 2 . 13 6MZ O4' 1 1
1 424 2 1 3 6MZ O5' O -4.165 -5.197 -1.948 1.00 . B 2 . 13 6MZ O5' 1 1
1 425 2 1 3 6MZ P P -3.628 -5.805 -0.558 1.00 . B 2 . 13 6MZ P 1 1
1 426 2 1 4 C C1' C -6.265 0.117 -6.799 1.00 . B 2 . 14 C C1' 1 1
1 427 2 1 4 C C2 C -5.927 1.495 -4.805 1.00 . B 2 . 14 C C2 1 1
1 428 2 1 4 C C2' C -5.760 0.971 -7.961 1.00 . B 2 . 14 C C2' 1 1
1 429 2 1 4 C C3' C -4.719 0.061 -8.592 1.00 . B 2 . 14 C C3' 1 1
1 430 2 1 4 C C4 C -4.267 0.986 -3.226 1.00 . B 2 . 14 C C4 1 1
1 431 2 1 4 C C4' C -5.312 -1.326 -8.413 1.00 . B 2 . 14 C C4' 1 1
1 432 2 1 4 C C5 C -3.859 -0.155 -3.986 1.00 . B 2 . 14 C C5 1 1
1 433 2 1 4 C C5' C -4.287 -2.452 -8.328 1.00 . B 2 . 14 C C5' 1 1
1 434 2 1 4 C C6 C -4.517 -0.415 -5.132 1.00 . B 2 . 14 C C6 1 1
1 435 2 1 4 C H1' H -7.332 0.269 -6.637 1.00 . B 2 . 14 C H1' 1 1
1 436 2 1 4 C H2' H -5.306 1.894 -7.600 1.00 . B 2 . 14 C H2' 1 1
1 437 2 1 4 C H3' H -3.727 0.168 -8.153 1.00 . B 2 . 14 C H3' 1 1
1 438 2 1 4 C H4' H -6.014 -1.548 -9.217 1.00 . B 2 . 14 C H4' 1 1
1 439 2 1 4 C H41 H -4.000 2.082 -1.532 1.00 . B 2 . 14 C H41 1 1
1 440 2 1 4 C H42 H -2.867 0.770 -1.765 1.00 . B 2 . 14 C H42 1 1
1 441 2 1 4 C H5 H -3.044 -0.800 -3.656 1.00 . B 2 . 14 C H5 1 1
1 442 2 1 4 C H5' H -4.805 -3.409 -8.388 1.00 . B 2 . 14 C H5' 1 1
1 443 2 1 4 C H5'' H -3.596 -2.368 -9.167 1.00 . B 2 . 14 C H5'' 1 1
1 444 2 1 4 C H6 H -4.231 -1.277 -5.734 1.00 . B 2 . 14 C H6 1 1
1 445 2 1 4 C HO2' H -6.915 0.463 -9.441 1.00 . B 2 . 14 C HO2' 1 1
1 446 2 1 4 C N1 N -5.537 0.391 -5.545 1.00 . B 2 . 14 C N1 1 1
1 447 2 1 4 C N3 N -5.271 1.769 -3.644 1.00 . B 2 . 14 C N3 1 1
1 448 2 1 4 C N4 N -3.662 1.305 -2.082 1.00 . B 2 . 14 C N4 1 1
1 449 2 1 4 C O2 O -6.849 2.207 -5.198 1.00 . B 2 . 14 C O2 1 1
1 450 2 1 4 C O2' O -6.819 1.239 -8.884 1.00 . B 2 . 14 C O2' 1 1
1 451 2 1 4 C O3' O -4.714 0.339 -9.995 1.00 . B 2 . 14 C O3' 1 1
1 452 2 1 4 C O4' O -6.030 -1.250 -7.176 1.00 . B 2 . 14 C O4' 1 1
1 453 2 1 4 C O5' O -3.546 -2.397 -7.106 1.00 . B 2 . 14 C O5' 1 1
1 454 2 1 4 C OP1 O -2.163 -4.345 -7.857 1.00 . B 2 . 14 C OP1 1 1
