NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
397804 |
1t28   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t28
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 454
_Distance_constraint_stats_list.Viol_count 89
_Distance_constraint_stats_list.Viol_total 63.035
_Distance_constraint_stats_list.Viol_max 6.046
_Distance_constraint_stats_list.Viol_rms 0.6119
_Distance_constraint_stats_list.Viol_average_all_restraints 0.1388
_Distance_constraint_stats_list.Viol_average_violations_only 0.7083
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 1.038 0.559 1 1 [+]
1 2 G 8.082 3.292 1 1 [+]
1 3 U 5.779 3.292 1 1 [+]
1 4 C 0.506 0.450 1 0 "[ ]"
1 5 A 0.369 0.148 1 0 "[ ]"
1 6 U 3.834 2.760 1 1 [+]
1 7 C 3.729 2.760 1 1 [+]
1 8 G 3.516 3.326 1 1 [+]
1 9 U 33.094 6.046 1 1 [+]
1 10 U 31.024 6.046 1 1 [+]
1 11 G 0.057 0.038 1 0 "[ ]"
1 12 A 0.075 0.038 1 0 "[ ]"
1 13 G 0.062 0.032 1 0 "[ ]"
1 14 A 0.047 0.027 1 0 "[ ]"
1 15 A 0.057 0.038 1 0 "[ ]"
1 16 A 0.038 0.038 1 0 "[ ]"
1 17 A 0.000 0.000 . 0 "[ ]"
1 18 C 0.000 0.000 . 0 "[ ]"
1 19 G 0.040 0.040 1 0 "[ ]"
1 20 A 0.144 0.057 1 0 "[ ]"
1 21 A 0.145 0.057 1 0 "[ ]"
1 22 A 0.041 0.041 1 0 "[ ]"
1 23 C 0.055 0.055 1 0 "[ ]"
1 24 A 1.356 0.795 1 1 [+]
1 25 G 4.361 3.043 1 1 [+]
1 26 A 1.185 0.490 1 0 "[ ]"
1 27 C 1.058 0.490 1 0 "[ ]"
1 28 G 0.490 0.177 1 0 "[ ]"
1 29 G 1.057 0.520 1 1 [+]
1 30 U 0.563 0.332 1 0 "[ ]"
1 31 G 0.798 0.492 1 0 "[ ]"
1 32 G 2.082 1.468 1 1 [+]
1 33 C 7.774 2.825 1 1 [+]
1 34 C 4.792 2.180 1 1 [+]
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1' 1 1 G H2' 2.500 . 3.300 2.740 2.740 2.740 . 0 0 "[ ]" 1
2 1 1 G H1' 1 1 G H3' 3.500 2.700 4.300 3.890 3.890 3.890 . 0 0 "[ ]" 1
3 1 1 G H1' 1 1 G H4' 3.500 2.700 4.300 3.477 3.477 3.477 . 0 0 "[ ]" 1
4 1 1 G H1' 1 1 G H8 3.500 . 4.000 3.812 3.812 3.812 . 0 0 "[ ]" 1
5 1 1 G H1' 1 2 G H1' 4.300 3.300 4.800 3.328 3.328 3.328 . 0 0 "[ ]" 1
6 1 1 G H1' 1 2 G H2' 4.500 3.500 5.000 5.559 5.559 5.559 0.559 1 1 [+] 1
7 1 1 G H1' 1 2 G H8 4.800 2.600 5.300 4.263 4.263 4.263 . 0 0 "[ ]" 1
8 1 1 G H2' 1 1 G H3' 2.400 2.100 2.700 2.378 2.378 2.378 . 0 0 "[ ]" 1
9 1 1 G H2' 1 1 G H8 3.300 2.300 3.900 2.809 2.809 2.809 . 0 0 "[ ]" 1
10 1 1 G H2' 1 2 G H8 3.000 2.500 3.500 2.083 2.083 2.083 0.417 1 0 "[ ]" 1
11 1 1 G H3' 1 1 G H8 2.700 . 3.200 1.737 1.737 1.737 0.063 1 0 "[ ]" 1
12 1 1 G H3' 1 2 G H8 3.500 2.600 4.300 4.123 4.123 4.123 . 0 0 "[ ]" 1
13 1 1 G H4' 1 1 G H8 4.000 . 4.500 4.118 4.118 4.118 . 0 0 "[ ]" 1
14 1 1 G H5' 1 1 G H8 3.300 . 3.600 2.918 2.918 2.918 . 0 0 "[ ]" 1
15 1 1 G H8 1 2 G H8 4.500 . 5.600 4.662 4.662 4.662 . 0 0 "[ ]" 1
16 1 2 G H1 1 3 U H3 3.500 3.000 5.000 4.521 4.521 4.521 . 0 0 "[ ]" 1
17 1 2 G H1 1 32 G H1 3.500 3.000 5.000 6.468 6.468 6.468 1.468 1 1 [+] 1
18 1 2 G H1' 1 2 G H2' 2.500 . 3.300 2.755 2.755 2.755 . 0 0 "[ ]" 1
19 1 2 G H1' 1 2 G H3' 3.500 2.700 4.300 3.875 3.875 3.875 . 0 0 "[ ]" 1
20 1 2 G H1' 1 2 G H8 3.500 . 4.000 3.785 3.785 3.785 . 0 0 "[ ]" 1
21 1 2 G H1' 1 3 U H2' 4.000 3.000 4.500 7.792 7.792 7.792 3.292 1 1 [+] 1
22 1 2 G H1' 1 3 U H6 4.600 2.400 5.100 4.878 4.878 4.878 . 0 0 "[ ]" 1
23 1 2 G H2' 1 2 G H3' 2.400 2.100 2.700 2.382 2.382 2.382 . 0 0 "[ ]" 1
24 1 2 G H2' 1 2 G H4' 3.300 3.000 3.600 3.828 3.828 3.828 0.228 1 0 "[ ]" 1
25 1 2 G H2' 1 2 G H8 3.500 2.500 4.300 3.364 3.364 3.364 . 0 0 "[ ]" 1
26 1 2 G H2' 1 3 U H5 3.400 2.900 3.900 1.659 1.659 1.659 1.241 1 1 [+] 1
27 1 2 G H2' 1 3 U H6 3.300 2.800 3.800 2.350 2.350 2.350 0.450 1 0 "[ ]" 1
28 1 2 G H3' 1 2 G H4' 3.000 2.500 3.500 3.013 3.013 3.013 . 0 0 "[ ]" 1
29 1 2 G H3' 1 2 G H8 2.700 . 3.200 2.436 2.436 2.436 . 0 0 "[ ]" 1
30 1 2 G H3' 1 3 U H5 3.300 3.000 3.800 2.722 2.722 2.722 0.278 1 0 "[ ]" 1
31 1 2 G H3' 1 3 U H6 3.300 2.400 3.800 3.811 3.811 3.811 0.011 1 0 "[ ]" 1
32 1 2 G H4' 1 2 G H5' 2.400 . 2.800 2.479 2.479 2.479 . 0 0 "[ ]" 1
33 1 2 G H4' 1 2 G H8 4.000 . 4.500 4.222 4.222 4.222 . 0 0 "[ ]" 1
34 1 2 G H5' 1 2 G H8 3.300 . 3.600 3.738 3.738 3.738 0.138 1 0 "[ ]" 1
35 1 2 G H8 1 3 U H5 3.800 3.000 4.300 3.295 3.295 3.295 . 0 0 "[ ]" 1
36 1 2 G H8 1 3 U H6 4.500 2.700 5.600 5.361 5.361 5.361 . 0 0 "[ ]" 1
37 1 3 U H1' 1 3 U H2' 2.500 . 3.300 2.759 2.759 2.759 . 0 0 "[ ]" 1
38 1 3 U H1' 1 3 U H3' 3.500 2.700 4.300 3.883 3.883 3.883 . 0 0 "[ ]" 1
39 1 3 U H1' 1 3 U H6 3.500 . 4.000 3.611 3.611 3.611 . 0 0 "[ ]" 1
