NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
451566 |
2rp1   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rp1
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 48
_Distance_constraint_stats_list.Viol_count 7
_Distance_constraint_stats_list.Viol_total 0.370
_Distance_constraint_stats_list.Viol_max 0.143
_Distance_constraint_stats_list.Viol_rms 0.0262
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0077
_Distance_constraint_stats_list.Viol_average_violations_only 0.0529
_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 2 C 0.000 0.000 . 0 "[ ]"
1 3 C 0.037 0.037 1 0 "[ ]"
1 4 G 0.000 0.000 . 0 "[ ]"
1 5 G 0.004 0.004 1 0 "[ ]"
1 6 U 0.121 0.098 1 0 "[ ]"
1 7 CH 0.166 0.143 1 0 "[ ]"
1 8 G 0.053 0.053 1 0 "[ ]"
1 9 A 0.000 0.000 . 0 "[ ]"
1 10 C 0.000 0.000 . 0 "[ ]"
1 12 C 0.000 0.000 . 0 "[ ]"
1 13 C 0.000 0.000 . 0 "[ ]"
1 14 G 0.037 0.037 1 0 "[ ]"
1 15 G 0.000 0.000 . 0 "[ ]"
1 16 A 0.000 0.000 . 0 "[ ]"
1 23 A 0.102 0.098 1 0 "[ ]"
1 24 A 0.156 0.143 1 0 "[ ]"
1 25 G 0.013 0.013 1 0 "[ ]"
1 26 U 0.000 0.000 . 0 "[ ]"
1 27 C 0.053 0.053 1 0 "[ ]"
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 2 C Q4 1 15 G H1 3.000 2.200 4.200 2.439 2.439 2.439 . 0 0 "[ ]" 1
2 1 15 G H1 1 16 A H2 3.500 2.500 5.000 4.918 4.918 4.918 . 0 0 "[ ]" 1
3 1 3 C Q4 1 14 G H1 3.000 2.500 4.000 2.463 2.463 2.463 0.037 1 0 "[ ]" 1
4 1 3 C H5 1 14 G H1 5.000 4.000 6.000 5.036 5.036 5.036 . 0 0 "[ ]" 1
5 1 10 C Q4 1 12 C H1' 4.000 2.500 5.500 5.398 5.398 5.398 . 0 0 "[ ]" 1
6 1 12 C H1' 1 25 G H1 3.200 2.200 4.400 4.158 4.158 4.158 . 0 0 "[ ]" 1
7 1 5 G H1 1 12 C Q4 2.500 2.500 3.500 2.665 2.665 2.665 . 0 0 "[ ]" 1
8 1 12 C H1' 1 25 G Q2 3.500 2.200 4.500 3.364 3.364 3.364 . 0 0 "[ ]" 1
9 1 6 U H5 1 24 A Q6 3.500 2.200 4.800 4.270 4.270 4.270 . 0 0 "[ ]" 1
10 1 6 U H3 1 24 A Q6 3.000 . 4.000 2.619 2.619 2.619 . 0 0 "[ ]" 1
11 1 5 G H1 1 24 A Q6 4.000 . 7.000 3.438 3.438 3.438 . 0 0 "[ ]" 1
12 1 12 C H2' 1 24 A Q6 4.000 3.000 5.000 3.994 3.994 3.994 . 0 0 "[ ]" 1
13 1 6 U H3 1 24 A H8 3.000 . 4.000 3.024 3.024 3.024 . 0 0 "[ ]" 1
14 1 7 CH H41 1 24 A H8 5.000 3.650 5.150 3.507 3.507 3.507 0.143 1 0 "[ ]" 1
15 1 5 G H2' 1 23 A Q6 4.000 3.000 5.000 2.996 2.996 2.996 0.004 1 0 "[ ]" 1
16 1 6 U H3 1 7 CH H41 . 4.000 4.500 3.977 3.977 3.977 0.023 1 0 "[ ]" 1
17 1 6 U H3 1 7 CH H5 4.000 3.000 5.000 4.727 4.727 4.727 . 0 0 "[ ]" 1
18 1 10 C H2' 1 12 C Q4 5.000 4.000 6.000 4.964 4.964 4.964 . 0 0 "[ ]" 1
19 1 10 C Q4 1 25 G H1 2.500 . 3.500 2.438 2.438 2.438 . 0 0 "[ ]" 1
20 1 9 A H2 1 26 U H3 3.000 . 4.000 3.414 3.414 3.414 . 0 0 "[ ]" 1
21 1 9 A Q6 1 26 U H3 3.500 2.200 4.500 3.222 3.222 3.222 . 0 0 "[ ]" 1
22 1 25 G H1 1 26 U H3 4.500 3.000 6.000 3.407 3.407 3.407 . 0 0 "[ ]" 1
23 1 8 G H1 1 27 C Q4 2.500 2.500 3.500 2.447 2.447 2.447 0.053 1 0 "[ ]" 1
24 1 2 C Q4 1 14 G H1 5.000 4.000 6.500 5.058 5.058 5.058 . 0 0 "[ ]" 1
25 1 2 C H5 1 15 G H1 4.550 3.550 5.050 5.018 5.018 5.018 . 0 0 "[ ]" 1
26 1 15 G H1 1 16 A H1' 5.000 3.500 6.500 5.693 5.693 5.693 . 0 0 "[ ]" 1
27 1 3 C Q4 1 4 G H1 5.000 3.500 6.000 4.464 4.464 4.464 . 0 0 "[ ]" 1
28 1 3 C H5 1 15 G H1 4.590 3.590 5.090 4.405 4.405 4.405 . 0 0 "[ ]" 1
