###################################
# Assigned chemical shift lists #
###################################
###################################################################
# Chemical Shift Ambiguity Index Value Definitions #
# #
# The values other than 1 are used for those atoms with different #
# chemical shifts that cannot be assigned to stereospecific atoms #
# or to specific residues or chains. #
# #
# Index Value Definition #
# #
# 1 Unique (including isolated methyl protons, #
# geminal atoms, and geminal methyl #
# groups with identical chemical shifts) #
# (e.g. ILE HD11, HD12, HD13 protons) #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups (e.g. ASP HB2 and HB3 #
# protons, LEU CD1 and CD2 carbons, or #
# LEU HD11, HD12, HD13 and HD21, HD22, #
# HD23 methyl protons) #
# 3 Aromatic atoms on opposite sides of #
# symmetrical rings (e.g. TYR HE1 and HE2 #
# protons) #
# 4 Intraresidue ambiguities (e.g. LYS HG and #
# HD protons or TRP HZ2 and HZ3 protons) #
# 5 Interresidue ambiguities (LYS 12 vs. LYS 27) #
# 6 Intermolecular ambiguities (e.g. ASP 31 CA #
# in monomer 1 and ASP 31 CA in monomer 2 #
# of an asymmetrical homodimer, duplex #
# DNA assignments, or other assignments #
# that may apply to atoms in one or more #
# molecule in the molecular assembly) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30923
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
1 '2D 1H-1H NOESY' . . . 30923 1
2 '2D 1H-1H NOESY' . . . 30923 1
3 '2D 1H-13C HSQC aromatic' . . . 30923 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 1 1 DT H1' H 1 5.754 0.003 . 1 . . 2097 . A 4 DT H1' . 30923 1
2 . 1 . 1 1 1 DT H2' H 1 1.510 0.002 . 1 . . 2099 . A 4 DT H2' . 30923 1
3 . 1 . 1 1 1 DT H2'' H 1 1.965 0.004 . 1 . . 2098 . A 4 DT H2'' . 30923 1
4 . 1 . 1 1 1 DT H3' H 1 4.394 0.003 . 1 . . 2200 . A 4 DT H3' . 30923 1
5 . 1 . 1 1 1 DT H4' H 1 3.779 0.003 . 1 . . 2241 . A 4 DT H4' . 30923 1
6 . 1 . 1 1 1 DT H5' H 1 3.430 0.002 . 2 . . 2242 . A 4 DT H5' . 30923 1
7 . 1 . 1 1 1 DT H5'' H 1 3.433 0.003 . 2 . . 2243 . A 4 DT H5'' . 30923 1
8 . 1 . 1 1 1 DT H6 H 1 7.181 0.001 . 1 . . 2100 . A 4 DT H6 . 30923 1
9 . 1 . 1 1 1 DT H71 H 1 1.616 0.001 . 1 . . 2101 . A 4 DT H71 . 30923 1
10 . 1 . 1 1 1 DT H72 H 1 1.616 0.001 . 1 . . 2101 . A 4 DT H72 . 30923 1
11 . 1 . 1 1 1 DT H73 H 1 1.616 0.001 . 1 . . 2101 . A 4 DT H73 . 30923 1
12 . 1 . 1 1 1 DT C6 C 13 139.788 . . 1 . . 2372 . A 4 DT C6 . 30923 1
13 . 1 . 1 2 2 DG H1' H 1 5.547 0.001 . 1 . . 2103 . A 5 DG H1' . 30923 1
14 . 1 . 1 2 2 DG H2' H 1 2.304 0.002 . 1 . . 2105 . A 5 DG H2' . 30923 1