40 1 3 U H1' 1 4 C H6 4.600 2.400 5.100 4.788 4.788 4.788 . 0 0 "[ ]" 1
41 1 3 U H2' 1 3 U H3' 2.400 2.100 2.700 2.324 2.324 2.324 . 0 0 "[ ]" 1
42 1 3 U H2' 1 3 U H4' 3.800 . 4.100 3.887 3.887 3.887 . 0 0 "[ ]" 1
43 1 3 U H2' 1 3 U H6 3.800 . 4.100 3.120 3.120 3.120 . 0 0 "[ ]" 1
44 1 3 U H2' 1 4 C H5 3.400 2.900 3.900 2.450 2.450 2.450 0.450 1 0 "[ ]" 1
45 1 3 U H2' 1 4 C H6 2.300 . 3.300 2.340 2.340 2.340 . 0 0 "[ ]" 1
46 1 3 U H3 1 31 G H1 3.500 3.000 5.000 4.729 4.729 4.729 . 0 0 "[ ]" 1
47 1 3 U H3' 1 3 U H4' 3.000 2.500 3.500 3.031 3.031 3.031 . 0 0 "[ ]" 1
48 1 3 U H3' 1 3 U H6 2.700 . 3.200 1.978 1.978 1.978 . 0 0 "[ ]" 1
49 1 3 U H3' 1 4 C H5 3.300 2.800 3.800 2.953 2.953 2.953 . 0 0 "[ ]" 1
50 1 3 U H3' 1 4 C H6 3.300 2.400 3.800 3.817 3.817 3.817 0.017 1 0 "[ ]" 1
51 1 3 U H4' 1 3 U H5' 2.400 . 2.800 2.635 2.635 2.635 . 0 0 "[ ]" 1
52 1 3 U H4' 1 3 U H6 4.000 . 4.500 3.683 3.683 3.683 . 0 0 "[ ]" 1
53 1 3 U H5 1 3 U H6 2.300 . 2.800 2.421 2.421 2.421 . 0 0 "[ ]" 1
54 1 3 U H5 1 4 C H5 3.800 3.000 4.600 4.639 4.639 4.639 0.039 1 0 "[ ]" 1
55 1 3 U H5' 1 3 U H6 3.300 . 3.600 2.990 2.990 2.990 . 0 0 "[ ]" 1
56 1 3 U H6 1 4 C H5 3.800 2.800 4.300 3.878 3.878 3.878 . 0 0 "[ ]" 1
57 1 3 U H6 1 4 C H6 4.500 2.700 5.600 5.191 5.191 5.191 . 0 0 "[ ]" 1
58 1 4 C H1' 1 4 C H2' 2.500 . 3.300 2.779 2.779 2.779 . 0 0 "[ ]" 1
59 1 4 C H1' 1 4 C H3' 3.500 2.700 4.300 3.876 3.876 3.876 . 0 0 "[ ]" 1
60 1 4 C H1' 1 4 C H6 3.500 . 4.000 3.651 3.651 3.651 . 0 0 "[ ]" 1
61 1 4 C H1' 1 5 A H8 4.600 2.400 5.100 5.038 5.038 5.038 . 0 0 "[ ]" 1
62 1 4 C H2' 1 4 C H3' 2.400 2.100 2.700 2.293 2.293 2.293 . 0 0 "[ ]" 1
63 1 4 C H2' 1 4 C H4' 3.800 3.500 4.100 3.911 3.911 3.911 . 0 0 "[ ]" 1
64 1 4 C H2' 1 4 C H6 3.800 . 4.100 2.866 2.866 2.866 . 0 0 "[ ]" 1
65 1 4 C H2' 1 5 A H8 2.300 . 2.800 2.468 2.468 2.468 . 0 0 "[ ]" 1
66 1 4 C H3' 1 4 C H4' 3.000 2.500 3.500 3.041 3.041 3.041 . 0 0 "[ ]" 1
67 1 4 C H3' 1 4 C H6 2.700 . 3.200 1.845 1.845 1.845 . 0 0 "[ ]" 1
68 1 4 C H3' 1 5 A H8 3.400 2.500 3.900 3.865 3.865 3.865 . 0 0 "[ ]" 1
69 1 4 C H4' 1 4 C H5' 2.400 . 2.800 2.513 2.513 2.513 . 0 0 "[ ]" 1
70 1 4 C H4' 1 4 C H6 4.000 . 4.500 3.831 3.831 3.831 . 0 0 "[ ]" 1
71 1 4 C H5 1 4 C H6 2.300 . 2.800 2.449 2.449 2.449 . 0 0 "[ ]" 1
72 1 4 C H5' 1 4 C H6 3.300 . 3.600 3.529 3.529 3.529 . 0 0 "[ ]" 1
73 1 4 C H6 1 5 A H8 4.500 . 5.600 4.871 4.871 4.871 . 0 0 "[ ]" 1
74 1 5 A H1' 1 5 A H2' 2.500 . 3.300 2.768 2.768 2.768 . 0 0 "[ ]" 1
75 1 5 A H1' 1 5 A H3' 3.500 2.700 4.300 3.896 3.896 3.896 . 0 0 "[ ]" 1
76 1 5 A H1' 1 5 A H8 3.500 . 4.000 3.793 3.793 3.793 . 0 0 "[ ]" 1
77 1 5 A H1' 1 6 U H6 4.600 2.400 5.100 4.955 4.955 4.955 . 0 0 "[ ]" 1
78 1 5 A H2 1 6 U H1' 3.800 3.000 4.600 4.748 4.748 4.748 0.148 1 0 "[ ]" 1
79 1 5 A H2 1 30 U H3 2.900 2.100 3.400 3.416 3.416 3.416 0.016 1 0 "[ ]" 1
80 1 5 A H2 1 31 G H1' 3.800 2.600 4.300 4.380 4.380 4.380 0.080 1 0 "[ ]" 1
81 1 5 A H2 1 31 G H8 5.000 3.500 5.500 5.535 5.535 5.535 0.035 1 0 "[ ]" 1
82 1 5 A H2' 1 5 A H3' 2.400 2.100 2.700 2.284 2.284 2.284 . 0 0 "[ ]" 1
83 1 5 A H2' 1 5 A H4' 3.800 3.500 4.100 3.907 3.907 3.907 . 0 0 "[ ]" 1
84 1 5 A H2' 1 5 A H8 3.800 . 4.100 2.925 2.925 2.925 . 0 0 "[ ]" 1
85 1 5 A H2' 1 6 U H5 3.400 2.900 3.900 2.906 2.906 2.906 . 0 0 "[ ]" 1
86 1 5 A H2' 1 6 U H6 2.300 . 2.800 2.369 2.369 2.369 . 0 0 "[ ]" 1
87 1 5 A H3' 1 5 A H4' 3.000 2.500 3.500 3.036 3.036 3.036 . 0 0 "[ ]" 1
88 1 5 A H3' 1 5 A H8 2.700 . 3.200 2.140 2.140 2.140 . 0 0 "[ ]" 1
89 1 5 A H3' 1 6 U H5 3.300 2.800 3.800 2.872 2.872 2.872 . 0 0 "[ ]" 1
90 1 5 A H3' 1 6 U H6 3.300 2.400 3.800 3.685 3.685 3.685 . 0 0 "[ ]" 1
91 1 5 A H4' 1 5 A H5' 2.400 . 2.800 2.558 2.558 2.558 . 0 0 "[ ]" 1
92 1 5 A H4' 1 5 A H8 4.000 . 4.500 4.148 4.148 4.148 . 0 0 "[ ]" 1
93 1 5 A H5' 1 5 A H8 3.300 . 3.600 3.690 3.690 3.690 0.090 1 0 "[ ]" 1
94 1 5 A H8 1 6 U H6 4.500 . 5.600 4.742 4.742 4.742 . 0 0 "[ ]" 1
95 1 6 U H1' 1 6 U H2' 2.500 . 3.300 2.774 2.774 2.774 . 0 0 "[ ]" 1
96 1 6 U H1' 1 6 U H3' 3.500 2.700 4.300 3.875 3.875 3.875 . 0 0 "[ ]" 1
97 1 6 U H1' 1 6 U H6 3.500 . 4.000 3.635 3.635 3.635 . 0 0 "[ ]" 1
98 1 6 U H1' 1 7 C H2' 4.400 3.400 4.900 7.660 7.660 7.660 2.760 1 1 [+] 1
99 1 6 U H1' 1 7 C H6 4.600 2.400 5.100 5.209 5.209 5.209 0.109 1 0 "[ ]" 1
100 1 6 U H2' 1 6 U H3' 2.400 2.100 2.700 2.290 2.290 2.290 . 0 0 "[ ]" 1