1 455 2 1 4 C OP2 O -1.665 -3.162 -5.640 1.00 . B 2 . 14 C OP2 1 1
1 456 2 1 4 C P P -2.639 -3.644 -6.644 1.00 . B 2 . 14 C P 1 1
1 457 2 1 5 U C1' C -4.039 5.522 -9.428 1.00 . B 2 . 15 U C1' 1 1
1 458 2 1 5 U C2 C -3.300 5.705 -7.107 1.00 . B 2 . 15 U C2 1 1
1 459 2 1 5 U C2' C -2.978 6.023 -10.405 1.00 . B 2 . 15 U C2' 1 1
1 460 2 1 5 U C3' C -2.813 4.830 -11.332 1.00 . B 2 . 15 U C3' 1 1
1 461 2 1 5 U C4 C -2.326 3.782 -5.915 1.00 . B 2 . 15 U C4 1 1
1 462 2 1 5 U C4' C -4.218 4.259 -11.420 1.00 . B 2 . 15 U C4' 1 1
1 463 2 1 5 U C5 C -2.513 3.013 -7.124 1.00 . B 2 . 15 U C5 1 1
1 464 2 1 5 U C5' C -4.282 2.762 -11.702 1.00 . B 2 . 15 U C5' 1 1
1 465 2 1 5 U C6 C -3.059 3.592 -8.222 1.00 . B 2 . 15 U C6 1 1
1 466 2 1 5 U H1' H -4.707 6.330 -9.128 1.00 . B 2 . 15 U H1' 1 1
1 467 2 1 5 U H2' H -2.045 6.249 -9.889 1.00 . B 2 . 15 U H2' 1 1
1 468 2 1 5 U H3 H -2.628 5.667 -5.173 1.00 . B 2 . 15 U H3 1 1
1 469 2 1 5 U H3' H -2.074 4.109 -10.983 1.00 . B 2 . 15 U H3' 1 1
1 470 2 1 5 U H4' H -4.798 4.785 -12.178 1.00 . B 2 . 15 U H4' 1 1
1 471 2 1 5 U H5 H -2.214 1.965 -7.154 1.00 . B 2 . 15 U H5 1 1
1 472 2 1 5 U H5' H -5.235 2.373 -11.344 1.00 . B 2 . 15 U H5' 1 1
1 473 2 1 5 U H5'' H -4.212 2.599 -12.777 1.00 . B 2 . 15 U H5'' 1 1
1 474 2 1 5 U H6 H -3.192 2.997 -9.126 1.00 . B 2 . 15 U H6 1 1
1 475 2 1 5 U HO2' H -2.691 7.669 -11.401 1.00 . B 2 . 15 U HO2' 1 1
1 476 2 1 5 U N1 N -3.447 4.906 -8.225 1.00 . B 2 . 15 U N1 1 1
1 477 2 1 5 U N3 N -2.742 5.097 -5.999 1.00 . B 2 . 15 U N3 1 1
1 478 2 1 5 U O2 O -3.642 6.885 -7.090 1.00 . B 2 . 15 U O2 1 1
1 479 2 1 5 U O2' O -3.457 7.159 -11.129 1.00 . B 2 . 15 U O2' 1 1
1 480 2 1 5 U O3' O -2.487 5.344 -12.626 1.00 . B 2 . 15 U O3' 1 1
1 481 2 1 5 U O4 O -1.843 3.355 -4.868 1.00 . B 2 . 15 U O4 1 1
1 482 2 1 5 U O4' O -4.790 4.520 -10.133 1.00 . B 2 . 15 U O4' 1 1
1 483 2 1 5 U O5' O -3.219 2.059 -11.053 1.00 . B 2 . 15 U O5' 1 1
1 484 2 1 5 U OP1 O -3.477 -0.199 -12.106 1.00 . B 2 . 15 U OP1 1 1
1 485 2 1 5 U OP2 O -2.225 0.077 -9.887 1.00 . B 2 . 15 U OP2 1 1
1 486 2 1 5 U P P -3.324 0.473 -10.796 1.00 . B 2 . 15 U P 1 1