15 . 1 . 1 2 2 DG H2'' H 1 2.206 0.001 . 1 . . 2104 . A 5 DG H2'' . 30923 1
16 . 1 . 1 2 2 DG H3' H 1 4.710 0.002 . 1 . . 2201 . A 5 DG H3' . 30923 1
17 . 1 . 1 2 2 DG H4' H 1 4.002 0.002 . 1 . . 2244 . A 5 DG H4' . 30923 1
18 . 1 . 1 2 2 DG H5' H 1 3.744 0.004 . 2 . . 2254 . A 5 DG H5' . 30923 1
19 . 1 . 1 2 2 DG H5'' H 1 3.619 0.003 . 2 . . 2255 . A 5 DG H5'' . 30923 1
20 . 1 . 1 2 2 DG H8 H 1 7.477 0.001 . 1 . . 2102 . A 5 DG H8 . 30923 1
21 . 1 . 1 2 2 DG C8 C 13 139.210 . . 1 . . 2373 . A 5 DG C8 . 30923 1
22 . 1 . 1 3 3 DA H1' H 1 6.212 0.002 . 1 . . 2107 . A 6 DA H1' . 30923 1
23 . 1 . 1 3 3 DA H2 H 1 7.855 0.002 . 1 . . 2230 . A 6 DA H2 . 30923 1
24 . 1 . 1 3 3 DA H2' H 1 2.691 0.001 . 1 . . 2109 . A 6 DA H2' . 30923 1
25 . 1 . 1 3 3 DA H2'' H 1 2.735 0.003 . 1 . . 2108 . A 6 DA H2'' . 30923 1
26 . 1 . 1 3 3 DA H3' H 1 4.956 0.003 . 1 . . 2202 . A 6 DA H3' . 30923 1
27 . 1 . 1 3 3 DA H4' H 1 4.237 0.001 . 1 . . 2236 . A 6 DA H4' . 30923 1
28 . 1 . 1 3 3 DA H5' H 1 3.975 0.003 . 2 . . 2278 . A 6 DA H5' . 30923 1
29 . 1 . 1 3 3 DA H5'' H 1 4.007 0.002 . 2 . . 2279 . A 6 DA H5'' . 30923 1
30 . 1 . 1 3 3 DA H8 H 1 8.173 0.001 . 1 . . 2106 . A 6 DA H8 . 30923 1
31 . 1 . 1 3 3 DA C2 C 13 155.348 . . 1 . . 2384 . A 6 DA C2 . 30923 1
32 . 1 . 1 3 3 DA C8 C 13 142.284 . . 1 . . 2380 . A 6 DA C8 . 30923 1
33 . 1 . 1 4 4 DG H1 H 1 11.445 0.004 . 1 . . 2189 . A 7 DG H1 . 30923 1
34 . 1 . 1 4 4 DG H1' H 1 6.069 0.003 . 1 . . 2111 . A 7 DG H1' . 30923 1
35 . 1 . 1 4 4 DG H2' H 1 2.739 0.002 . 1 . . 2113 . A 7 DG H2' . 30923 1
36 . 1 . 1 4 4 DG H2'' H 1 3.009 0.002 . 1 . . 2114 . A 7 DG H2'' . 30923 1
37 . 1 . 1 4 4 DG H3' H 1 5.010 0.003 . 1 . . 2203 . A 7 DG H3' . 30923 1
38 . 1 . 1 4 4 DG H4' H 1 4.501 0.001 . 1 . . 2246 . A 7 DG H4' . 30923 1
39 . 1 . 1 4 4 DG H5' H 1 4.180 0.004 . 2 . . 2276 . A 7 DG H5' . 30923 1
40 . 1 . 1 4 4 DG H5'' H 1 4.233 0.002 . 2 . . 2277 . A 7 DG H5'' . 30923 1
41 . 1 . 1 4 4 DG H8 H 1 8.066 0.002 . 1 . . 2110 . A 7 DG H8 . 30923 1
42 . 1 . 1 4 4 DG C8 C 13 138.788 . . 1 . . 2376 . A 7 DG C8 . 30923 1
43 . 1 . 1 5 5 DG H1 H 1 11.037 0.002 . 1 . . 2190 . A 8 DG H1 . 30923 1
44 . 1 . 1 5 5 DG H1' H 1 6.101 0.001 . 1 . . 2115 . A 8 DG H1' . 30923 1
45 . 1 . 1 5 5 DG H2' H 1 2.573 0.003 . 1 . . 2117 . A 8 DG H2' . 30923 1
46 . 1 . 1 5 5 DG H2'' H 1 2.885 0.002 . 1 . . 2116 . A 8 DG H2'' . 30923 1
47 . 1 . 1 5 5 DG H3' H 1 5.018 0.002 . 1 . . 2204 . A 8 DG H3' . 30923 1
48 . 1 . 1 5 5 DG H4' H 1 4.539 0.001 . 1 . . 2250 . A 8 DG H4' . 30923 1
49 . 1 . 1 5 5 DG H5' H 1 4.298 . . 2 . . 2282 . A 8 DG H5' . 30923 1