101 1 6 U H2' 1 6 U H4' 3.800 3.500 4.100 3.916 3.916 3.916 . 0 0 "[ ]" 1
102 1 6 U H2' 1 6 U H6 3.800 . 4.100 2.879 2.879 2.879 . 0 0 "[ ]" 1
103 1 6 U H2' 1 7 C H5 3.400 2.900 3.900 2.130 2.130 2.130 0.770 1 1 [+] 1
104 1 6 U H2' 1 7 C H6 2.300 . 2.800 2.518 2.518 2.518 . 0 0 "[ ]" 1
105 1 6 U H3 1 28 G H1 3.500 3.000 5.000 4.822 4.822 4.822 . 0 0 "[ ]" 1
106 1 6 U H3 1 29 G H1 2.300 . 2.800 2.666 2.666 2.666 . 0 0 "[ ]" 1
107 1 6 U H3 1 30 U H3 3.500 3.000 5.000 3.755 3.755 3.755 . 0 0 "[ ]" 1
108 1 6 U H3' 1 6 U H4' 3.000 2.500 3.500 3.041 3.041 3.041 . 0 0 "[ ]" 1
109 1 6 U H3' 1 6 U H6 2.700 . 3.200 1.837 1.837 1.837 . 0 0 "[ ]" 1
110 1 6 U H3' 1 7 C H5 3.300 2.800 3.800 2.752 2.752 2.752 0.048 1 0 "[ ]" 1
111 1 6 U H3' 1 7 C H6 3.300 2.400 3.800 3.297 3.297 3.297 . 0 0 "[ ]" 1
112 1 6 U H4' 1 6 U H5' 2.400 . 2.800 2.497 2.497 2.497 . 0 0 "[ ]" 1
113 1 6 U H4' 1 6 U H6 4.000 . 4.500 3.786 3.786 3.786 . 0 0 "[ ]" 1
114 1 6 U H5 1 6 U H6 2.300 . 2.800 2.416 2.416 2.416 . 0 0 "[ ]" 1
115 1 6 U H5' 1 6 U H6 3.300 . 3.600 3.502 3.502 3.502 . 0 0 "[ ]" 1
116 1 6 U H6 1 7 C H6 4.500 . 5.600 4.562 4.562 4.562 . 0 0 "[ ]" 1
117 1 7 C H1' 1 7 C H2' 2.500 . 3.300 2.773 2.773 2.773 . 0 0 "[ ]" 1
118 1 7 C H1' 1 7 C H3' 3.500 2.700 4.300 3.881 3.881 3.881 . 0 0 "[ ]" 1
119 1 7 C H1' 1 7 C H6 3.500 . 4.000 3.665 3.665 3.665 . 0 0 "[ ]" 1
120 1 7 C H1' 1 8 G H8 4.600 2.400 5.100 5.143 5.143 5.143 0.043 1 0 "[ ]" 1
121 1 7 C H2' 1 7 C H3' 2.400 2.100 2.700 2.288 2.288 2.288 . 0 0 "[ ]" 1
122 1 7 C H2' 1 7 C H4' 3.800 3.500 4.100 3.883 3.883 3.883 . 0 0 "[ ]" 1
123 1 7 C H2' 1 7 C H6 3.800 . 4.100 2.835 2.835 2.835 . 0 0 "[ ]" 1
124 1 7 C H2' 1 8 G H8 2.300 . 2.800 2.495 2.495 2.495 . 0 0 "[ ]" 1
125 1 7 C H3' 1 7 C H4' 3.000 2.500 3.500 3.034 3.034 3.034 . 0 0 "[ ]" 1
126 1 7 C H3' 1 7 C H6 2.700 . 3.200 1.949 1.949 1.949 . 0 0 "[ ]" 1
127 1 7 C H3' 1 8 G H8 3.400 2.500 3.900 3.630 3.630 3.630 . 0 0 "[ ]" 1
128 1 7 C H4' 1 7 C H5' 2.400 . 2.800 2.768 2.768 2.768 . 0 0 "[ ]" 1
129 1 7 C H4' 1 7 C H6 4.000 . 4.500 3.941 3.941 3.941 . 0 0 "[ ]" 1
130 1 7 C H5 1 7 C H6 2.300 . 2.800 2.453 2.453 2.453 . 0 0 "[ ]" 1
131 1 7 C H5' 1 7 C H6 3.300 . 3.600 3.145 3.145 3.145 . 0 0 "[ ]" 1
132 1 7 C H6 1 8 G H8 4.500 . 5.600 4.697 4.697 4.697 . 0 0 "[ ]" 1
133 1 8 G H1 1 9 U H3 3.500 3.000 5.000 4.432 4.432 4.432 . 0 0 "[ ]" 1
134 1 8 G H1 1 28 G H1 3.500 3.000 5.000 3.310 3.310 3.310 . 0 0 "[ ]" 1
135 1 8 G H1' 1 8 G H2' 2.500 . 3.300 2.766 2.766 2.766 . 0 0 "[ ]" 1
136 1 8 G H1' 1 8 G H3' 3.500 2.700 4.300 3.872 3.872 3.872 . 0 0 "[ ]" 1
137 1 8 G H1' 1 8 G H8 3.500 . 4.000 3.803 3.803 3.803 . 0 0 "[ ]" 1
138 1 8 G H1' 1 9 U H6 4.600 2.400 5.100 4.799 4.799 4.799 . 0 0 "[ ]" 1
139 1 8 G H2' 1 8 G H3' 2.400 2.100 2.700 2.247 2.247 2.247 . 0 0 "[ ]" 1
140 1 8 G H2' 1 8 G H4' 3.800 3.500 4.100 3.850 3.850 3.850 . 0 0 "[ ]" 1
141 1 8 G H2' 1 8 G H8 3.800 . 4.100 2.854 2.854 2.854 . 0 0 "[ ]" 1
142 1 8 G H2' 1 9 U H5 3.400 2.900 3.900 2.769 2.769 2.769 0.131 1 0 "[ ]" 1
143 1 8 G H2' 1 9 U H6 2.300 . 3.300 2.211 2.211 2.211 . 0 0 "[ ]" 1
144 1 8 G H3' 1 8 G H4' 3.000 2.500 3.500 3.030 3.030 3.030 . 0 0 "[ ]" 1
145 1 8 G H3' 1 8 G H8 2.700 . 3.200 2.087 2.087 2.087 . 0 0 "[ ]" 1
146 1 8 G H3' 1 9 U H2' 2.400 2.100 2.700 6.026 6.026 6.026 3.326 1 1 [+] 1
147 1 8 G H3' 1 9 U H5 3.300 2.800 3.800 3.291 3.291 3.291 . 0 0 "[ ]" 1
148 1 8 G H3' 1 9 U H6 3.400 2.500 3.900 3.288 3.288 3.288 . 0 0 "[ ]" 1
149 1 8 G H4' 1 8 G H5' 2.400 . 2.800 2.687 2.687 2.687 . 0 0 "[ ]" 1
150 1 8 G H4' 1 8 G H8 4.000 . 4.500 4.191 4.191 4.191 . 0 0 "[ ]" 1
151 1 8 G H5' 1 8 G H8 3.300 . 3.600 3.474 3.474 3.474 . 0 0 "[ ]" 1
152 1 8 G H8 1 9 U H5 4.000 3.500 4.500 3.485 3.485 3.485 0.015 1 0 "[ ]" 1
153 1 8 G H8 1 9 U H6 4.500 . 5.600 4.487 4.487 4.487 . 0 0 "[ ]" 1
154 1 9 U H1' 1 9 U H2' 2.500 . 3.300 2.453 2.453 2.453 . 0 0 "[ ]" 1
155 1 9 U H1' 1 9 U H3 3.500 3.000 6.000 4.715 4.715 4.715 . 0 0 "[ ]" 1
156 1 9 U H1' 1 9 U H3' 3.500 2.700 4.300 4.071 4.071 4.071 . 0 0 "[ ]" 1
157 1 9 U H1' 1 9 U H6 3.500 . 4.000 3.643 3.643 3.643 . 0 0 "[ ]" 1
158 1 9 U H1' 1 10 U H6 4.400 2.200 4.900 8.243 8.243 8.243 3.343 1 1 [+] 1
159 1 9 U H2' 1 9 U H4' 3.800 3.500 4.100 0.782 0.782 0.782 2.718 1 1 [+] 1
160 1 9 U H2' 1 9 U H6 3.800 . 4.100 3.650 3.650 3.650 . 0 0 "[ ]" 1
161 1 9 U H2' 1 10 U H5 3.400 2.900 3.900 9.946 9.946 9.946 6.046 1 1 [+] 1