1 487 2 1 6 A C1' C -0.937 8.603 -7.868 1.00 . B 2 . 16 A C1' 1 1
1 488 2 1 6 A C2 C -0.245 8.314 -3.596 1.00 . B 2 . 16 A C2 1 1
1 489 2 1 6 A C2' C 0.125 9.682 -8.069 1.00 . B 2 . 16 A C2' 1 1
1 490 2 1 6 A C3' C 0.792 9.233 -9.359 1.00 . B 2 . 16 A C3' 1 1
1 491 2 1 6 A C4 C -0.285 7.553 -5.655 1.00 . B 2 . 16 A C4 1 1
1 492 2 1 6 A C4' C -0.357 8.647 -10.161 1.00 . B 2 . 16 A C4' 1 1
1 493 2 1 6 A C5 C 0.168 6.321 -5.281 1.00 . B 2 . 16 A C5 1 1
1 494 2 1 6 A C5' C 0.047 7.563 -11.154 1.00 . B 2 . 16 A C5' 1 1
1 495 2 1 6 A C6 C 0.421 6.134 -3.912 1.00 . B 2 . 16 A C6 1 1
1 496 2 1 6 A C8 C -0.096 6.227 -7.384 1.00 . B 2 . 16 A C8 1 1
1 497 2 1 6 A H1' H -1.845 9.024 -7.437 1.00 . B 2 . 16 A H1' 1 1
1 498 2 1 6 A H2 H -0.405 9.117 -2.875 1.00 . B 2 . 16 A H2 1 1
1 499 2 1 6 A H2' H 0.836 9.691 -7.243 1.00 . B 2 . 16 A H2' 1 1
1 500 2 1 6 A H3' H 1.612 8.533 -9.201 1.00 . B 2 . 16 A H3' 1 1
1 501 2 1 6 A H4' H -0.890 9.434 -10.695 1.00 . B 2 . 16 A H4' 1 1
1 502 2 1 6 A H5' H 0.938 7.887 -11.693 1.00 . B 2 . 16 A H5' 1 1
1 503 2 1 6 A H5'' H 0.275 6.647 -10.608 1.00 . B 2 . 16 A H5'' 1 1
1 504 2 1 6 A H61 H 0.964 4.892 -2.394 1.00 . B 2 . 16 A H61 1 1
1 505 2 1 6 A H62 H 1.105 4.219 -4.003 1.00 . B 2 . 16 A H62 1 1
1 506 2 1 6 A H8 H -0.125 5.873 -8.414 1.00 . B 2 . 16 A H8 1 1
1 507 2 1 6 A HO2' H -0.057 11.569 -7.632 1.00 . B 2 . 16 A HO2' 1 1
1 508 2 1 6 A N1 N 0.199 7.170 -3.088 1.00 . B 2 . 16 A N1 1 1
1 509 2 1 6 A N3 N -0.519 8.616 -4.856 1.00 . B 2 . 16 A N3 1 1
1 510 2 1 6 A N6 N 0.866 4.989 -3.395 1.00 . B 2 . 16 A N6 1 1
1 511 2 1 6 A N7 N 0.286 5.482 -6.384 1.00 . B 2 . 16 A N7 1 1
1 512 2 1 6 A N9 N -0.458 7.498 -7.017 1.00 . B 2 . 16 A N9 1 1
1 513 2 1 6 A O2' O -0.487 10.963 -8.240 1.00 . B 2 . 16 A O2' 1 1
1 514 2 1 6 A O3' O 1.224 10.413 -10.042 1.00 . B 2 . 16 A O3' 1 1
1 515 2 1 6 A O4' O -1.228 8.081 -9.176 1.00 . B 2 . 16 A O4' 1 1
1 516 2 1 6 A O5' O -0.996 7.297 -12.096 1.00 . B 2 . 16 A O5' 1 1
1 517 2 1 6 A OP1 O -0.932 6.248 -14.369 1.00 . B 2 . 16 A OP1 1 1
1 518 2 1 6 A OP2 O -0.024 5.000 -12.324 1.00 . B 2 . 16 A OP2 1 1