29 1 14 G H1 1 15 G H1' 4.000 3.000 5.500 5.049 5.049 5.049 . 0 0 "[ ]" 1
30 1 4 G H1 1 13 C H1' 5.000 4.000 5.500 5.178 5.178 5.178 . 0 0 "[ ]" 1
31 1 6 U H3 1 12 C H1' 5.500 3.000 7.500 7.485 7.485 7.485 . 0 0 "[ ]" 1
32 1 5 G H1 1 12 C H5 5.000 4.000 6.000 5.170 5.170 5.170 . 0 0 "[ ]" 1
33 1 12 C HO2' 1 25 G H1 5.000 4.000 5.500 5.171 5.171 5.171 . 0 0 "[ ]" 1
34 1 5 G H1 1 6 U H5 4.500 3.000 6.000 5.991 5.991 5.991 . 0 0 "[ ]" 1
35 1 24 A H2 1 25 G H1 5.000 3.500 6.500 6.513 6.513 6.513 0.013 1 0 "[ ]" 1
36 1 7 CH H41 1 24 A Q6 5.320 4.320 5.610 4.907 4.907 4.907 . 0 0 "[ ]" 1
37 1 24 A Q6 1 25 G H1 4.500 3.500 5.500 4.389 4.389 4.389 . 0 0 "[ ]" 1
38 1 5 G H1 1 23 A H2 5.330 4.330 5.830 5.819 5.819 5.819 . 0 0 "[ ]" 1
39 1 6 U H3 1 23 A H2 5.070 4.070 5.570 3.972 3.972 3.972 0.098 1 0 "[ ]" 1
40 1 12 C HO2' 1 23 A H2 4.560 3.560 5.060 4.764 4.764 4.764 . 0 0 "[ ]" 1
41 1 13 C HO2' 1 23 A H2 4.500 3.500 5.500 5.116 5.116 5.116 . 0 0 "[ ]" 1
42 1 12 C HO2' 1 25 G Q2 4.810 3.850 5.310 4.500 4.500 4.500 . 0 0 "[ ]" 1
43 1 5 G H1 1 10 C Q4 5.000 3.000 7.000 5.317 5.317 5.317 . 0 0 "[ ]" 1
44 1 10 C Q4 1 26 U H3 5.000 3.500 6.500 3.758 3.758 3.758 . 0 0 "[ ]" 1
45 1 9 A H2 1 25 G H1 5.000 3.500 6.500 4.943 4.943 4.943 . 0 0 "[ ]" 1
46 1 26 U H1' 1 26 U H3 5.370 4.370 5.870 4.657 4.657 4.657 . 0 0 "[ ]" 1
47 1 8 G H1 1 26 U H5 5.000 4.000 6.500 6.250 6.250 6.250 . 0 0 "[ ]" 1
48 1 8 G H1 1 27 C H5 5.930 4.930 6.430 5.039 5.039 5.039 . 0 0 "[ ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 514
_Distance_constraint_stats_list.Viol_count 39
_Distance_constraint_stats_list.Viol_total 4.187
_Distance_constraint_stats_list.Viol_max 0.506
_Distance_constraint_stats_list.Viol_rms 0.0422
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0081
_Distance_constraint_stats_list.Viol_average_violations_only 0.1074
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
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 U 0.006 0.006 1 0 "[ ]"
1 2 C 0.008 0.008 1 0 "[ ]"
1 3 C 0.000 0.000 . 0 "[ ]"
1 4 G 0.010 0.010 1 0 "[ ]"
1 5 G 0.213 0.204 1 0 "[ ]"
1 6 U 0.282 0.248 1 0 "[ ]"
1 7 CH 0.410 0.248 1 0 "[ ]"
1 8 G 0.000 0.000 . 0 "[ ]"
1 9 A 0.319 0.197 1 0 "[ ]"
1 10 C 0.464 0.291 1 0 "[ ]"
1 11 U 0.571 0.291 1 0 "[ ]"
1 12 C 0.000 0.000 . 0 "[ ]"
1 13 C 0.506 0.506 1 1 [+]
1 14 G 0.000 0.000 . 0 "[ ]"
1 15 G 0.087 0.087 1 0 "[ ]"
1 16 A 0.405 0.317 1 0 "[ ]"
1 17 G 0.000 0.000 . 0 "[ ]"
1 18 A 0.339 0.174 1 0 "[ ]"
1 19 A 0.692 0.317 1 0 "[ ]"
1 20 A 0.435 0.268 1 0 "[ ]"
1 21 C 0.046 0.038 1 0 "[ ]"
1 22 A 0.027 0.020 1 0 "[ ]"
1 23 A 0.038 0.038 1 0 "[ ]"
1 24 A 0.136 0.097 1 0 "[ ]"
1 25 G 0.118 0.078 1 0 "[ ]"
1 26 U 0.191 0.151 1 0 "[ ]"
1 27 C 0.290 0.290 1 0 "[ ]"
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 U H1' 1 1 U H2' 2.500 . 3.000 2.853 2.853 2.853 . 0 0 "[ ]" 2
2 1 1 U H1' 1 1 U H3' 4.300 3.500 5.300 3.982 3.982 3.982 . 0 0 "[ ]" 2
3 1 1 U H1' 1 1 U H4' 3.300 2.500 4.100 3.446 3.446 3.446 . 0 0 "[ ]" 2
4 1 1 U H1' 1 1 U H5' 4.300 3.300 5.300 4.818 4.818 4.818 . 0 0 "[ ]" 2
5 1 1 U H1' 1 1 U H5'' 4.300 3.300 5.300 5.123 5.123 5.123 . 0 0 "[ ]" 2