162 1 9 U H2' 1 10 U H6 3.000 . 3.800 8.719 8.719 8.719 4.919 1 1 [+] 1
163 1 9 U H3 1 10 U H3 3.500 3.000 5.000 7.133 7.133 7.133 2.133 1 1 [+] 1
164 1 9 U H3 1 25 G H1 3.500 3.000 5.000 4.469 4.469 4.469 . 0 0 "[ ]" 1
165 1 9 U H3 1 26 A H2 . 2.400 2.800 2.573 2.573 2.573 . 0 0 "[ ]" 1
166 1 9 U H3' 1 9 U H4' 3.000 2.500 3.500 3.004 3.004 3.004 . 0 0 "[ ]" 1
167 1 9 U H3' 1 9 U H6 2.700 . 3.200 1.843 1.843 1.843 . 0 0 "[ ]" 1
168 1 9 U H3' 1 10 U H5 3.300 2.800 3.800 7.450 7.450 7.450 3.650 1 1 [+] 1
169 1 9 U H3' 1 10 U H6 3.400 2.500 3.900 6.788 6.788 6.788 2.888 1 1 [+] 1
170 1 9 U H4' 1 9 U H5' 2.400 . 2.800 2.580 2.580 2.580 . 0 0 "[ ]" 1
171 1 9 U H4' 1 9 U H6 4.000 . 4.500 3.797 3.797 3.797 . 0 0 "[ ]" 1
172 1 9 U H5 1 9 U H6 2.300 . 2.800 2.383 2.383 2.383 . 0 0 "[ ]" 1
173 1 9 U H5 1 10 U H5 3.800 3.300 4.300 6.783 6.783 6.783 2.483 1 1 [+] 1
174 1 9 U H5' 1 9 U H6 3.300 . 3.600 3.569 3.569 3.569 . 0 0 "[ ]" 1
175 1 9 U H6 1 10 U H6 4.500 . 5.600 7.041 7.041 7.041 1.441 1 1 [+] 1
176 1 10 U H1' 1 10 U H6 3.000 2.500 4.500 2.796 2.796 2.796 . 0 0 "[ ]" 1
177 1 10 U H1' 1 11 G H8 4.800 2.800 5.600 5.613 5.613 5.613 0.013 1 0 "[ ]" 1
178 1 10 U H1' 1 26 A H2 4.000 2.500 4.500 4.586 4.586 4.586 0.086 1 0 "[ ]" 1
179 1 10 U H2' 1 10 U H3' 2.400 2.100 2.700 2.347 2.347 2.347 . 0 0 "[ ]" 1
180 1 10 U H2' 1 10 U H4' 3.800 3.500 4.100 3.850 3.850 3.850 . 0 0 "[ ]" 1
181 1 10 U H2' 1 10 U H6 3.800 . 4.400 2.289 2.289 2.289 . 0 0 "[ ]" 1
182 1 10 U H2' 1 11 G H8 3.200 2.200 4.000 2.891 2.891 2.891 . 0 0 "[ ]" 1
183 1 10 U H3 1 25 G H1 3.500 . 4.500 7.543 7.543 7.543 3.043 1 1 [+] 1
184 1 10 U H3' 1 10 U H4' 3.000 2.500 3.500 3.037 3.037 3.037 . 0 0 "[ ]" 1
185 1 10 U H3' 1 10 U H6 3.700 . 4.200 4.219 4.219 4.219 0.019 1 0 "[ ]" 1
186 1 10 U H4' 1 10 U H5' 2.400 . 2.800 2.376 2.376 2.376 . 0 0 "[ ]" 1
187 1 10 U H4' 1 10 U H6 4.000 . 4.500 5.454 5.454 5.454 0.954 1 1 [+] 1
188 1 10 U H5 1 10 U H6 2.300 . 2.800 2.423 2.423 2.423 . 0 0 "[ ]" 1
189 1 10 U H5 1 11 G H8 4.200 3.200 4.700 4.705 4.705 4.705 0.005 1 0 "[ ]" 1
190 1 10 U H6 1 11 G H8 4.000 3.000 4.500 3.930 3.930 3.930 . 0 0 "[ ]" 1
191 1 11 G H1' 1 11 G H2' 2.500 . 3.300 2.740 2.740 2.740 . 0 0 "[ ]" 1
192 1 11 G H1' 1 11 G H3' 3.500 2.700 4.300 3.844 3.844 3.844 . 0 0 "[ ]" 1
193 1 11 G H1' 1 11 G H8 3.800 . 4.600 3.804 3.804 3.804 . 0 0 "[ ]" 1
194 1 11 G H1' 1 12 A H8 4.500 2.500 5.300 5.338 5.338 5.338 0.038 1 0 "[ ]" 1
195 1 11 G H2' 1 11 G H8 3.500 . 3.800 3.102 3.102 3.102 . 0 0 "[ ]" 1
196 1 11 G H2' 1 12 A H8 3.000 2.200 3.500 2.749 2.749 2.749 . 0 0 "[ ]" 1
197 1 11 G H3' 1 12 A H8 4.300 2.500 4.800 4.214 4.214 4.214 . 0 0 "[ ]" 1
198 1 11 G H8 1 12 A H8 4.500 2.700 5.000 5.001 5.001 5.001 0.001 1 0 "[ ]" 1
199 1 12 A H1' 1 12 A H2' 2.500 . 3.300 2.739 2.739 2.739 . 0 0 "[ ]" 1
200 1 12 A H1' 1 12 A H3' 3.500 2.700 4.300 3.841 3.841 3.841 . 0 0 "[ ]" 1
201 1 12 A H1' 1 12 A H8 3.800 . 4.600 3.801 3.801 3.801 . 0 0 "[ ]" 1
202 1 12 A H1' 1 13 G H8 4.500 2.500 5.300 5.332 5.332 5.332 0.032 1 0 "[ ]" 1
203 1 12 A H2' 1 12 A H8 3.800 . 4.100 3.114 3.114 3.114 . 0 0 "[ ]" 1
204 1 12 A H2' 1 13 G H1' 4.200 3.200 5.000 4.447 4.447 4.447 . 0 0 "[ ]" 1
205 1 12 A H2' 1 13 G H8 3.000 2.200 3.500 2.742 2.742 2.742 . 0 0 "[ ]" 1
206 1 12 A H3' 1 13 G H8 3.800 2.800 4.600 4.209 4.209 4.209 . 0 0 "[ ]" 1
207 1 12 A H8 1 13 G H8 4.500 2.700 5.000 5.004 5.004 5.004 0.004 1 0 "[ ]" 1
208 1 13 G H1' 1 13 G H2' 2.500 . 3.300 2.740 2.740 2.740 . 0 0 "[ ]" 1
209 1 13 G H1' 1 13 G H8 3.800 . 4.600 3.800 3.800 3.800 . 0 0 "[ ]" 1
210 1 13 G H1' 1 14 A H8 4.500 2.500 5.300 5.327 5.327 5.327 0.027 1 0 "[ ]" 1
211 1 13 G H2' 1 13 G H8 3.800 . 4.100 3.113 3.113 3.113 . 0 0 "[ ]" 1
212 1 13 G H2' 1 14 A H8 3.200 2.200 4.000 2.729 2.729 2.729 . 0 0 "[ ]" 1
213 1 13 G H8 1 14 A H8 4.500 2.700 5.000 4.986 4.986 4.986 . 0 0 "[ ]" 1
214 1 14 A H1' 1 14 A H2' 2.500 . 3.300 2.744 2.744 2.744 . 0 0 "[ ]" 1
215 1 14 A H1' 1 14 A H3' 3.500 2.700 4.300 3.846 3.846 3.846 . 0 0 "[ ]" 1
216 1 14 A H1' 1 14 A H4' 3.500 2.700 4.300 3.423 3.423 3.423 . 0 0 "[ ]" 1
217 1 14 A H1' 1 14 A H8 3.800 . 4.600 3.803 3.803 3.803 . 0 0 "[ ]" 1
218 1 14 A H1' 1 15 A H8 4.500 2.500 5.300 5.320 5.320 5.320 0.020 1 0 "[ ]" 1
219 1 14 A H2' 1 14 A H3' 2.400 2.100 2.700 2.393 2.393 2.393 . 0 0 "[ ]" 1