1 519 2 1 6 A P P -1.014 5.919 -12.929 1.00 . B 2 . 16 A P 1 1
1 520 2 1 7 G C1' C 2.520 11.049 -4.846 1.00 . B 2 . 17 G C1' 1 1
1 521 2 1 7 G C2 C 3.246 7.690 -2.182 1.00 . B 2 . 17 G C2 1 1
1 522 2 1 7 G C2' C 3.804 11.851 -4.641 1.00 . B 2 . 17 G C2' 1 1
1 523 2 1 7 G C3' C 4.076 12.376 -6.041 1.00 . B 2 . 17 G C3' 1 1
1 524 2 1 7 G C4 C 3.004 8.651 -4.180 1.00 . B 2 . 17 G C4 1 1
1 525 2 1 7 G C4' C 2.685 12.634 -6.594 1.00 . B 2 . 17 G C4' 1 1
1 526 2 1 7 G C5 C 3.211 7.486 -4.881 1.00 . B 2 . 17 G C5 1 1
1 527 2 1 7 G C5' C 2.572 12.527 -8.111 1.00 . B 2 . 17 G C5' 1 1
1 528 2 1 7 G C6 C 3.465 6.279 -4.174 1.00 . B 2 . 17 G C6 1 1
1 529 2 1 7 G C8 C 2.878 8.993 -6.339 1.00 . B 2 . 17 G C8 1 1
1 530 2 1 7 G H1 H 3.637 5.674 -2.220 1.00 . B 2 . 17 G H1 1 1
1 531 2 1 7 G H1' H 1.866 11.129 -3.978 1.00 . B 2 . 17 G H1' 1 1
1 532 2 1 7 G H2' H 4.616 11.210 -4.298 1.00 . B 2 . 17 G H2' 1 1
1 533 2 1 7 G H21 H 3.516 6.858 -0.344 1.00 . B 2 . 17 G H21 1 1
1 534 2 1 7 G H22 H 3.073 8.551 -0.345 1.00 . B 2 . 17 G H22 1 1
1 535 2 1 7 G H3' H 4.666 11.693 -6.652 1.00 . B 2 . 17 G H3' 1 1
1 536 2 1 7 G H4' H 2.325 13.615 -6.282 1.00 . B 2 . 17 G H4' 1 1
1 537 2 1 7 G H5' H 1.524 12.615 -8.397 1.00 . B 2 . 17 G H5' 1 1
1 538 2 1 7 G H5'' H 3.135 13.341 -8.568 1.00 . B 2 . 17 G H5'' 1 1
1 539 2 1 7 G H8 H 2.751 9.510 -7.291 1.00 . B 2 . 17 G H8 1 1
1 540 2 1 7 G HO2' H 2.769 13.370 -4.005 1.00 . B 2 . 17 G HO2' 1 1
1 541 2 1 7 G N1 N 3.464 6.481 -2.802 1.00 . B 2 . 17 G N1 1 1
1 542 2 1 7 G N2 N 3.281 7.701 -0.849 1.00 . B 2 . 17 G N2 1 1
1 543 2 1 7 G N3 N 3.007 8.830 -2.836 1.00 . B 2 . 17 G N3 1 1
1 544 2 1 7 G N7 N 3.128 7.717 -6.249 1.00 . B 2 . 17 G N7 1 1
1 545 2 1 7 G N9 N 2.789 9.625 -5.126 1.00 . B 2 . 17 G N9 1 1
1 546 2 1 7 G O2' O 3.580 12.933 -3.734 1.00 . B 2 . 17 G O2' 1 1
1 547 2 1 7 G O3' O 4.714 13.648 -5.897 1.00 . B 2 . 17 G O3' 1 1
1 548 2 1 7 G O4' O 1.868 11.625 -5.990 1.00 . B 2 . 17 G O4' 1 1
1 549 2 1 7 G O5' O 3.083 11.280 -8.590 1.00 . B 2 . 17 G O5' 1 1
1 550 2 1 7 G O6 O 3.670 5.157 -4.630 1.00 . B 2 . 17 G O6 1 1
1 551 2 1 7 G OP1 O 2.942 11.967 -10.995 1.00 . B 2 . 17 G OP1 1 1