50 . 1 . 1 5 5 DG H5'' H 1 4.315 . . 2 . . 2283 . A 8 DG H5'' . 30923 1
51 . 1 . 1 5 5 DG H8 H 1 7.641 0.002 . 1 . . 2112 . A 8 DG H8 . 30923 1
52 . 1 . 1 5 5 DG C8 C 13 137.826 . . 1 . . 2374 . A 8 DG C8 . 30923 1
53 . 1 . 1 6 6 DG H1 H 1 10.786 0.002 . 1 . . 2191 . A 9 DG H1 . 30923 1
54 . 1 . 1 6 6 DG H1' H 1 6.344 0.001 . 1 . . 2118 . A 9 DG H1' . 30923 1
55 . 1 . 1 6 6 DG H2' H 1 2.745 0.001 . 1 . . 2119 . A 9 DG H2' . 30923 1
56 . 1 . 1 6 6 DG H2'' H 1 2.672 0.002 . 1 . . 2120 . A 9 DG H2'' . 30923 1
57 . 1 . 1 6 6 DG H3' H 1 5.178 . . 1 . . 2205 . A 9 DG H3' . 30923 1
58 . 1 . 1 6 6 DG H4' H 1 4.589 . . 1 . . 2234 . A 9 DG H4' . 30923 1
59 . 1 . 1 6 6 DG H5' H 1 4.315 0.003 . 2 . . 2264 . A 9 DG H5' . 30923 1
60 . 1 . 1 6 6 DG H5'' H 1 4.355 0.001 . 2 . . 2265 . A 9 DG H5'' . 30923 1
61 . 1 . 1 6 6 DG H8 H 1 7.597 0.001 . 1 . . 2391 . A 9 DG H8 . 30923 1
62 . 1 . 1 6 6 DG C8 C 13 138.002 . . 1 . . 2392 . A 9 DG C8 . 30923 1
63 . 1 . 1 7 7 DT H1' H 1 6.540 0.002 . 1 . . 2180 . A 10 DT H1' . 30923 1
64 . 1 . 1 7 7 DT H2' H 1 2.496 0.002 . 1 . . 2183 . A 10 DT H2' . 30923 1
65 . 1 . 1 7 7 DT H2'' H 1 2.691 0.002 . 1 . . 2182 . A 10 DT H2'' . 30923 1
66 . 1 . 1 7 7 DT H3' H 1 5.111 0.002 . 1 . . 2207 . A 10 DT H3' . 30923 1
67 . 1 . 1 7 7 DT H4' H 1 4.607 0.004 . 1 . . 2239 . A 10 DT H4' . 30923 1
68 . 1 . 1 7 7 DT H5' H 1 4.298 0.001 . 2 . . 2269 . A 10 DT H5' . 30923 1
69 . 1 . 1 7 7 DT H5'' H 1 4.358 0.001 . 2 . . 2270 . A 10 DT H5'' . 30923 1
70 . 1 . 1 7 7 DT H6 H 1 7.887 0.002 . 1 . . 2388 . A 10 DT H6 . 30923 1
71 . 1 . 1 7 7 DT H71 H 1 2.017 0.002 . 1 . . 2177 . A 10 DT H71 . 30923 1
72 . 1 . 1 7 7 DT H72 H 1 2.017 0.002 . 1 . . 2177 . A 10 DT H72 . 30923 1
73 . 1 . 1 7 7 DT H73 H 1 2.017 0.002 . 1 . . 2177 . A 10 DT H73 . 30923 1
74 . 1 . 1 7 7 DT C6 C 13 140.265 . . 1 . . 2389 . A 10 DT C6 . 30923 1
75 . 1 . 1 8 8 DG H1 H 1 11.224 0.002 . 1 . . 2197 . A 11 DG H1 . 30923 1
76 . 1 . 1 8 8 DG H1' H 1 6.083 0.002 . 1 . . 2143 . A 11 DG H1' . 30923 1
77 . 1 . 1 8 8 DG H2' H 1 2.407 0.002 . 1 . . 2145 . A 11 DG H2' . 30923 1
78 . 1 . 1 8 8 DG H2'' H 1 2.868 0.002 . 1 . . 2144 . A 11 DG H2'' . 30923 1
79 . 1 . 1 8 8 DG H3' H 1 5.092 0.002 . 1 . . 2208 . A 11 DG H3' . 30923 1
80 . 1 . 1 8 8 DG H4' H 1 4.484 0.001 . 1 . . 2248 . A 11 DG H4' . 30923 1
81 . 1 . 1 8 8 DG H5' H 1 4.350 0.0 . 2 . . 2258 . A 11 DG H5' . 30923 1
82 . 1 . 1 8 8 DG H5'' H 1 4.290 0.001 . 2 . . 2259 . A 11 DG H5'' . 30923 1
83 . 1 . 1 8 8 DG H8 H 1 7.931 0.001 . 1 . . 2142 . A 11 DG H8 . 30923 1
84 . 1 . 1 8 8 DG C8 C 13 138.122 . . 1 . . 2378 . A 11 DG C8 . 30923 1