220 1 14 A H2' 1 14 A H8 3.800 . 4.100 3.107 3.107 3.107 . 0 0 "[ ]" 1
221 1 14 A H3' 1 14 A H8 2.700 . 3.200 1.922 1.922 1.922 . 0 0 "[ ]" 1
222 1 14 A H3' 1 15 A H8 3.800 . 4.100 3.644 3.644 3.644 . 0 0 "[ ]" 1
223 1 14 A H8 1 15 A H8 4.500 2.700 5.000 4.367 4.367 4.367 . 0 0 "[ ]" 1
224 1 15 A H1' 1 15 A H2' 2.500 . 3.300 2.747 2.747 2.747 . 0 0 "[ ]" 1
225 1 15 A H1' 1 15 A H3' 3.700 2.900 4.500 3.865 3.865 3.865 . 0 0 "[ ]" 1
226 1 15 A H1' 1 15 A H4' 3.500 2.700 4.300 3.435 3.435 3.435 . 0 0 "[ ]" 1
227 1 15 A H1' 1 15 A H8 3.800 . 4.600 3.803 3.803 3.803 . 0 0 "[ ]" 1
228 1 15 A H1' 1 16 A H8 4.500 2.500 5.300 5.338 5.338 5.338 0.038 1 0 "[ ]" 1
229 1 15 A H2' 1 15 A H8 3.800 . 4.100 3.086 3.086 3.086 . 0 0 "[ ]" 1
230 1 15 A H2' 1 16 A H8 2.800 . 3.100 2.707 2.707 2.707 . 0 0 "[ ]" 1
231 1 15 A H3' 1 16 A H8 3.700 2.900 4.500 4.075 4.075 4.075 . 0 0 "[ ]" 1
232 1 15 A H8 1 16 A H8 4.500 2.700 5.000 4.933 4.933 4.933 . 0 0 "[ ]" 1
233 1 16 A H1' 1 16 A H2' 2.500 . 3.300 2.743 2.743 2.743 . 0 0 "[ ]" 1
234 1 16 A H1' 1 16 A H3' 3.700 2.900 4.500 3.861 3.861 3.861 . 0 0 "[ ]" 1
235 1 16 A H1' 1 16 A H4' 3.700 2.900 4.500 3.432 3.432 3.432 . 0 0 "[ ]" 1
236 1 16 A H1' 1 16 A H8 3.800 . 4.600 3.800 3.800 3.800 . 0 0 "[ ]" 1
237 1 16 A H1' 1 17 A H8 4.800 2.800 5.600 5.352 5.352 5.352 . 0 0 "[ ]" 1
238 1 16 A H2' 1 16 A H8 3.800 . 4.100 3.095 3.095 3.095 . 0 0 "[ ]" 1
239 1 16 A H3' 1 17 A H8 4.000 3.000 4.800 4.171 4.171 4.171 . 0 0 "[ ]" 1
240 1 17 A H1' 1 17 A H3' 3.700 2.900 4.500 3.847 3.847 3.847 . 0 0 "[ ]" 1
241 1 17 A H1' 1 17 A H8 3.800 . 4.600 3.800 3.800 3.800 . 0 0 "[ ]" 1
242 1 17 A H2' 1 17 A H3' 2.400 2.100 2.700 2.395 2.395 2.395 . 0 0 "[ ]" 1
243 1 17 A H2' 1 17 A H8 3.800 . 4.100 3.113 3.113 3.113 . 0 0 "[ ]" 1
244 1 18 C H1' 1 18 C H2' 2.500 . 3.300 2.773 2.773 2.773 . 0 0 "[ ]" 1
245 1 18 C H1' 1 18 C H3' 3.700 2.900 4.500 3.858 3.858 3.858 . 0 0 "[ ]" 1
246 1 18 C H1' 1 18 C H6 3.800 . 4.600 3.606 3.606 3.606 . 0 0 "[ ]" 1
247 1 18 C H5 1 18 C H6 2.300 . 2.600 2.451 2.451 2.451 . 0 0 "[ ]" 1
248 1 19 G H1' 1 19 G H2' 2.500 . 3.300 2.747 2.747 2.747 . 0 0 "[ ]" 1
249 1 19 G H1' 1 19 G H3' 3.700 2.900 4.500 3.866 3.866 3.866 . 0 0 "[ ]" 1
250 1 19 G H1' 1 19 G H4' 3.700 2.900 4.500 3.433 3.433 3.433 . 0 0 "[ ]" 1
251 1 19 G H1' 1 19 G H8 3.800 . 4.600 3.798 3.798 3.798 . 0 0 "[ ]" 1
252 1 19 G H1' 1 20 A H8 4.500 2.500 5.300 5.340 5.340 5.340 0.040 1 0 "[ ]" 1
253 1 19 G H2' 1 19 G H8 3.800 . 4.100 3.093 3.093 3.093 . 0 0 "[ ]" 1
254 1 19 G H3' 1 20 A H8 3.000 . 3.800 2.889 2.889 2.889 . 0 0 "[ ]" 1
255 1 19 G H4' 1 19 G H8 4.000 3.000 4.800 4.132 4.132 4.132 . 0 0 "[ ]" 1
256 1 19 G H8 1 20 A H8 4.200 2.700 4.700 3.530 3.530 3.530 . 0 0 "[ ]" 1
257 1 20 A H1' 1 20 A H3' 3.700 2.900 4.500 3.827 3.827 3.827 . 0 0 "[ ]" 1
258 1 20 A H1' 1 20 A H8 3.800 . 4.600 3.722 3.722 3.722 . 0 0 "[ ]" 1
259 1 20 A H1' 1 21 A H8 4.000 . 4.800 4.857 4.857 4.857 0.057 1 0 "[ ]" 1
260 1 20 A H2 1 21 A H1' 4.500 2.500 5.300 4.427 4.427 4.427 . 0 0 "[ ]" 1
261 1 20 A H2 1 21 A H8 5.000 3.000 5.500 5.547 5.547 5.547 0.047 1 0 "[ ]" 1
262 1 20 A H2' 1 20 A H8 3.800 . 4.100 3.624 3.624 3.624 . 0 0 "[ ]" 1
263 1 20 A H3' 1 20 A H8 3.000 . 3.800 2.387 2.387 2.387 . 0 0 "[ ]" 1
264 1 20 A H4' 1 20 A H8 4.000 3.000 4.800 4.083 4.083 4.083 . 0 0 "[ ]" 1
265 1 20 A H5' 1 20 A H8 4.000 3.000 4.800 3.747 3.747 3.747 . 0 0 "[ ]" 1
266 1 20 A H8 1 21 A H8 5.000 3.000 5.500 5.351 5.351 5.351 . 0 0 "[ ]" 1
267 1 21 A H1' 1 21 A H2' 2.800 . 3.100 2.750 2.750 2.750 . 0 0 "[ ]" 1
268 1 21 A H1' 1 21 A H3' 3.700 2.900 4.500 3.867 3.867 3.867 . 0 0 "[ ]" 1
269 1 21 A H1' 1 21 A H8 3.800 . 4.600 3.763 3.763 3.763 . 0 0 "[ ]" 1
270 1 21 A H1' 1 22 A H8 4.500 3.000 5.000 4.548 4.548 4.548 . 0 0 "[ ]" 1
271 1 21 A H2' 1 21 A H8 3.000 2.200 3.800 3.333 3.333 3.333 . 0 0 "[ ]" 1
272 1 21 A H2' 1 22 A H8 3.200 . 3.700 3.071 3.071 3.071 . 0 0 "[ ]" 1
273 1 21 A H3' 1 22 A H8 4.500 2.500 4.800 4.841 4.841 4.841 0.041 1 0 "[ ]" 1
274 1 22 A H1' 1 22 A H3' 3.700 2.900 4.500 3.822 3.822 3.822 . 0 0 "[ ]" 1
275 1 22 A H1' 1 22 A H8 3.800 . 4.600 3.801 3.801 3.801 . 0 0 "[ ]" 1
276 1 22 A H2' 1 22 A H8 3.800 . 4.100 3.185 3.185 3.185 . 0 0 "[ ]" 1
277 1 22 A H2' 1 23 C H6 4.500 3.500 5.300 4.968 4.968 4.968 . 0 0 "[ ]" 1
278 1 22 A H3' 1 22 A H8 2.800 . 3.100 1.900 1.900 1.900 . 0 0 "[ ]" 1