1 552 2 1 7 G OP2 O 3.560 9.565 -10.351 1.00 . B 2 . 17 G OP2 1 1
1 553 2 1 7 G P P 2.786 10.800 -10.097 1.00 . B 2 . 17 G P 1 1
1 554 2 1 8 U C1' C 6.430 10.571 -1.357 1.00 . B 2 . 18 U C1' 1 1
1 555 2 1 8 U C2 C 6.350 8.242 -2.089 1.00 . B 2 . 18 U C2 1 1
1 556 2 1 8 U C2' C 7.825 11.102 -1.029 1.00 . B 2 . 18 U C2' 1 1
1 557 2 1 8 U C3' C 7.906 12.342 -1.904 1.00 . B 2 . 18 U C3' 1 1
1 558 2 1 8 U C4 C 6.490 7.642 -4.474 1.00 . B 2 . 18 U C4 1 1
1 559 2 1 8 U C4' C 6.484 12.877 -1.884 1.00 . B 2 . 18 U C4' 1 1
1 560 2 1 8 U C5 C 6.593 9.054 -4.764 1.00 . B 2 . 18 U C5 1 1
1 561 2 1 8 U C5' C 6.084 13.671 -3.123 1.00 . B 2 . 18 U C5' 1 1
1 562 2 1 8 U C6 C 6.571 9.959 -3.754 1.00 . B 2 . 18 U C6 1 1
1 563 2 1 8 U H1' H 5.961 10.134 -0.476 1.00 . B 2 . 18 U H1' 1 1
1 564 2 1 8 U H2' H 8.593 10.379 -1.302 1.00 . B 2 . 18 U H2' 1 1
1 565 2 1 8 U H3 H 6.301 6.358 -2.889 1.00 . B 2 . 18 U H3 1 1
1 566 2 1 8 U H3' H 8.278 12.139 -2.908 1.00 . B 2 . 18 U H3' 1 1
1 567 2 1 8 U H4' H 6.320 13.494 -1.001 1.00 . B 2 . 18 U H4' 1 1
1 568 2 1 8 U H5 H 6.688 9.392 -5.796 1.00 . B 2 . 18 U H5 1 1
1 569 2 1 8 U H5' H 4.997 13.724 -3.176 1.00 . B 2 . 18 U H5' 1 1
1 570 2 1 8 U H5'' H 6.486 14.681 -3.042 1.00 . B 2 . 18 U H5'' 1 1
1 571 2 1 8 U H6 H 6.649 11.021 -3.990 1.00 . B 2 . 18 U H6 1 1
1 572 2 1 8 U HO2' H 7.714 12.393 0.422 1.00 . B 2 . 18 U HO2' 1 1
1 573 2 1 8 U N1 N 6.453 9.574 -2.444 1.00 . B 2 . 18 U N1 1 1
1 574 2 1 8 U N3 N 6.375 7.336 -3.131 1.00 . B 2 . 18 U N3 1 1
1 575 2 1 8 U O2 O 6.244 7.877 -0.921 1.00 . B 2 . 18 U O2 1 1
1 576 2 1 8 U O2' O 7.914 11.456 0.354 1.00 . B 2 . 18 U O2' 1 1
1 577 2 1 8 U O3' O 8.722 13.291 -1.213 1.00 . B 2 . 18 U O3' 1 1
1 578 2 1 8 U O4 O 6.500 6.742 -5.312 1.00 . B 2 . 18 U O4 1 1
1 579 2 1 8 U O4' O 5.664 11.706 -1.792 1.00 . B 2 . 18 U O4' 1 1
1 580 2 1 8 U O5' O 6.582 13.065 -4.319 1.00 . B 2 . 18 U O5' 1 1
1 581 2 1 8 U OP1 O 6.683 15.178 -5.661 1.00 . B 2 . 18 U OP1 1 1
1 582 2 1 8 U OP2 O 6.927 12.892 -6.794 1.00 . B 2 . 18 U OP2 1 1
1 583 2 1 8 U P P 6.315 13.747 -5.753 1.00 . B 2 . 18 U P 1 1