85 . 1 . 1 9 9 DG H1 H 1 11.222 0.001 . 1 . . 2196 . A 12 DG H1 . 30923 1
86 . 1 . 1 9 9 DG H1' H 1 6.058 0.003 . 1 . . 2149 . A 12 DG H1' . 30923 1
87 . 1 . 1 9 9 DG H2' H 1 2.602 0.002 . 1 . . 2151 . A 12 DG H2' . 30923 1
88 . 1 . 1 9 9 DG H2'' H 1 2.796 0.002 . 1 . . 2150 . A 12 DG H2'' . 30923 1
89 . 1 . 1 9 9 DG H3' H 1 5.051 0.002 . 1 . . 2209 . A 12 DG H3' . 30923 1
90 . 1 . 1 9 9 DG H4' H 1 4.394 0.0 . 1 . . 2284 . A 12 DG H4' . 30923 1
91 . 1 . 1 9 9 DG H5' H 1 4.184 0.004 . 2 . . 2288 . A 12 DG H5' . 30923 1
92 . 1 . 1 9 9 DG H5'' H 1 4.262 0.004 . 2 . . 2289 . A 12 DG H5'' . 30923 1
93 . 1 . 1 9 9 DG H8 H 1 7.791 0.001 . 1 . . 2146 . A 12 DG H8 . 30923 1
94 . 1 . 1 9 9 DG C8 C 13 138.429 . . 1 . . 2395 . A 12 DG C8 . 30923 1
95 . 1 . 1 10 10 DG H1 H 1 10.979 0.003 . 1 . . 2195 . A 13 DG H1 . 30923 1
96 . 1 . 1 10 10 DG H1' H 1 6.346 0.001 . 1 . . 2148 . A 13 DG H1' . 30923 1
97 . 1 . 1 10 10 DG H2' H 1 2.758 0.004 . 1 . . 2153 . A 13 DG H2' . 30923 1
98 . 1 . 1 10 10 DG H2'' H 1 2.631 0.001 . 1 . . 2152 . A 13 DG H2'' . 30923 1
99 . 1 . 1 10 10 DG H3' H 1 5.058 0.001 . 1 . . 2210 . A 13 DG H3' . 30923 1
100 . 1 . 1 10 10 DG H4' H 1 4.496 0.001 . 1 . . 2235 . A 13 DG H4' . 30923 1
101 . 1 . 1 10 10 DG H5' H 1 4.264 0.002 . 2 . . 2290 . A 13 DG H5' . 30923 1
102 . 1 . 1 10 10 DG H5'' H 1 4.284 0.001 . 2 . . 2291 . A 13 DG H5'' . 30923 1
103 . 1 . 1 10 10 DG H8 H 1 7.780 0.001 . 1 . . 2147 . A 13 DG H8 . 30923 1
104 . 1 . 1 10 10 DG C8 C 13 138.133 . . 1 . . 2394 . A 13 DG C8 . 30923 1
105 . 1 . 1 11 11 DT H1' H 1 6.265 0.002 . 1 . . 2127 . A 14 DT H1' . 30923 1
106 . 1 . 1 11 11 DT H2' H 1 2.249 0.001 . 1 . . 2129 . A 14 DT H2' . 30923 1
107 . 1 . 1 11 11 DT H2'' H 1 2.483 0.003 . 1 . . 2128 . A 14 DT H2'' . 30923 1
108 . 1 . 1 11 11 DT H3' H 1 4.748 0.002 . 1 . . 2211 . A 14 DT H3' . 30923 1
109 . 1 . 1 11 11 DT H4' H 1 3.897 0.003 . 1 . . 2268 . A 14 DT H4' . 30923 1
110 . 1 . 1 11 11 DT H5' H 1 3.788 . . 2 . . 2366 . A 14 DT H5' . 30923 1
111 . 1 . 1 11 11 DT H5'' H 1 3.756 . . 2 . . 2367 . A 14 DT H5'' . 30923 1
112 . 1 . 1 11 11 DT H6 H 1 7.688 0.001 . 1 . . 2125 . A 14 DT H6 . 30923 1
113 . 1 . 1 11 11 DT H71 H 1 1.962 0.003 . 1 . . 2126 . A 14 DT H71 . 30923 1
114 . 1 . 1 11 11 DT H72 H 1 1.962 0.003 . 1 . . 2126 . A 14 DT H72 . 30923 1
115 . 1 . 1 11 11 DT H73 H 1 1.962 0.003 . 1 . . 2126 . A 14 DT H73 . 30923 1
116 . 1 . 1 11 11 DT C6 C 13 140.453 . . 1 . . 2386 . A 14 DT C6 . 30923 1
117 . 1 . 1 12 12 DA H1' H 1 6.688 0.003 . 1 . . 2122 . A 15 DA H1' . 30923 1