279 1 22 A H3' 1 23 C H6 3.000 . 3.800 3.533 3.533 3.533 . 0 0 "[ ]" 1
280 1 22 A H4' 1 22 A H8 4.000 . 4.300 4.121 4.121 4.121 . 0 0 "[ ]" 1
281 1 22 A H8 1 23 C H5 4.000 3.000 4.500 4.317 4.317 4.317 . 0 0 "[ ]" 1
282 1 22 A H8 1 23 C H6 4.500 3.500 5.000 4.246 4.246 4.246 . 0 0 "[ ]" 1
283 1 23 C H1' 1 23 C H6 3.600 . 4.400 3.667 3.667 3.667 . 0 0 "[ ]" 1
284 1 23 C H1' 1 24 A H8 4.500 3.500 5.300 5.355 5.355 5.355 0.055 1 0 "[ ]" 1
285 1 23 C H2' 1 23 C H6 3.000 . 3.300 3.026 3.026 3.026 . 0 0 "[ ]" 1
286 1 23 C H2' 1 24 A H8 3.000 . 3.500 2.767 2.767 2.767 . 0 0 "[ ]" 1
287 1 23 C H3' 1 23 C H5 4.000 3.000 4.800 4.106 4.106 4.106 . 0 0 "[ ]" 1
288 1 23 C H3' 1 24 A H8 3.000 . 3.800 2.477 2.477 2.477 . 0 0 "[ ]" 1
289 1 23 C H5 1 23 C H6 2.300 . 2.600 2.467 2.467 2.467 . 0 0 "[ ]" 1
290 1 23 C H5 1 24 A H8 4.300 2.800 5.100 4.501 4.501 4.501 . 0 0 "[ ]" 1
291 1 23 C H6 1 24 A H8 4.000 2.500 4.800 3.492 3.492 3.492 . 0 0 "[ ]" 1
292 1 24 A H1' 1 24 A H8 3.800 2.300 4.600 3.695 3.695 3.695 . 0 0 "[ ]" 1
293 1 24 A H1' 1 25 G H8 3.500 . 4.000 4.795 4.795 4.795 0.795 1 1 [+] 1
294 1 24 A H2' 1 24 A H8 3.800 . 4.100 3.756 3.756 3.756 . 0 0 "[ ]" 1
295 1 24 A H2' 1 25 G H8 3.800 . 4.100 3.065 3.065 3.065 . 0 0 "[ ]" 1
296 1 24 A H3' 1 25 G H8 3.500 . 4.000 4.506 4.506 4.506 0.506 1 1 [+] 1
297 1 24 A H4' 1 24 A H8 4.000 2.500 4.800 4.086 4.086 4.086 . 0 0 "[ ]" 1
298 1 25 G H1' 1 25 G H2' 2.500 . 3.300 2.767 2.767 2.767 . 0 0 "[ ]" 1
299 1 25 G H1' 1 25 G H3' 3.500 2.700 4.300 3.906 3.906 3.906 . 0 0 "[ ]" 1
300 1 25 G H1' 1 25 G H8 3.500 . 4.000 3.823 3.823 3.823 . 0 0 "[ ]" 1
301 1 25 G H1' 1 26 A H8 4.600 2.400 5.100 4.951 4.951 4.951 . 0 0 "[ ]" 1
302 1 25 G H2' 1 25 G H8 3.800 . 4.100 2.703 2.703 2.703 . 0 0 "[ ]" 1
303 1 25 G H2' 1 26 A H8 2.300 . 2.800 2.306 2.306 2.306 . 0 0 "[ ]" 1
304 1 25 G H3' 1 25 G H8 2.700 . 3.200 2.013 2.013 2.013 . 0 0 "[ ]" 1
305 1 25 G H3' 1 26 A H8 3.300 2.400 3.800 3.679 3.679 3.679 . 0 0 "[ ]" 1
306 1 25 G H4' 1 25 G H8 4.000 . 4.500 4.315 4.315 4.315 . 0 0 "[ ]" 1
307 1 25 G H5' 1 25 G H8 3.300 . 3.600 3.617 3.617 3.617 0.017 1 0 "[ ]" 1
308 1 25 G H8 1 26 A H8 4.500 . 5.600 4.156 4.156 4.156 . 0 0 "[ ]" 1
309 1 26 A H1' 1 26 A H2' 2.500 . 3.300 2.759 2.759 2.759 . 0 0 "[ ]" 1
310 1 26 A H1' 1 26 A H3' 3.500 2.700 4.300 3.872 3.872 3.872 . 0 0 "[ ]" 1
311 1 26 A H1' 1 26 A H8 3.500 . 4.000 3.765 3.765 3.765 . 0 0 "[ ]" 1
312 1 26 A H1' 1 27 C H6 4.700 3.200 5.200 4.210 4.210 4.210 . 0 0 "[ ]" 1
313 1 26 A H2 1 27 C H1' 4.100 3.100 4.600 4.783 4.783 4.783 0.183 1 0 "[ ]" 1
314 1 26 A H2 1 27 C H5 4.500 3.500 5.300 5.481 5.481 5.481 0.181 1 0 "[ ]" 1
315 1 26 A H2' 1 26 A H3' 2.400 2.100 2.700 2.263 2.263 2.263 . 0 0 "[ ]" 1
316 1 26 A H2' 1 26 A H4' 3.800 3.500 4.100 3.882 3.882 3.882 . 0 0 "[ ]" 1
317 1 26 A H2' 1 26 A H8 3.800 . 4.100 3.065 3.065 3.065 . 0 0 "[ ]" 1
318 1 26 A H2' 1 27 C H5 3.400 2.900 3.900 2.410 2.410 2.410 0.490 1 0 "[ ]" 1
319 1 26 A H2' 1 27 C H6 2.300 . 2.800 2.101 2.101 2.101 . 0 0 "[ ]" 1
320 1 26 A H3' 1 26 A H4' 3.000 2.500 3.500 3.041 3.041 3.041 . 0 0 "[ ]" 1
321 1 26 A H3' 1 26 A H8 2.700 . 3.200 2.215 2.215 2.215 . 0 0 "[ ]" 1
322 1 26 A H3' 1 27 C H5 3.300 2.800 3.800 3.738 3.738 3.738 . 0 0 "[ ]" 1
323 1 26 A H3' 1 27 C H6 3.300 2.400 3.800 3.962 3.962 3.962 0.162 1 0 "[ ]" 1
324 1 26 A H4' 1 26 A H5' 2.400 . 2.800 2.511 2.511 2.511 . 0 0 "[ ]" 1
325 1 26 A H4' 1 26 A H8 4.000 . 4.500 4.101 4.101 4.101 . 0 0 "[ ]" 1
326 1 26 A H5' 1 26 A H8 3.300 . 3.600 3.684 3.684 3.684 0.084 1 0 "[ ]" 1
327 1 26 A H8 1 27 C H5 3.500 2.500 4.300 4.012 4.012 4.012 . 0 0 "[ ]" 1
328 1 26 A H8 1 27 C H6 4.500 . 5.600 5.072 5.072 5.072 . 0 0 "[ ]" 1
329 1 27 C H1' 1 27 C H2' 2.500 . 3.300 2.776 2.776 2.776 . 0 0 "[ ]" 1
330 1 27 C H1' 1 27 C H3' 3.500 2.700 4.300 3.869 3.869 3.869 . 0 0 "[ ]" 1
331 1 27 C H1' 1 27 C H6 3.500 . 4.000 3.655 3.655 3.655 . 0 0 "[ ]" 1
332 1 27 C H1' 1 28 G H8 4.600 2.400 5.100 5.143 5.143 5.143 0.043 1 0 "[ ]" 1
333 1 27 C H2' 1 27 C H3' 2.400 2.100 2.700 2.290 2.290 2.290 . 0 0 "[ ]" 1
334 1 27 C H2' 1 27 C H4' 3.800 3.500 4.100 3.899 3.899 3.899 . 0 0 "[ ]" 1
335 1 27 C H2' 1 27 C H6 3.800 . 4.100 2.934 2.934 2.934 . 0 0 "[ ]" 1
336 1 27 C H2' 1 28 G H8 2.300 . 2.800 2.469 2.469 2.469 . 0 0 "[ ]" 1
337 1 27 C H3' 1 27 C H4' 3.000 2.500 3.500 3.038 3.038 3.038 . 0 0 "[ ]" 1