1 584 2 1 9 C C1' C 10.685 8.384 0.480 1.00 . B 2 . 19 C C1' 1 1
1 585 2 1 9 C C2 C 9.992 6.877 -1.319 1.00 . B 2 . 19 C C2 1 1
1 586 2 1 9 C C2' C 12.188 8.520 0.721 1.00 . B 2 . 19 C C2' 1 1
1 587 2 1 9 C C3' C 12.387 10.024 0.635 1.00 . B 2 . 19 C C3' 1 1
1 588 2 1 9 C C4 C 9.756 7.630 -3.530 1.00 . B 2 . 19 C C4 1 1
1 589 2 1 9 C C4' C 11.113 10.581 1.246 1.00 . B 2 . 19 C C4' 1 1
1 590 2 1 9 C C5 C 10.141 8.953 -3.147 1.00 . B 2 . 19 C C5 1 1
1 591 2 1 9 C C5' C 10.710 11.960 0.733 1.00 . B 2 . 19 C C5' 1 1
1 592 2 1 9 C C6 C 10.435 9.172 -1.851 1.00 . B 2 . 19 C C6 1 1
1 593 2 1 9 C H1' H 10.265 7.576 1.078 1.00 . B 2 . 19 C H1' 1 1
1 594 2 1 9 C H2' H 12.757 8.005 -0.052 1.00 . B 2 . 19 C H2' 1 1
1 595 2 1 9 C H3' H 12.573 10.379 -0.378 1.00 . B 2 . 19 C H3' 1 1
1 596 2 1 9 C H4' H 11.194 10.619 2.332 1.00 . B 2 . 19 C H4' 1 1
1 597 2 1 9 C H41 H 9.194 6.395 -5.047 1.00 . B 2 . 19 C H41 1 1
1 598 2 1 9 C H42 H 9.475 8.061 -5.499 1.00 . B 2 . 19 C H42 1 1
1 599 2 1 9 C H5 H 10.196 9.764 -3.873 1.00 . B 2 . 19 C H5 1 1
1 600 2 1 9 C H5' H 9.672 12.151 1.005 1.00 . B 2 . 19 C H5' 1 1
1 601 2 1 9 C H5'' H 11.345 12.713 1.200 1.00 . B 2 . 19 C H5'' 1 1
1 602 2 1 9 C H6 H 10.732 10.169 -1.526 1.00 . B 2 . 19 C H6 1 1
1 603 2 1 9 C HO2' H 12.426 8.774 2.635 1.00 . B 2 . 19 C HO2' 1 1
1 604 2 1 9 C N1 N 10.366 8.157 -0.942 1.00 . B 2 . 19 C N1 1 1
1 605 2 1 9 C N3 N 9.692 6.642 -2.626 1.00 . B 2 . 19 C N3 1 1
1 606 2 1 9 C N4 N 9.451 7.338 -4.794 1.00 . B 2 . 19 C N4 1 1
1 607 2 1 9 C O2 O 9.937 5.979 -0.482 1.00 . B 2 . 19 C O2 1 1
1 608 2 1 9 C O2' O 12.532 8.041 2.024 1.00 . B 2 . 19 C O2' 1 1
1 609 2 1 9 C O3' O 13.459 10.357 1.522 1.00 . B 2 . 19 C O3' 1 1
1 610 2 1 9 C O4' O 10.102 9.633 0.888 1.00 . B 2 . 19 C O4' 1 1
1 611 2 1 9 C O5' O 10.844 12.052 -0.688 1.00 . B 2 . 19 C O5' 1 1
1 612 2 1 9 C OP1 O 10.846 14.554 -0.806 1.00 . B 2 . 19 C OP1 1 1
1 613 2 1 9 C OP2 O 10.546 13.142 -2.923 1.00 . B 2 . 19 C OP2 1 1
1 614 2 1 9 C P P 10.309 13.349 -1.477 1.00 . B 2 . 19 C P 1 1
1 615 2 1 10 C C1' C 14.595 5.198 -0.365 1.00 . B 2 . 20 C C1' 1 1