118 . 1 . 1 12 12 DA H2 H 1 8.384 0.001 . 1 . . 2130 . A 15 DA H2 . 30923 1
119 . 1 . 1 12 12 DA H2' H 1 3.103 0.003 . 1 . . 2124 . A 15 DA H2' . 30923 1
120 . 1 . 1 12 12 DA H2'' H 1 2.961 0.003 . 1 . . 2123 . A 15 DA H2'' . 30923 1
121 . 1 . 1 12 12 DA H3' H 1 5.186 0.001 . 1 . . 2198 . A 15 DA H3' . 30923 1
122 . 1 . 1 12 12 DA H4' H 1 4.605 0.001 . 1 . . 2232 . A 15 DA H4' . 30923 1
123 . 1 . 1 12 12 DA H5' H 1 4.305 0.004 . 2 . . 2251 . A 15 DA H5' . 30923 1
124 . 1 . 1 12 12 DA H5'' H 1 4.215 0.004 . 2 . . 2252 . A 15 DA H5'' . 30923 1
125 . 1 . 1 12 12 DA H8 H 1 8.573 0.001 . 1 . . 2121 . A 15 DA H8 . 30923 1
126 . 1 . 1 12 12 DA C2 C 13 155.959 . . 1 . . 2385 . A 15 DA C2 . 30923 1
127 . 1 . 1 12 12 DA C8 C 13 143.806 . . 1 . . 2383 . A 15 DA C8 . 30923 1
128 . 1 . 1 13 13 DG H1 H 1 11.438 0.002 . 1 . . 2194 . A 16 DG H1 . 30923 1
129 . 1 . 1 13 13 DG H1' H 1 6.082 0.002 . 1 . . 2133 . A 16 DG H1' . 30923 1
130 . 1 . 1 13 13 DG H2' H 1 2.543 0.003 . 1 . . 2135 . A 16 DG H2' . 30923 1
131 . 1 . 1 13 13 DG H2'' H 1 2.932 0.001 . 1 . . 2134 . A 16 DG H2'' . 30923 1
132 . 1 . 1 13 13 DG H3' H 1 5.010 0.002 . 1 . . 2199 . A 16 DG H3' . 30923 1
133 . 1 . 1 13 13 DG H4' H 1 4.491 0.002 . 1 . . 2247 . A 16 DG H4' . 30923 1
134 . 1 . 1 13 13 DG H5' H 1 4.211 0.002 . 2 . . 2256 . A 16 DG H5' . 30923 1
135 . 1 . 1 13 13 DG H5'' H 1 4.304 0.002 . 2 . . 2257 . A 16 DG H5'' . 30923 1
136 . 1 . 1 13 13 DG H8 H 1 8.006 0.001 . 1 . . 2132 . A 16 DG H8 . 30923 1
137 . 1 . 1 13 13 DG C8 C 13 138.469 . . 1 . . 2377 . A 16 DG C8 . 30923 1
138 . 1 . 1 14 14 DG H1 H 1 11.029 0.002 . 1 . . 2193 . A 17 DG H1 . 30923 1
139 . 1 . 1 14 14 DG H1' H 1 6.137 0.002 . 1 . . 2136 . A 17 DG H1' . 30923 1
140 . 1 . 1 14 14 DG H2' H 1 2.615 0.002 . 1 . . 2138 . A 17 DG H2' . 30923 1
141 . 1 . 1 14 14 DG H2'' H 1 2.935 0.002 . 1 . . 2137 . A 17 DG H2'' . 30923 1
142 . 1 . 1 14 14 DG H3' H 1 5.026 0.002 . 1 . . 2212 . A 17 DG H3' . 30923 1
143 . 1 . 1 14 14 DG H4' H 1 4.545 0.001 . 1 . . 2237 . A 17 DG H4' . 30923 1
144 . 1 . 1 14 14 DG H5' H 1 4.252 . . 2 . . 2368 . A 17 DG H5' . 30923 1
145 . 1 . 1 14 14 DG H5'' H 1 4.222 0.001 . 2 . . 2369 . A 17 DG H5'' . 30923 1
146 . 1 . 1 14 14 DG H8 H 1 7.721 0.001 . 1 . . 2131 . A 17 DG H8 . 30923 1
147 . 1 . 1 14 14 DG C8 C 13 138.104 . . 1 . . 2390 . A 17 DG C8 . 30923 1
148 . 1 . 1 15 15 DG H1 H 1 10.624 0.003 . 1 . . 2192 . A 18 DG H1 . 30923 1
149 . 1 . 1 15 15 DG H1' H 1 6.402 0.001 . 1 . . 2139 . A 18 DG H1' . 30923 1
150 . 1 . 1 15 15 DG H2' H 1 2.792 0.001 . 1 . . 2141 . A 18 DG H2' . 30923 1
151 . 1 . 1 15 15 DG H2'' H 1 2.702 . . 1 . . 2140 . A 18 DG H2'' . 30923 1