338 1 27 C H3' 1 27 C H6 2.700 . 3.200 1.982 1.982 1.982 . 0 0 "[ ]" 1
339 1 27 C H3' 1 28 G H8 3.300 2.400 3.800 2.679 2.679 2.679 . 0 0 "[ ]" 1
340 1 27 C H4' 1 27 C H5' 2.400 . 2.800 2.675 2.675 2.675 . 0 0 "[ ]" 1
341 1 27 C H4' 1 27 C H6 4.000 . 4.500 3.909 3.909 3.909 . 0 0 "[ ]" 1
342 1 27 C H5 1 27 C H6 2.300 . 2.800 2.449 2.449 2.449 . 0 0 "[ ]" 1
343 1 27 C H5' 1 27 C H6 3.300 . 3.600 3.258 3.258 3.258 . 0 0 "[ ]" 1
344 1 27 C H6 1 28 G H8 4.500 . 5.600 4.165 4.165 4.165 . 0 0 "[ ]" 1
345 1 28 G H1 1 29 G H1 3.500 3.000 5.000 3.192 3.192 3.192 . 0 0 "[ ]" 1
346 1 28 G H1' 1 28 G H3' 3.500 2.700 4.300 3.808 3.808 3.808 . 0 0 "[ ]" 1
347 1 28 G H1' 1 28 G H8 3.500 . 4.000 3.834 3.834 3.834 . 0 0 "[ ]" 1
348 1 28 G H1' 1 29 G H8 4.600 2.400 5.100 3.430 3.430 3.430 . 0 0 "[ ]" 1
349 1 28 G H2' 1 28 G H3' 2.400 2.100 2.700 2.355 2.355 2.355 . 0 0 "[ ]" 1
350 1 28 G H2' 1 28 G H4' 3.800 3.500 4.100 3.323 3.323 3.323 0.177 1 0 "[ ]" 1
351 1 28 G H2' 1 28 G H8 2.300 . 3.100 1.993 1.993 1.993 . 0 0 "[ ]" 1
352 1 28 G H3' 1 28 G H4' 3.000 2.500 3.500 2.674 2.674 2.674 . 0 0 "[ ]" 1
353 1 28 G H3' 1 28 G H8 3.700 2.800 4.200 4.303 4.303 4.303 0.103 1 0 "[ ]" 1
354 1 28 G H3' 1 29 G H8 3.300 2.400 3.800 3.919 3.919 3.919 0.119 1 0 "[ ]" 1
355 1 28 G H4' 1 28 G H5' 2.400 . 2.800 2.424 2.424 2.424 . 0 0 "[ ]" 1
356 1 28 G H4' 1 28 G H8 4.000 . 4.500 4.549 4.549 4.549 0.049 1 0 "[ ]" 1
357 1 28 G H5' 1 28 G H8 3.300 . 3.600 3.556 3.556 3.556 . 0 0 "[ ]" 1
358 1 28 G H8 1 29 G H8 4.500 . 5.600 5.515 5.515 5.515 . 0 0 "[ ]" 1
359 1 29 G H1 1 30 U H3 3.500 3.000 5.000 4.118 4.118 4.118 . 0 0 "[ ]" 1
360 1 29 G H1' 1 29 G H2' 2.500 . 3.300 2.770 2.770 2.770 . 0 0 "[ ]" 1
361 1 29 G H1' 1 29 G H3' 3.500 2.700 4.300 3.888 3.888 3.888 . 0 0 "[ ]" 1
362 1 29 G H1' 1 29 G H8 3.500 . 4.000 3.842 3.842 3.842 . 0 0 "[ ]" 1
363 1 29 G H1' 1 30 U H6 4.600 2.400 5.100 5.033 5.033 5.033 . 0 0 "[ ]" 1
364 1 29 G H2' 1 29 G H3' 2.400 2.100 2.700 2.280 2.280 2.280 . 0 0 "[ ]" 1
365 1 29 G H2' 1 29 G H4' 3.800 3.500 4.100 3.843 3.843 3.843 . 0 0 "[ ]" 1
366 1 29 G H2' 1 29 G H8 3.800 3.300 4.100 2.780 2.780 2.780 0.520 1 1 [+] 1
367 1 29 G H2' 1 30 U H1' 4.000 3.000 4.800 4.783 4.783 4.783 . 0 0 "[ ]" 1
368 1 29 G H2' 1 30 U H5 3.400 2.900 3.900 2.568 2.568 2.568 0.332 1 0 "[ ]" 1
369 1 29 G H2' 1 30 U H6 2.300 . 2.800 2.533 2.533 2.533 . 0 0 "[ ]" 1
370 1 29 G H3' 1 29 G H4' 3.000 2.500 3.500 3.035 3.035 3.035 . 0 0 "[ ]" 1
371 1 29 G H3' 1 29 G H8 2.700 . 3.200 2.098 2.098 2.098 . 0 0 "[ ]" 1
372 1 29 G H3' 1 30 U H5 3.300 2.800 3.800 3.058 3.058 3.058 . 0 0 "[ ]" 1
373 1 29 G H3' 1 30 U H6 3.300 2.400 3.800 3.885 3.885 3.885 0.085 1 0 "[ ]" 1
374 1 29 G H4' 1 29 G H5' 2.400 . 2.800 2.726 2.726 2.726 . 0 0 "[ ]" 1
375 1 29 G H4' 1 29 G H8 4.000 . 4.500 4.318 4.318 4.318 . 0 0 "[ ]" 1
376 1 29 G H5' 1 29 G H8 3.300 . 3.600 3.601 3.601 3.601 0.001 1 0 "[ ]" 1
377 1 29 G H8 1 30 U H6 4.500 . 5.600 4.795 4.795 4.795 . 0 0 "[ ]" 1
378 1 30 U H1' 1 30 U H2' 2.500 . 3.300 2.776 2.776 2.776 . 0 0 "[ ]" 1
379 1 30 U H1' 1 30 U H6 3.500 . 4.000 3.659 3.659 3.659 . 0 0 "[ ]" 1
380 1 30 U H1' 1 31 G H8 4.600 2.400 5.100 4.883 4.883 4.883 . 0 0 "[ ]" 1
381 1 30 U H2' 1 30 U H3' 2.400 2.100 2.700 2.286 2.286 2.286 . 0 0 "[ ]" 1
382 1 30 U H2' 1 30 U H4' 3.800 3.500 4.100 3.891 3.891 3.891 . 0 0 "[ ]" 1
383 1 30 U H2' 1 30 U H6 3.800 . 4.100 2.864 2.864 2.864 . 0 0 "[ ]" 1
384 1 30 U H2' 1 31 G H8 2.300 . 2.800 2.347 2.347 2.347 . 0 0 "[ ]" 1
385 1 30 U H3 1 31 G H1 3.500 3.000 5.000 4.978 4.978 4.978 . 0 0 "[ ]" 1
386 1 30 U H3' 1 30 U H4' 3.000 2.500 3.500 3.038 3.038 3.038 . 0 0 "[ ]" 1
387 1 30 U H3' 1 30 U H6 2.700 . 3.200 1.884 1.884 1.884 . 0 0 "[ ]" 1
388 1 30 U H3' 1 31 G H8 3.300 2.400 3.800 3.857 3.857 3.857 0.057 1 0 "[ ]" 1
389 1 30 U H4' 1 30 U H5' 2.400 . 2.800 2.446 2.446 2.446 . 0 0 "[ ]" 1
390 1 30 U H4' 1 30 U H6 4.000 . 4.500 3.861 3.861 3.861 . 0 0 "[ ]" 1
391 1 30 U H5 1 30 U H6 2.300 . 2.800 2.430 2.430 2.430 . 0 0 "[ ]" 1
392 1 30 U H5' 1 30 U H6 3.300 . 3.600 3.673 3.673 3.673 0.073 1 0 "[ ]" 1
393 1 30 U H6 1 31 G H8 4.500 . 5.600 4.789 4.789 4.789 . 0 0 "[ ]" 1
394 1 31 G H1 1 32 G H1 3.500 3.000 5.000 4.191 4.191 4.191 . 0 0 "[ ]" 1
395 1 31 G H1' 1 31 G H2' 2.500 . 3.300 2.772 2.772 2.772 . 0 0 "[ ]" 1
396 1 31 G H1' 1 31 G H3' 3.500 2.700 4.300 3.871 3.871 3.871 . 0 0 "[ ]" 1