6 1 1 U H2' 1 1 U H3' 2.500 . 3.000 2.239 2.239 2.239 . 0 0 "[ ]" 2
7 1 1 U H2' 1 1 U H4' 4.300 3.500 5.100 3.996 3.996 3.996 . 0 0 "[ ]" 2
8 1 1 U H3' 1 1 U H4' 2.500 . 3.200 2.943 2.943 2.943 . 0 0 "[ ]" 2
9 1 1 U H3' 1 1 U H5' 3.300 2.300 4.100 3.457 3.457 3.457 . 0 0 "[ ]" 2
10 1 1 U H3' 1 1 U H5'' 3.300 2.300 4.100 2.380 2.380 2.380 . 0 0 "[ ]" 2
11 1 1 U H4' 1 1 U H5' 2.500 . 3.200 2.398 2.398 2.398 . 0 0 "[ ]" 2
12 1 1 U H4' 1 1 U H5'' 2.500 . 3.200 2.477 2.477 2.477 . 0 0 "[ ]" 2
13 1 1 U H2' 1 2 C H1' 4.500 3.000 6.000 4.217 4.217 4.217 . 0 0 "[ ]" 2
14 1 1 U H1' 1 1 U H6 3.300 2.400 4.300 3.606 3.606 3.606 . 0 0 "[ ]" 2
15 1 1 U H1' 1 2 C H6 5.000 4.000 6.000 4.604 4.604 4.604 . 0 0 "[ ]" 2
16 1 1 U H2' 1 1 U H6 4.300 3.300 5.300 3.294 3.294 3.294 0.006 1 0 "[ ]" 2
17 1 1 U H2' 1 2 C H5 4.500 3.000 6.000 3.630 3.630 3.630 . 0 0 "[ ]" 2
18 1 1 U H2' 1 2 C H6 2.500 . 3.000 2.037 2.037 2.037 . 0 0 "[ ]" 2
19 1 1 U H3' 1 1 U H6 3.300 2.500 4.300 3.148 3.148 3.148 . 0 0 "[ ]" 2
20 1 1 U H3' 1 2 C H5 4.000 2.500 5.200 4.697 4.697 4.697 . 0 0 "[ ]" 2
21 1 1 U H3' 1 2 C H6 3.300 2.300 4.100 3.660 3.660 3.660 . 0 0 "[ ]" 2
22 1 1 U H4' 1 1 U H6 4.300 3.500 5.100 4.017 4.017 4.017 . 0 0 "[ ]" 2
23 1 1 U H4' 1 2 C H6 5.000 4.000 6.000 5.938 5.938 5.938 . 0 0 "[ ]" 2
24 1 1 U H5' 1 1 U H6 3.300 2.300 4.300 3.361 3.361 3.361 . 0 0 "[ ]" 2
25 1 1 U H5'' 1 1 U H6 3.500 2.500 5.000 3.726 3.726 3.726 . 0 0 "[ ]" 2
26 1 1 U H5 1 2 C H5 4.000 2.500 5.500 4.500 4.500 4.500 . 0 0 "[ ]" 2
27 1 1 U H6 1 2 C H5 4.300 3.300 5.300 4.742 4.742 4.742 . 0 0 "[ ]" 2
28 1 1 U H6 1 2 C H6 5.000 4.000 6.500 4.775 4.775 4.775 . 0 0 "[ ]" 2
29 1 2 C H1' 1 2 C H2' 2.500 . 3.000 2.839 2.839 2.839 . 0 0 "[ ]" 2
30 1 2 C H1' 1 2 C H3' 4.300 3.500 5.300 3.911 3.911 3.911 . 0 0 "[ ]" 2
31 1 2 C H1' 1 2 C H4' 3.300 2.600 4.000 3.201 3.201 3.201 . 0 0 "[ ]" 2
32 1 2 C H2' 1 2 C H3' 2.500 . 3.000 2.293 2.293 2.293 . 0 0 "[ ]" 2
33 1 2 C H2' 1 2 C H4' 4.300 3.500 5.100 3.845 3.845 3.845 . 0 0 "[ ]" 2
34 1 2 C H2' 1 2 C H5'' 5.000 3.500 6.000 4.320 4.320 4.320 . 0 0 "[ ]" 2
35 1 2 C H3' 1 2 C H4' 3.300 2.500 4.300 3.014 3.014 3.014 . 0 0 "[ ]" 2
36 1 2 C H3' 1 2 C H5' 3.300 2.300 4.300 3.026 3.026 3.026 . 0 0 "[ ]" 2
37 1 2 C H3' 1 2 C H5'' 3.300 2.300 4.300 2.292 2.292 2.292 0.008 1 0 "[ ]" 2
38 1 2 C H4' 1 2 C H5' 2.500 . 3.300 2.386 2.386 2.386 . 0 0 "[ ]" 2
39 1 2 C H4' 1 2 C H5'' 2.500 . 3.300 3.006 3.006 3.006 . 0 0 "[ ]" 2
40 1 2 C H2' 1 3 C H3' 5.000 4.000 6.000 5.164 5.164 5.164 . 0 0 "[ ]" 2
41 1 2 C H1' 1 2 C H6 4.300 3.300 5.300 3.529 3.529 3.529 . 0 0 "[ ]" 2
42 1 2 C H1' 1 3 C H6 5.000 4.000 6.000 5.198 5.198 5.198 . 0 0 "[ ]" 2
43 1 2 C H1' 1 16 A H2 3.500 2.700 5.000 3.682 3.682 3.682 . 0 0 "[ ]" 2
44 1 2 C H1' 1 18 A H2 4.000 2.500 5.000 2.636 2.636 2.636 . 0 0 "[ ]" 2
45 1 2 C H2' 1 2 C H6 4.500 3.500 6.000 3.870 3.870 3.870 . 0 0 "[ ]" 2
46 1 2 C H2' 1 3 C H5 3.300 2.300 4.300 2.980 2.980 2.980 . 0 0 "[ ]" 2
47 1 2 C H2' 1 3 C H6 2.500 . 3.500 2.436 2.436 2.436 . 0 0 "[ ]" 2
48 1 2 C H2' 1 18 A H2 4.000 3.000 6.000 4.661 4.661 4.661 . 0 0 "[ ]" 2
49 1 2 C H3' 1 3 C H5 4.000 3.000 5.500 3.815 3.815 3.815 . 0 0 "[ ]" 2