152 . 1 . 1 15 15 DG H3' H 1 5.182 0.001 . 1 . . 2213 . A 18 DG H3' . 30923 1
153 . 1 . 1 15 15 DG H4' H 1 4.609 0.002 . 1 . . 2233 . A 18 DG H4' . 30923 1
154 . 1 . 1 15 15 DG H5' H 1 4.327 0.003 . 2 . . 2273 . A 18 DG H5' . 30923 1
155 . 1 . 1 15 15 DG H5'' H 1 4.373 0.003 . 2 . . 2274 . A 18 DG H5'' . 30923 1
156 . 1 . 1 15 15 DG H8 H 1 7.749 0.001 . 1 . . 2398 . A 18 DG H8 . 30923 1
157 . 1 . 1 15 15 DG C8 C 13 138.207 . . 1 . . 2399 . A 18 DG C8 . 30923 1
158 . 1 . 1 16 16 DT H1' H 1 6.542 0.002 . 1 . . 2181 . A 19 DT H1' . 30923 1
159 . 1 . 1 16 16 DT H2' H 1 2.497 0.001 . 1 . . 2184 . A 19 DT H2' . 30923 1
160 . 1 . 1 16 16 DT H2'' H 1 2.690 0.003 . 1 . . 2185 . A 19 DT H2'' . 30923 1
161 . 1 . 1 16 16 DT H3' H 1 5.111 0.001 . 1 . . 2206 . A 19 DT H3' . 30923 1
162 . 1 . 1 16 16 DT H4' H 1 4.593 0.001 . 1 . . 2240 . A 19 DT H4' . 30923 1
163 . 1 . 1 16 16 DT H5' H 1 4.311 0.001 . 2 . . 2266 . A 19 DT H5' . 30923 1
164 . 1 . 1 16 16 DT H5'' H 1 4.375 0.001 . 2 . . 2267 . A 19 DT H5'' . 30923 1
165 . 1 . 1 16 16 DT H6 H 1 7.888 0.001 . 1 . . 2178 . A 19 DT H6 . 30923 1
166 . 1 . 1 16 16 DT H71 H 1 2.018 0.002 . 1 . . 2179 . A 19 DT H71 . 30923 1
167 . 1 . 1 16 16 DT H72 H 1 2.018 0.002 . 1 . . 2179 . A 19 DT H72 . 30923 1
168 . 1 . 1 16 16 DT H73 H 1 2.018 0.002 . 1 . . 2179 . A 19 DT H73 . 30923 1
169 . 1 . 1 16 16 DT C6 C 13 140.265 . . 1 . . 2387 . A 19 DT C6 . 30923 1
170 . 1 . 1 17 17 DG H1 H 1 11.260 0.003 . 1 . . 2188 . A 20 DG H1 . 30923 1
171 . 1 . 1 17 17 DG H1' H 1 5.936 0.001 . 1 . . 2155 . A 20 DG H1' . 30923 1
172 . 1 . 1 17 17 DG H2' H 1 2.331 0.002 . 1 . . 2156 . A 20 DG H2' . 30923 1
173 . 1 . 1 17 17 DG H2'' H 1 2.774 0.002 . 1 . . 2157 . A 20 DG H2'' . 30923 1
174 . 1 . 1 17 17 DG H3' H 1 5.083 0.001 . 1 . . 2214 . A 20 DG H3' . 30923 1
175 . 1 . 1 17 17 DG H4' H 1 4.439 0.002 . 1 . . 2245 . A 20 DG H4' . 30923 1
176 . 1 . 1 17 17 DG H5' H 1 4.265 0.003 . 2 . . 2280 . A 20 DG H5' . 30923 1
177 . 1 . 1 17 17 DG H5'' H 1 4.338 0.001 . 2 . . 2281 . A 20 DG H5'' . 30923 1
178 . 1 . 1 17 17 DG H8 H 1 7.849 0.002 . 1 . . 2154 . A 20 DG H8 . 30923 1
179 . 1 . 1 17 17 DG C8 C 13 138.076 . . 1 . . 2379 . A 20 DG C8 . 30923 1
180 . 1 . 1 18 18 DG H1 H 1 11.197 0.001 . 1 . . 2187 . A 21 DG H1 . 30923 1
181 . 1 . 1 18 18 DG H1' H 1 5.987 0.003 . 1 . . 2158 . A 21 DG H1' . 30923 1
182 . 1 . 1 18 18 DG H2' H 1 2.664 0.003 . 1 . . 2159 . A 21 DG H2' . 30923 1
183 . 1 . 1 18 18 DG H2'' H 1 2.684 0.002 . 1 . . 2160 . A 21 DG H2'' . 30923 1
184 . 1 . 1 18 18 DG H3' H 1 5.090 0.002 . 1 . . 2215 . A 21 DG H3' . 30923 1