397 1 31 G H1' 1 31 G H8 3.500 . 4.000 3.807 3.807 3.807 . 0 0 "[ ]" 1
398 1 31 G H1' 1 32 G H8 4.600 2.400 5.100 5.152 5.152 5.152 0.052 1 0 "[ ]" 1
399 1 31 G H2' 1 31 G H3' 2.400 2.100 2.700 2.280 2.280 2.280 . 0 0 "[ ]" 1
400 1 31 G H2' 1 31 G H4' 3.800 3.500 4.100 3.892 3.892 3.892 . 0 0 "[ ]" 1
401 1 31 G H2' 1 31 G H8 3.800 . 4.100 2.856 2.856 2.856 . 0 0 "[ ]" 1
402 1 31 G H2' 1 32 G H1' 4.000 3.000 4.500 4.992 4.992 4.992 0.492 1 0 "[ ]" 1
403 1 31 G H2' 1 32 G H8 2.300 . 2.800 2.513 2.513 2.513 . 0 0 "[ ]" 1
404 1 31 G H3' 1 31 G H4' 3.000 2.500 3.500 3.033 3.033 3.033 . 0 0 "[ ]" 1
405 1 31 G H3' 1 31 G H8 2.700 . 3.200 2.042 2.042 2.042 . 0 0 "[ ]" 1
406 1 31 G H3' 1 32 G H8 3.300 2.400 3.800 3.654 3.654 3.654 . 0 0 "[ ]" 1
407 1 31 G H4' 1 31 G H5' 2.400 . 2.800 2.571 2.571 2.571 . 0 0 "[ ]" 1
408 1 31 G H4' 1 31 G H8 4.000 . 4.500 4.190 4.190 4.190 . 0 0 "[ ]" 1
409 1 31 G H5' 1 31 G H8 3.300 . 3.600 3.682 3.682 3.682 0.082 1 0 "[ ]" 1
410 1 31 G H8 1 32 G H8 4.500 . 5.600 4.669 4.669 4.669 . 0 0 "[ ]" 1
411 1 32 G H1' 1 32 G H2' 2.500 . 3.300 2.771 2.771 2.771 . 0 0 "[ ]" 1
412 1 32 G H1' 1 32 G H8 3.500 . 4.000 3.820 3.820 3.820 . 0 0 "[ ]" 1
413 1 32 G H1' 1 33 C H6 4.600 2.400 5.100 4.647 4.647 4.647 . 0 0 "[ ]" 1
414 1 32 G H2' 1 32 G H3' 2.400 2.100 2.700 2.285 2.285 2.285 . 0 0 "[ ]" 1
415 1 32 G H2' 1 32 G H4' 3.800 3.500 4.100 3.854 3.854 3.854 . 0 0 "[ ]" 1
416 1 32 G H2' 1 32 G H8 3.800 . 4.100 2.637 2.637 2.637 . 0 0 "[ ]" 1
417 1 32 G H2' 1 33 C H5 3.400 2.900 3.900 3.052 3.052 3.052 . 0 0 "[ ]" 1
418 1 32 G H2' 1 33 C H6 2.300 . 2.800 2.238 2.238 2.238 . 0 0 "[ ]" 1
419 1 32 G H3' 1 32 G H4' 3.000 2.500 3.500 3.027 3.027 3.027 . 0 0 "[ ]" 1
420 1 32 G H3' 1 32 G H8 2.700 . 3.200 2.147 2.147 2.147 . 0 0 "[ ]" 1
421 1 32 G H3' 1 33 C H5 3.300 2.800 3.800 3.661 3.661 3.661 . 0 0 "[ ]" 1
422 1 32 G H3' 1 33 C H6 3.300 2.400 3.800 3.308 3.308 3.308 . 0 0 "[ ]" 1
423 1 32 G H4' 1 32 G H5' 2.400 . 2.800 2.741 2.741 2.741 . 0 0 "[ ]" 1
424 1 32 G H4' 1 32 G H8 4.000 . 4.500 4.370 4.370 4.370 . 0 0 "[ ]" 1
425 1 32 G H5' 1 32 G H8 3.300 . 3.600 3.670 3.670 3.670 0.070 1 0 "[ ]" 1
426 1 32 G H8 1 33 C H6 4.500 . 5.600 4.423 4.423 4.423 . 0 0 "[ ]" 1
427 1 33 C H1' 1 33 C H2' 2.500 . 3.300 2.394 2.394 2.394 . 0 0 "[ ]" 1
428 1 33 C H1' 1 33 C H6 3.500 . 4.000 3.416 3.416 3.416 . 0 0 "[ ]" 1
429 1 33 C H1' 1 34 C H6 4.600 2.400 5.100 5.163 5.163 5.163 0.063 1 0 "[ ]" 1
430 1 33 C H2' 1 33 C H3' 2.400 2.100 2.700 3.020 3.020 3.020 0.320 1 0 "[ ]" 1
431 1 33 C H2' 1 33 C H4' 3.800 3.500 4.100 0.675 0.675 0.675 2.825 1 1 [+] 1
432 1 33 C H2' 1 33 C H6 3.800 . 4.100 3.700 3.700 3.700 . 0 0 "[ ]" 1
433 1 33 C H2' 1 34 C H5 3.400 2.900 3.900 6.080 6.080 6.080 2.180 1 1 [+] 1
434 1 33 C H2' 1 34 C H6 2.300 . 2.800 4.909 4.909 4.909 2.109 1 1 [+] 1
435 1 33 C H3' 1 33 C H4' 3.000 2.500 3.500 2.962 2.962 2.962 . 0 0 "[ ]" 1
436 1 33 C H3' 1 33 C H6 2.700 . 3.200 3.265 3.265 3.265 0.065 1 0 "[ ]" 1
437 1 33 C H3' 1 34 C H5 3.300 2.800 3.800 3.850 3.850 3.850 0.050 1 0 "[ ]" 1
438 1 33 C H3' 1 34 C H6 3.300 2.400 3.800 2.237 2.237 2.237 0.163 1 0 "[ ]" 1
439 1 33 C H4' 1 33 C H5' 2.400 . 2.800 2.481 2.481 2.481 . 0 0 "[ ]" 1
440 1 33 C H4' 1 33 C H6 4.000 . 4.500 3.948 3.948 3.948 . 0 0 "[ ]" 1
441 1 33 C H5 1 33 C H6 2.300 . 2.800 2.410 2.410 2.410 . 0 0 "[ ]" 1
442 1 33 C H5 1 34 C H5 4.000 2.500 4.500 2.731 2.731 2.731 . 0 0 "[ ]" 1
443 1 33 C H5' 1 33 C H6 3.300 . 3.600 3.474 3.474 3.474 . 0 0 "[ ]" 1
444 1 33 C H6 1 34 C H6 4.500 . 5.600 3.570 3.570 3.570 . 0 0 "[ ]" 1
445 1 34 C H1' 1 34 C H6 3.500 . 4.000 3.709 3.709 3.709 . 0 0 "[ ]" 1
446 1 34 C H2' 1 34 C H3' 2.400 2.100 2.700 2.204 2.204 2.204 . 0 0 "[ ]" 1
447 1 34 C H2' 1 34 C H4' 3.800 3.500 4.100 3.867 3.867 3.867 . 0 0 "[ ]" 1
448 1 34 C H2' 1 34 C H6 3.800 . 4.100 2.202 2.202 2.202 . 0 0 "[ ]" 1
449 1 34 C H3' 1 34 C H4' 3.000 2.500 3.500 2.964 2.964 2.964 . 0 0 "[ ]" 1
450 1 34 C H3' 1 34 C H6 2.700 . 3.200 3.368 3.368 3.368 0.168 1 0 "[ ]" 1
451 1 34 C H4' 1 34 C H5' 2.400 . 2.800 2.827 2.827 2.827 0.027 1 0 "[ ]" 1
452 1 34 C H4' 1 34 C H6 4.000 . 4.500 4.513 4.513 4.513 0.013 1 0 "[ ]" 1
453 1 34 C H5 1 34 C H6 2.300 . 2.800 2.459 2.459 2.459 . 0 0 "[ ]" 1
454 1 34 C H5' 1 34 C H6 3.300 . 3.600 3.620 3.620 3.620 0.020 1 0 "[ ]" 1
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