1 616 2 1 10 C C2 C 13.507 5.066 -2.553 1.00 . B 2 . 20 C C2 1 1
1 617 2 1 10 C C2' C 16.109 5.012 -0.411 1.00 . B 2 . 20 C C2' 1 1
1 618 2 1 10 C C3' C 16.606 6.285 0.257 1.00 . B 2 . 20 C C3' 1 1
1 619 2 1 10 C C4 C 13.085 6.988 -3.833 1.00 . B 2 . 20 C C4 1 1
1 620 2 1 10 C C4' C 15.571 6.479 1.355 1.00 . B 2 . 20 C C4' 1 1
1 621 2 1 10 C C5 C 13.669 7.818 -2.825 1.00 . B 2 . 20 C C5 1 1
1 622 2 1 10 C C5' C 15.410 7.919 1.833 1.00 . B 2 . 20 C C5' 1 1
1 623 2 1 10 C C6 C 14.148 7.220 -1.718 1.00 . B 2 . 20 C C6 1 1
1 624 2 1 10 C H1' H 14.086 4.244 -0.230 1.00 . B 2 . 20 C H1' 1 1
1 625 2 1 10 C H2' H 16.464 4.945 -1.440 1.00 . B 2 . 20 C H2' 1 1
1 626 2 1 10 C H3' H 16.601 7.123 -0.440 1.00 . B 2 . 20 C H3' 1 1
1 627 2 1 10 C H4' H 15.801 5.847 2.213 1.00 . B 2 . 20 C H4' 1 1
1 628 2 1 10 C H41 H 12.138 6.913 -5.633 1.00 . B 2 . 20 C H41 1 1
1 629 2 1 10 C H42 H 12.668 8.502 -5.128 1.00 . B 2 . 20 C H42 1 1
1 630 2 1 10 C H5 H 13.728 8.901 -2.940 1.00 . B 2 . 20 C H5 1 1
1 631 2 1 10 C H5' H 14.516 7.990 2.453 1.00 . B 2 . 20 C H5' 1 1
1 632 2 1 10 C H5'' H 16.280 8.195 2.429 1.00 . B 2 . 20 C H5'' 1 1
1 633 2 1 10 C H6 H 14.599 7.823 -0.930 1.00 . B 2 . 20 C H6 1 1
1 634 2 1 10 C HO2' H 17.267 3.484 -0.084 1.00 . B 2 . 20 C HO2' 1 1
1 635 2 1 10 C HO3' H 18.309 6.950 0.923 1.00 . B 2 . 20 C HO3' 1 1
1 636 2 1 10 C N1 N 14.074 5.866 -1.573 1.00 . B 2 . 20 C N1 1 1
1 637 2 1 10 C N3 N 13.019 5.659 -3.677 1.00 . B 2 . 20 C N3 1 1
1 638 2 1 10 C N4 N 12.591 7.510 -4.955 1.00 . B 2 . 20 C N4 1 1
1 639 2 1 10 C O2 O 13.452 3.848 -2.400 1.00 . B 2 . 20 C O2 1 1
1 640 2 1 10 C O2' O 16.497 3.863 0.346 1.00 . B 2 . 20 C O2' 1 1
1 641 2 1 10 C O3' O 17.906 6.085 0.820 1.00 . B 2 . 20 C O3' 1 1
1 642 2 1 10 C O4' O 14.342 6.039 0.769 1.00 . B 2 . 20 C O4' 1 1
1 643 2 1 10 C O5' O 15.289 8.826 0.734 1.00 . B 2 . 20 C O5' 1 1
1 644 2 1 10 C OP1 O 15.846 10.853 2.097 1.00 . B 2 . 20 C OP1 1 1
1 645 2 1 10 C OP2 O 15.003 11.084 -0.312 1.00 . B 2 . 20 C OP2 1 1
1 646 2 1 10 C P P 14.979 10.385 0.992 1.00 . B 2 . 20 C P 1 1
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