50 1 2 C H3' 1 3 C H6 4.300 3.300 5.800 3.624 3.624 3.624 . 0 0 "[ ]" 2
51 1 2 C H4' 1 2 C H6 5.000 4.000 6.000 4.246 4.246 4.246 . 0 0 "[ ]" 2
52 1 2 C H5' 1 2 C H6 4.300 3.300 5.300 4.568 4.568 4.568 . 0 0 "[ ]" 2
53 1 3 C H1' 1 3 C H2' 2.500 . 3.200 2.864 2.864 2.864 . 0 0 "[ ]" 2
54 1 3 C H1' 1 3 C H4' 3.300 2.300 4.300 3.264 3.264 3.264 . 0 0 "[ ]" 2
55 1 3 C H2' 1 3 C H3' 2.500 . 3.200 2.252 2.252 2.252 . 0 0 "[ ]" 2
56 1 3 C H2' 1 3 C H4' 4.000 3.000 5.000 3.942 3.942 3.942 . 0 0 "[ ]" 2
57 1 3 C H3' 1 3 C H4' 2.500 . 3.300 2.971 2.971 2.971 . 0 0 "[ ]" 2
58 1 3 C H4' 1 3 C H5' 2.500 . 3.200 2.278 2.278 2.278 . 0 0 "[ ]" 2
59 1 3 C H4' 1 3 C H5'' 2.500 . 3.200 2.642 2.642 2.642 . 0 0 "[ ]" 2
60 1 3 C H1' 1 3 C H6 4.500 3.000 6.000 3.646 3.646 3.646 . 0 0 "[ ]" 2
61 1 3 C H1' 1 4 G H8 5.000 4.000 6.000 4.774 4.774 4.774 . 0 0 "[ ]" 2
62 1 3 C H1' 1 18 A H8 5.000 3.500 6.500 5.981 5.981 5.981 . 0 0 "[ ]" 2
63 1 3 C H2' 1 3 C H6 4.200 3.200 5.200 3.224 3.224 3.224 . 0 0 "[ ]" 2
64 1 3 C H2' 1 4 G H8 2.500 . 3.500 2.170 2.170 2.170 . 0 0 "[ ]" 2
65 1 3 C H3' 1 3 C H5 5.000 4.000 6.000 5.212 5.212 5.212 . 0 0 "[ ]" 2
66 1 3 C H3' 1 4 G H8 3.500 2.500 4.500 3.298 3.298 3.298 . 0 0 "[ ]" 2
67 1 3 C H4' 1 3 C H6 5.000 4.000 6.000 4.101 4.101 4.101 . 0 0 "[ ]" 2
68 1 4 G H1' 1 4 G H2' 2.500 . 3.000 2.860 2.860 2.860 . 0 0 "[ ]" 2
69 1 4 G H1' 1 4 G H3' 4.300 3.500 5.300 3.961 3.961 3.961 . 0 0 "[ ]" 2
70 1 4 G H2' 1 4 G H3' 2.500 . 3.200 2.242 2.242 2.242 . 0 0 "[ ]" 2
71 1 4 G H3' 1 4 G H4' 2.500 . 3.200 2.932 2.932 2.932 . 0 0 "[ ]" 2
72 1 4 G H3' 1 4 G H5'' 3.300 2.300 4.000 2.463 2.463 2.463 . 0 0 "[ ]" 2
73 1 4 G H4' 1 4 G H5' 2.500 . 3.300 2.380 2.380 2.380 . 0 0 "[ ]" 2
74 1 4 G H4' 1 4 G H5'' 2.500 . 3.300 2.470 2.470 2.470 . 0 0 "[ ]" 2
75 1 4 G H2' 1 5 G H5' 3.500 2.300 5.500 4.686 4.686 4.686 . 0 0 "[ ]" 2
76 1 4 G H2' 1 5 G H5'' 3.500 2.300 5.500 4.119 4.119 4.119 . 0 0 "[ ]" 2
77 1 4 G H1' 1 4 G H8 4.000 3.000 5.000 3.889 3.889 3.889 . 0 0 "[ ]" 2
78 1 4 G H1' 1 5 G H8 5.000 3.500 6.000 4.812 4.812 4.812 . 0 0 "[ ]" 2
79 1 4 G H2' 1 4 G H8 3.300 2.300 4.300 3.155 3.155 3.155 . 0 0 "[ ]" 2
80 1 4 G H2' 1 5 G H8 3.300 2.300 4.300 2.290 2.290 2.290 0.010 1 0 "[ ]" 2
81 1 4 G H3' 1 4 G H8 3.300 2.300 4.300 3.067 3.067 3.067 . 0 0 "[ ]" 2
82 1 4 G H3' 1 5 G H8 4.300 2.800 5.800 3.938 3.938 3.938 . 0 0 "[ ]" 2
83 1 4 G H5' 1 4 G H8 4.000 2.500 5.500 3.895 3.895 3.895 . 0 0 "[ ]" 2
84 1 4 G H5'' 1 4 G H8 4.000 2.500 5.500 4.141 4.141 4.141 . 0 0 "[ ]" 2
85 1 5 G H1' 1 5 G H2' 2.500 . 3.000 2.839 2.839 2.839 . 0 0 "[ ]" 2
86 1 5 G H1' 1 5 G H3' 4.300 3.300 5.300 3.887 3.887 3.887 . 0 0 "[ ]" 2
87 1 5 G H1' 1 5 G H4' 3.300 2.300 4.300 3.258 3.258 3.258 . 0 0 "[ ]" 2
88 1 5 G H2' 1 5 G H3' 2.500 . 3.200 2.271 2.271 2.271 . 0 0 "[ ]" 2
89 1 5 G H2' 1 5 G H4' 4.300 3.500 5.100 3.889 3.889 3.889 . 0 0 "[ ]" 2
90 1 5 G H3' 1 5 G H4' 2.500 . 3.200 3.019 3.019 3.019 . 0 0 "[ ]" 2
91 1 5 G H3' 1 5 G H5' 3.300 2.300 4.300 3.183 3.183 3.183 . 0 0 "[ ]" 2
92 1 5 G H3' 1 5 G H5'' 3.300 2.300 4.300 2.096 2.096 2.096 0.204 1 0 "[ ]" 2
93 1 5 G H4' 1 5 G H5' 2.500 . 3.300 2.231 2.231 2.231 . 0 0 "[ ]" 2