185 . 1 . 1 18 18 DG H4' H 1 4.528 0.002 . 1 . . 2249 . A 21 DG H4' . 30923 1
186 . 1 . 1 18 18 DG H5' H 1 4.182 0.001 . 2 . . 2262 . A 21 DG H5' . 30923 1
187 . 1 . 1 18 18 DG H5'' H 1 4.280 0.004 . 2 . . 2263 . A 21 DG H5'' . 30923 1
188 . 1 . 1 18 18 DG H8 H 1 7.835 0.001 . 1 . . 2396 . A 21 DG H8 . 30923 1
189 . 1 . 1 18 18 DG C8 C 13 138.519 . . 1 . . 2397 . A 21 DG C8 . 30923 1
190 . 1 . 1 19 19 DG H1 H 1 10.636 0.003 . 1 . . 2186 . A 22 DG H1 . 30923 1
191 . 1 . 1 19 19 DG H1' H 1 6.164 0.002 . 1 . . 2162 . A 22 DG H1' . 30923 1
192 . 1 . 1 19 19 DG H2' H 1 2.376 0.003 . 1 . . 2164 . A 22 DG H2' . 30923 1
193 . 1 . 1 19 19 DG H2'' H 1 2.549 0.002 . 1 . . 2163 . A 22 DG H2'' . 30923 1
194 . 1 . 1 19 19 DG H3' H 1 5.021 0.002 . 1 . . 2216 . A 22 DG H3' . 30923 1
195 . 1 . 1 19 19 DG H4' H 1 4.481 0.001 . 1 . . 2238 . A 22 DG H4' . 30923 1
196 . 1 . 1 19 19 DG H5' H 1 4.235 . . 2 . . 2271 . A 22 DG H5' . 30923 1
197 . 1 . 1 19 19 DG H5'' H 1 4.280 0.001 . 2 . . 2272 . A 22 DG H5'' . 30923 1
198 . 1 . 1 19 19 DG H8 H 1 7.538 0.001 . 1 . . 2161 . A 22 DG H8 . 30923 1
199 . 1 . 1 19 19 DG C8 C 13 137.450 . . 1 . . 2375 . A 22 DG C8 . 30923 1
200 . 1 . 1 20 20 DG H1' H 1 5.611 0.002 . 1 . . 2166 . A 23 DG H1' . 30923 1
201 . 1 . 1 20 20 DG H2' H 1 2.493 0.002 . 1 . . 2168 . A 23 DG H2' . 30923 1
202 . 1 . 1 20 20 DG H2'' H 1 2.394 0.002 . 1 . . 2167 . A 23 DG H2'' . 30923 1
203 . 1 . 1 20 20 DG H3' H 1 4.896 0.002 . 1 . . 2231 . A 23 DG H3' . 30923 1
204 . 1 . 1 20 20 DG H4' H 1 4.367 0.003 . 1 . . 2286 . A 23 DG H4' . 30923 1
205 . 1 . 1 20 20 DG H5' H 1 4.173 0.005 . 2 . . 2370 . A 23 DG H5' . 30923 1
206 . 1 . 1 20 20 DG H5'' H 1 4.157 0.002 . 2 . . 2371 . A 23 DG H5'' . 30923 1
207 . 1 . 1 20 20 DG H8 H 1 7.785 0.002 . 1 . . 2165 . A 23 DG H8 . 30923 1
208 . 1 . 1 20 20 DG C8 C 13 139.894 . . 1 . . 2393 . A 23 DG C8 . 30923 1
209 . 1 . 1 21 21 DA H1' H 1 5.754 0.002 . 1 . . 2170 . A 24 DA H1' . 30923 1
210 . 1 . 1 21 21 DA H2 H 1 7.527 0.001 . 1 . . 2402 . A 24 DA H2 . 30923 1
211 . 1 . 1 21 21 DA H2' H 1 2.319 0.002 . 1 . . 2176 . A 24 DA H2' . 30923 1
212 . 1 . 1 21 21 DA H2'' H 1 2.388 0.001 . 1 . . 2175 . A 24 DA H2'' . 30923 1
213 . 1 . 1 21 21 DA H3' H 1 4.792 0.002 . 1 . . 2285 . A 24 DA H3' . 30923 1
214 . 1 . 1 21 21 DA H4' H 1 3.982 . . 1 . . 2556 . A 24 DA H4' . 30923 1
215 . 1 . 1 21 21 DA H5' H 1 3.885 . . 2 . . 2554 . A 24 DA H5' . 30923 1
216 . 1 . 1 21 21 DA H5'' H 1 3.963 . . 2 . . 2555 . A 24 DA H5'' . 30923 1
217 . 1 . 1 21 21 DA H8 H 1 7.976 0.002 . 1 . . 2169 . A 24 DA H8 . 30923 1
218 . 1 . 1 21 21 DA C2 C 13 154.994 . . 1 . . 2403 . A 24 DA C2 . 30923 1
219 . 1 . 1 21 21 DA C8 C 13 141.920 . . 1 . . 2382 . A 24 DA C8 . 30923 1
220 . 1 . 1 22 22 DA H1' H 1 5.987 0.001 . 1 . . 2172 . A 25 DA H1' . 30923 1
221 . 1 . 1 22 22 DA H2 H 1 7.659 0.001 . 1 . . 2400 . A 25 DA H2 . 30923 1
222 . 1 . 1 22 22 DA H2' H 1 2.470 0.002 . 1 . . 2174 . A 25 DA H2' . 30923 1
223 . 1 . 1 22 22 DA H2'' H 1 2.299 0.004 . 1 . . 2173 . A 25 DA H2'' . 30923 1
224 . 1 . 1 22 22 DA H3' H 1 4.552 0.002 . 1 . . 2253 . A 25 DA H3' . 30923 1
225 . 1 . 1 22 22 DA H4' H 1 4.004 . . 1 . . 2275 . A 25 DA H4' . 30923 1
226 . 1 . 1 22 22 DA H5' H 1 3.915 0.003 . 2 . . 2260 . A 25 DA H5' . 30923 1
227 . 1 . 1 22 22 DA H5'' H 1 3.998 0.002 . 2 . . 2261 . A 25 DA H5'' . 30923 1
228 . 1 . 1 22 22 DA H8 H 1 8.043 0.001 . 1 . . 2171 . A 25 DA H8 . 30923 1
229 . 1 . 1 22 22 DA C2 C 13 155.092 . . 1 . . 2401 . A 25 DA C2 . 30923 1
230 . 1 . 1 22 22 DA C8 C 13 142.108 . . 1 . . 2381 . A 25 DA C8 . 30923 1
231 . 2 . 2 1 1 BER H101 H 1 2.743 0.004 . 2 . . 2224 . A 101 BER H101 . 30923 1
232 . 2 . 2 1 1 BER H102 H 1 2.801 0.001 . 2 . . 2225 . A 101 BER H102 . 30923 1
233 . 2 . 2 1 1 BER H131 H 1 7.267 0.002 . 1 . . 2219 . A 101 BER H131 . 30923 1
234 . 2 . 2 1 1 BER H161 H 1 7.472 0.004 . 1 . . 2218 . A 101 BER H161 . 30923 1
235 . 2 . 2 1 1 BER H171 H 1 5.831 0.006 . 2 . . 2229 . A 101 BER H171 . 30923 1
236 . 2 . 2 1 1 BER H172 H 1 5.859 0.006 . 2 . . 2287 . A 101 BER H172 . 30923 1
237 . 2 . 2 1 1 BER H191 H 1 3.797 0.003 . 1 . . 2221 . A 101 BER H191 . 30923 1
238 . 2 . 2 1 1 BER H192 H 1 3.797 0.003 . 1 . . 2221 . A 101 BER H192 . 30923 1
239 . 2 . 2 1 1 BER H193 H 1 3.797 0.003 . 1 . . 2221 . A 101 BER H193 . 30923 1
240 . 2 . 2 1 1 BER H201 H 1 3.873 0.003 . 1 . . 2220 . A 101 BER H201 . 30923 1
241 . 2 . 2 1 1 BER H202 H 1 3.873 0.003 . 1 . . 2220 . A 101 BER H202 . 30923 1
242 . 2 . 2 1 1 BER H203 H 1 3.873 0.003 . 1 . . 2220 . A 101 BER H203 . 30923 1
243 . 2 . 2 1 1 BER H31 H 1 7.889 0.002 . 1 . . 2226 . A 101 BER H31 . 30923 1
244 . 2 . 2 1 1 BER H51 H 1 6.682 0.004 . 1 . . 2227 . A 101 BER H51 . 30923 1
245 . 2 . 2 1 1 BER H61 H 1 9.090 0.003 . 1 . . 2217 . A 101 BER H61 . 30923 1
246 . 2 . 2 1 1 BER H71 H 1 4.611 0.001 . 2 . . 2222 . A 101 BER H71 . 30923 1
247 . 2 . 2 1 1 BER H72 H 1 4.612 0.001 . 2 . . 2223 . A 101 BER H72 . 30923 1
248 . 2 . 2 1 1 BER H91 H 1 6.194 0.006 . 1 . . 2228 . A 101 BER H91 . 30923 1
249 . 2 . 2 1 1 BER C6 C 13 146.765 . . 1 . . 2414 . A 101 BER C6 . 30923 1
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