94 1 5 G H4' 1 5 G H5'' 2.500 . 3.300 2.968 2.968 2.968 . 0 0 "[ ]" 2
95 1 5 G H2' 1 5 G H8 4.500 3.000 6.000 3.764 3.764 3.764 . 0 0 "[ ]" 2
96 1 5 G H2' 1 6 U H5 2.500 . 3.500 2.812 2.812 2.812 . 0 0 "[ ]" 2
97 1 5 G H2' 1 6 U H6 2.500 . 3.500 3.448 3.448 3.448 . 0 0 "[ ]" 2
98 1 5 G H3' 1 5 G H8 3.300 2.500 4.100 3.319 3.319 3.319 . 0 0 "[ ]" 2
99 1 5 G H5' 1 5 G H8 4.000 3.000 5.500 4.652 4.652 4.652 . 0 0 "[ ]" 2
100 1 5 G H5'' 1 5 G H8 4.000 3.000 5.500 3.448 3.448 3.448 . 0 0 "[ ]" 2
101 1 6 U H1' 1 6 U H2' 2.500 . 3.000 2.778 2.778 2.778 . 0 0 "[ ]" 2
102 1 6 U H1' 1 6 U H3' 4.000 3.000 5.000 3.898 3.898 3.898 . 0 0 "[ ]" 2
103 1 6 U H1' 1 6 U H4' 3.300 2.800 3.800 3.400 3.400 3.400 . 0 0 "[ ]" 2
104 1 6 U H1' 1 6 U H5'' 5.000 4.000 6.000 5.203 5.203 5.203 . 0 0 "[ ]" 2
105 1 6 U H2' 1 6 U H3' 2.500 . 3.000 2.287 2.287 2.287 . 0 0 "[ ]" 2
106 1 6 U H2' 1 6 U H4' 4.300 3.800 4.800 3.887 3.887 3.887 . 0 0 "[ ]" 2
107 1 6 U H3' 1 6 U H4' 3.300 2.800 3.800 2.985 2.985 2.985 . 0 0 "[ ]" 2
108 1 6 U H3' 1 6 U H5' 3.200 2.200 4.200 3.626 3.626 3.626 . 0 0 "[ ]" 2
109 1 6 U H3' 1 6 U H5'' 3.200 2.200 4.200 2.681 2.681 2.681 . 0 0 "[ ]" 2
110 1 6 U H4' 1 6 U H5' 2.500 . 3.000 2.423 2.423 2.423 . 0 0 "[ ]" 2
111 1 6 U H4' 1 6 U H5'' 2.500 . 3.000 2.460 2.460 2.460 . 0 0 "[ ]" 2
112 1 6 U H3' 1 7 CH H2' 3.300 2.300 4.800 2.286 2.286 2.286 0.014 1 0 "[ ]" 2
113 1 6 U H3' 1 7 CH H3' 4.000 2.500 5.500 2.252 2.252 2.252 0.248 1 0 "[ ]" 2
114 1 6 U H1' 1 6 U H6 3.300 2.800 3.900 3.701 3.701 3.701 . 0 0 "[ ]" 2
115 1 6 U H1' 1 7 CH H5 5.000 4.000 6.000 5.215 5.215 5.215 . 0 0 "[ ]" 2
116 1 6 U H2' 1 6 U H5 5.000 3.500 6.000 4.792 4.792 4.792 . 0 0 "[ ]" 2
117 1 6 U H2' 1 6 U H6 3.300 2.800 3.800 3.245 3.245 3.245 . 0 0 "[ ]" 2
118 1 6 U H2' 1 7 CH H5 3.000 . 4.000 3.854 3.854 3.854 . 0 0 "[ ]" 2
119 1 6 U H2' 1 7 CH H6 3.000 2.200 3.800 2.351 2.351 2.351 . 0 0 "[ ]" 2
120 1 6 U H3' 1 6 U H5 5.000 4.000 6.000 4.475 4.475 4.475 . 0 0 "[ ]" 2
121 1 6 U H3' 1 6 U H6 2.500 . 3.000 2.441 2.441 2.441 . 0 0 "[ ]" 2
122 1 6 U H3' 1 7 CH H5 5.000 4.000 6.000 6.020 6.020 6.020 0.020 1 0 "[ ]" 2
123 1 6 U H3' 1 7 CH H6 3.500 2.800 4.200 3.995 3.995 3.995 . 0 0 "[ ]" 2
124 1 6 U H4' 1 6 U H6 5.000 3.500 6.000 3.949 3.949 3.949 . 0 0 "[ ]" 2
125 1 6 U H5' 1 6 U H6 5.000 3.500 6.000 3.581 3.581 3.581 . 0 0 "[ ]" 2
126 1 6 U H6 1 7 CH H6 5.000 4.000 6.000 4.946 4.946 4.946 . 0 0 "[ ]" 2
127 1 7 CH H1' 1 7 CH H2' 3.300 2.800 3.800 3.007 3.007 3.007 . 0 0 "[ ]" 2
128 1 7 CH H1' 1 7 CH H3' 4.300 3.800 4.800 3.835 3.835 3.835 . 0 0 "[ ]" 2
129 1 7 CH H1' 1 7 CH H4' 3.300 2.500 4.100 3.212 3.212 3.212 . 0 0 "[ ]" 2
130 1 7 CH H2' 1 7 CH H3' 2.500 . 3.000 2.292 2.292 2.292 . 0 0 "[ ]" 2
131 1 7 CH H2' 1 7 CH H4' 5.000 4.000 6.000 3.900 3.900 3.900 0.100 1 0 "[ ]" 2
132 1 7 CH H3' 1 7 CH H4' 3.300 2.300 4.300 2.831 2.831 2.831 . 0 0 "[ ]" 2
133 1 7 CH H4' 1 7 CH H5' 2.500 . 3.000 2.545 2.545 2.545 . 0 0 "[ ]" 2
134 1 7 CH H4' 1 7 CH H5'' 2.500 . 3.000 2.399 2.399 2.399 . 0 0 "[ ]" 2
135 1 7 CH H1' 1 7 CH H6 4.000 2.500 5.500 3.729 3.729 3.729 . 0 0 "[ ]" 2
136 1 7 CH H1' 1 8 G H8 4.000 2.500 5.500 4.945 4.945 4.945 . 0 0 "[ ]" 2
137 1 7 CH H2' 1 7 CH H6 3.500 2.800 4.200 2.772 2.772 2.772 0.028 1 0 "[ ]" 2
138 1 6 U H6 1 7 CH H2' 3.300 2.500 3.800 2.541 2.541 2.541 . 0 0 "[ ]" 2
139 1 7 CH H4' 1 8 G H8 4.000 2.500 5.000 2.641 2.641 2.641 . 0 0 "[ ]" 2
140 1 7 CH H5' 1 7 CH H6 5.000 3.500 6.000 3.590 3.590 3.590 . 0 0 "[ ]" 2
141 1 7 CH H5'' 1 7 CH H6 5.000 3.500 6.000 4.569 4.569 4.569 . 0 0 "[ ]" 2
142 1 8 G H1' 1 8 G H2' 2.500 . 3.500 2.787 2.787 2.787 . 0 0 "[ ]" 2
143 1 8 G H1' 1 8 G H8 4.000 2.500 5.500 3.476 3.476 3.476 . 0 0 "[ ]" 2
144 1 9 A H1' 1 9 A H2' 2.500 . 3.000 2.724 2.724 2.724 . 0 0 "[ ]" 2
145 1 9 A H1' 1 9 A H3' 4.300 3.800 5.300 3.886 3.886 3.886 . 0 0 "[ ]" 2
146 1 9 A H1' 1 9 A H4' 3.300 2.300 3.800 3.702 3.702 3.702 . 0 0 "[ ]" 2
147 1 9 A H2' 1 9 A H3' 3.300 2.300 4.300 2.290 2.290 2.290 0.010 1 0 "[ ]" 2
148 1 9 A H2' 1 9 A H4' 3.300 2.300 4.300 4.018 4.018 4.018 . 0 0 "[ ]" 2
149 1 9 A H3' 1 9 A H4' 2.500 . 3.000 2.955 2.955 2.955 . 0 0 "[ ]" 2
150 1 9 A H3' 1 9 A H5'' 4.000 2.200 5.500 2.003 2.003 2.003 0.197 1 0 "[ ]" 2
151 1 9 A H4' 1 9 A H5' 3.000 2.200 3.800 2.290 2.290 2.290 . 0 0 "[ ]" 2
152 1 9 A H4' 1 9 A H5'' 3.000 2.200 3.800 2.959 2.959 2.959 . 0 0 "[ ]" 2
153 1 9 A H2' 1 10 C H1' 5.000 4.000 6.000 4.167 4.167 4.167 . 0 0 "[ ]" 2
154 1 9 A H2' 1 10 C H4' 5.000 3.500 6.000 4.809 4.809 4.809 . 0 0 "[ ]" 2
155 1 9 A H2' 1 10 C H5'' 3.700 2.500 4.900 4.086 4.086 4.086 . 0 0 "[ ]" 2
156 1 9 A H2' 1 10 C H6 3.300 2.300 3.800 2.188 2.188 2.188 0.112 1 0 "[ ]" 2
157 1 9 A H3' 1 9 A H8 3.300 2.300 4.300 3.645 3.645 3.645 . 0 0 "[ ]" 2
158 1 9 A H3' 1 10 C H6 4.000 2.800 5.200 3.003 3.003 3.003 . 0 0 "[ ]" 2
159 1 10 C H1' 1 10 C H2' 2.500 . 3.000 2.722 2.722 2.722 . 0 0 "[ ]" 2
160 1 10 C H1' 1 10 C H3' 3.300 2.800 3.800 3.796 3.796 3.796 . 0 0 "[ ]" 2
161 1 10 C H1' 1 10 C H4' 4.000 3.000 5.000 3.484 3.484 3.484 . 0 0 "[ ]" 2
162 1 10 C H2' 1 10 C H3' 2.500 . 3.000 2.325 2.325 2.325 . 0 0 "[ ]" 2
163 1 10 C H2' 1 10 C H4' 4.300 3.800 4.800 3.921 3.921 3.921 . 0 0 "[ ]" 2
164 1 10 C H3' 1 10 C H4' 2.500 . 3.000 3.026 3.026 3.026 0.026 1 0 "[ ]" 2
165 1 10 C H3' 1 10 C H5' 3.300 2.300 4.300 3.000 3.000 3.000 . 0 0 "[ ]" 2
166 1 10 C H3' 1 10 C H5'' 3.300 2.300 4.300 2.265 2.265 2.265 0.035 1 0 "[ ]" 2
167 1 10 C H4' 1 10 C H5' 3.000 2.200 3.800 2.402 2.402 2.402 . 0 0 "[ ]" 2
168 1 10 C H4' 1 10 C H5'' 3.000 2.200 3.800 2.978 2.978 2.978 . 0 0 "[ ]" 2
169 1 10 C H2' 1 11 U H2' 4.500 3.000 6.000 3.629 3.629 3.629 . 0 0 "[ ]" 2
170 1 10 C H2' 1 11 U H3' 5.000 3.500 6.000 4.087 4.087 4.087 . 0 0 "[ ]" 2
171 1 9 A H2 1 10 C H1' 3.300 2.800 3.800 3.442 3.442 3.442 . 0 0 "[ ]" 2
172 1 10 C H1' 1 10 C H6 3.300 2.300 3.800 3.404 3.404 3.404 . 0 0 "[ ]" 2
173 1 10 C H2' 1 10 C H6 4.300 3.800 4.800 4.151 4.151 4.151 . 0 0 "[ ]" 2
174 1 10 C H2' 1 11 U H6 5.000 3.500 6.500 4.937 4.937 4.937 . 0 0 "[ ]" 2
175 1 10 C H2' 1 12 C H5 3.000 2.200 4.300 4.205 4.205 4.205 . 0 0 "[ ]" 2
176 1 10 C H2' 1 12 C H6 3.300 2.500 4.100 3.744 3.744 3.744 . 0 0 "[ ]" 2
177 1 10 C H3' 1 10 C H5 5.000 4.000 6.000 5.098 5.098 5.098 . 0 0 "[ ]" 2
178 1 10 C H3' 1 10 C H6 3.000 2.200 3.800 3.498 3.498 3.498 . 0 0 "[ ]" 2
179 1 10 C H3' 1 12 C H5 3.300 2.500 4.100 3.022 3.022 3.022 . 0 0 "[ ]" 2
180 1 10 C H4' 1 11 U H5 5.000 4.000 6.000 3.709 3.709 3.709 0.291 1 0 "[ ]" 2
181 1 10 C H4' 1 10 C H6 5.000 4.000 6.000 4.225 4.225 4.225 . 0 0 "[ ]" 2
182 1 10 C H5'' 1 10 C H6 4.000 2.500 5.500 2.829 2.829 2.829 . 0 0 "[ ]" 2
183 1 11 U H1' 1 11 U H2' 2.500 . 3.000 2.983 2.983 2.983 . 0 0 "[ ]" 2
184 1 11 U H1' 1 11 U H3' 4.300 3.300 5.300 3.873 3.873 3.873 . 0 0 "[ ]" 2
185 1 11 U H1' 1 11 U H4' 3.300 2.600 4.000 3.506 3.506 3.506 . 0 0 "[ ]" 2
186 1 11 U H2' 1 11 U H3' 2.500 . 3.200 2.313 2.313 2.313 . 0 0 "[ ]" 2
187 1 11 U H2' 1 11 U H4' 3.300 2.300 4.000 3.905 3.905 3.905 . 0 0 "[ ]" 2
188 1 11 U H2' 1 11 U H5'' 4.300 3.500 5.100 3.560 3.560 3.560 . 0 0 "[ ]" 2
189 1 11 U H2' 1 11 U H5' 4.300 3.500 5.100 4.151 4.151 4.151 . 0 0 "[ ]" 2
190 1 11 U H3' 1 11 U H4' 3.300 2.600 4.000 2.773 2.773 2.773 . 0 0 "[ ]" 2
191 1 11 U H3' 1 11 U H5'' 3.300 2.300 4.100 2.322 2.322 2.322 . 0 0 "[ ]" 2
192 1 11 U H3' 1 11 U H5' 3.300 2.300 4.100 3.574 3.574 3.574 . 0 0 "[ ]" 2
193 1 11 U H4' 1 11 U H5'' 2.500 . 3.200 2.516 2.516 2.516 . 0 0 "[ ]" 2
194 1 11 U H4' 1 11 U H5' 2.500 . 3.200 2.405 2.405 2.405 . 0 0 "[ ]" 2
195 1 11 U H1' 1 11 U H6 3.300 2.800 3.800 3.676 3.676 3.676 . 0 0 "[ ]" 2
196 1 11 U H2' 1 11 U H5 5.000 4.000 6.000 4.054 4.054 4.054 . 0 0 "[ ]" 2
197 1 11 U H2' 1 11 U H6 2.500 . 3.000 2.128 2.128 2.128 . 0 0 "[ ]" 2
198 1 11 U H2' 1 12 C H5 5.000 4.000 6.500 4.528 4.528 4.528 . 0 0 "[ ]" 2
199 1 11 U H2' 1 12 C H6 4.300 3.500 5.100 3.967 3.967 3.967 . 0 0 "[ ]" 2
200 1 11 U H3' 1 11 U H6 3.300 2.300 4.300 3.711 3.711 3.711 . 0 0 "[ ]" 2
201 1 11 U H3' 1 12 C H5 3.500 2.500 4.500 2.986 2.986 2.986 . 0 0 "[ ]" 2
202 1 11 U H3' 1 12 C H6 2.500 . 3.300 2.146 2.146 2.146 . 0 0 "[ ]" 2
203 1 11 U H4' 1 11 U H6 5.000 4.000 6.000 4.256 4.256 4.256 . 0 0 "[ ]" 2
204 1 11 U H4' 1 12 C H5 5.000 4.000 6.500 4.794 4.794 4.794 . 0 0 "[ ]" 2
205 1 11 U H4' 1 12 C H6 5.000 4.000 6.000 4.539 4.539 4.539 . 0 0 "[ ]" 2
206 1 11 U H5'' 1 11 U H6 4.300 3.800 4.800 3.593 3.593 3.593 0.207 1 0 "[ ]" 2
207 1 11 U H5' 1 11 U H6 4.500 3.500 6.000 3.426 3.426 3.426 0.074 1 0 "[ ]" 2
208 1 11 U H5'' 1 12 C H5 4.000 2.500 5.500 2.744 2.744 2.744 . 0 0 "[ ]" 2
209 1 11 U H5' 1 12 C H5 3.700 2.200 5.200 4.401 4.401 4.401 . 0 0 "[ ]" 2
210 1 11 U H5' 1 12 C H6 5.000 4.000 6.000 5.295 5.295 5.295 . 0 0 "[ ]" 2
211 1 12 C H1' 1 12 C H2' 2.500 . 3.000 2.823 2.823 2.823 . 0 0 "[ ]" 2
212 1 12 C H1' 1 12 C H3' 4.300 3.500 5.100 4.046 4.046 4.046 . 0 0 "[ ]" 2
213 1 12 C H1' 1 12 C H4' 3.300 2.500 4.100 3.225 3.225 3.225 . 0 0 "[ ]" 2
214 1 12 C H2' 1 12 C H3' 2.500 . 3.200 2.344 2.344 2.344 . 0 0 "[ ]" 2
215 1 12 C H2' 1 12 C H4' 4.300 3.300 5.300 3.840 3.840 3.840 . 0 0 "[ ]" 2
216 1 12 C H2' 1 12 C H5' 4.500 3.500 5.500 5.209 5.209 5.209 . 0 0 "[ ]" 2
217 1 12 C H2' 1 12 C H5'' 4.500 3.500 6.000 4.460 4.460 4.460 . 0 0 "[ ]" 2
218 1 12 C H3' 1 12 C H4' 2.500 . 3.000 2.946 2.946 2.946 . 0 0 "[ ]" 2
219 1 12 C H3' 1 12 C H5' 3.200 2.200 4.200 3.584 3.584 3.584 . 0 0 "[ ]" 2
220 1 12 C H3' 1 12 C H5'' 3.200 2.200 4.200 2.343 2.343 2.343 . 0 0 "[ ]" 2
221 1 12 C H4' 1 12 C H5' 2.500 . 3.200 2.262 2.262 2.262 . 0 0 "[ ]" 2
222 1 12 C H4' 1 12 C H5'' 2.500 . 3.200 2.496 2.496 2.496 . 0 0 "[ ]" 2
223 1 12 C H1' 1 12 C H6 4.300 3.300 5.300 3.509 3.509 3.509 . 0 0 "[ ]" 2
224 1 12 C H1' 1 13 C H6 5.000 4.000 6.500 5.387 5.387 5.387 . 0 0 "[ ]" 2
225 1 12 C H2' 1 12 C H6 4.300 3.300 5.300 3.716 3.716 3.716 . 0 0 "[ ]" 2
226 1 12 C H2' 1 13 C H5 3.300 2.300 4.300 2.528 2.528 2.528 . 0 0 "[ ]" 2
227 1 12 C H3' 1 12 C H6 3.500 2.500 4.500 3.662 3.662 3.662 . 0 0 "[ ]" 2
228 1 12 C H3' 1 13 C H5 3.300 2.300 4.800 2.604 2.604 2.604 . 0 0 "[ ]" 2
229 1 12 C H3' 1 13 C H6 3.300 2.500 4.300 3.154 3.154 3.154 . 0 0 "[ ]" 2
230 1 12 C H6 1 13 C H5 5.000 3.500 6.500 4.733 4.733 4.733 . 0 0 "[ ]" 2
231 1 13 C H1' 1 13 C H2' 2.500 . 3.000 2.786 2.786 2.786 . 0 0 "[ ]" 2
232 1 13 C H1' 1 13 C H3' 4.300 3.300 5.300 3.865 3.865 3.865 . 0 0 "[ ]" 2
233 1 13 C H1' 1 13 C H4' 3.300 2.300 4.300 3.546 3.546 3.546 . 0 0 "[ ]" 2
234 1 13 C H2' 1 13 C H3' 2.500 . 3.000 2.232 2.232 2.232 . 0 0 "[ ]" 2
235 1 13 C H2' 1 13 C H4' 4.300 3.500 5.100 3.946 3.946 3.946 . 0 0 "[ ]" 2
236 1 13 C H2' 1 13 C Q5' 4.300 3.300 5.300 3.785 3.785 3.785 . 0 0 "[ ]" 2
237 1 13 C H3' 1 13 C H4' 2.500 . 3.200 2.969 2.969 2.969 . 0 0 "[ ]" 2
238 1 13 C H3' 1 13 C Q5' 3.500 2.200 5.000 1.694 1.694 1.694 0.506 1 1 [+] 2
239 1 13 C H4' 1 13 C Q5' 2.500 . 3.200 2.226 2.226 2.226 . 0 0 "[ ]" 2
240 1 13 C H2' 1 14 G H1' 4.300 3.300 5.300 4.481 4.481 4.481 . 0 0 "[ ]" 2
241 1 13 C H1' 1 13 C H6 3.500 2.500 4.500 3.655 3.655 3.655 . 0 0 "[ ]" 2
242 1 13 C H1' 1 23 A H2 2.500 . 3.500 2.927 2.927 2.927 . 0 0 "[ ]" 2
243 1 13 C H2' 1 14 G H8 2.500 . 3.500 2.273 2.273 2.273 . 0 0 "[ ]" 2
244 1 13 C H2' 1 23 A H2 4.300 2.800 5.800 5.701 5.701 5.701 . 0 0 "[ ]" 2
245 1 13 C H3' 1 13 C H6 3.500 2.200 5.000 2.688 2.688 2.688 . 0 0 "[ ]" 2
246 1 13 C H3' 1 14 G H8 3.500 2.500 4.500 3.166 3.166 3.166 . 0 0 "[ ]" 2
247 1 13 C H4' 1 13 C H6 4.500 3.500 6.000 3.896 3.896 3.896 . 0 0 "[ ]" 2
248 1 13 C H4' 1 23 A H2 4.000 2.500 5.500 5.210 5.210 5.210 . 0 0 "[ ]" 2
249 1 13 C H4' 1 24 A H2 4.300 2.300 6.300 4.215 4.215 4.215 . 0 0 "[ ]" 2
250 1 13 C Q5' 1 13 C H6 4.000 2.200 5.300 2.762 2.762 2.762 . 0 0 "[ ]" 2
251 1 13 C Q5' 1 24 A H2 4.300 3.000 6.300 3.827 3.827 3.827 . 0 0 "[ ]" 2
252 1 14 G H1' 1 14 G H2' 2.500 . 3.000 2.785 2.785 2.785 . 0 0 "[ ]" 2
253 1 14 G H1' 1 14 G H3' 4.300 3.600 5.000 3.940 3.940 3.940 . 0 0 "[ ]" 2
254 1 14 G H1' 1 14 G H4' 3.300 2.600 4.000 3.555 3.555 3.555 . 0 0 "[ ]" 2
255 1 14 G H2' 1 14 G H3' 2.500 . 3.000 2.266 2.266 2.266 . 0 0 "[ ]" 2
256 1 14 G H2' 1 14 G H4' 4.000 3.000 5.000 3.985 3.985 3.985 . 0 0 "[ ]" 2
257 1 14 G H3' 1 14 G H4' 2.500 . 3.200 2.961 2.961 2.961 . 0 0 "[ ]" 2
258 1 14 G H3' 1 14 G H5' 3.200 2.200 4.200 3.503 3.503 3.503 . 0 0 "[ ]" 2
259 1 14 G H3' 1 14 G H5'' 3.200 2.200 4.200 2.274 2.274 2.274 . 0 0 "[ ]" 2
260 1 14 G H4' 1 14 G H5' 2.500 . 3.200 2.261 2.261 2.261 . 0 0 "[ ]" 2
261 1 14 G H4' 1 14 G H5'' 2.500 . 3.200 2.654 2.654 2.654 . 0 0 "[ ]" 2
262 1 14 G H2' 1 15 G H1' 4.500 3.000 6.000 4.227 4.227 4.227 . 0 0 "[ ]" 2
263 1 14 G H1' 1 14 G H8 3.500 2.500 4.500 3.814 3.814 3.814 . 0 0 "[ ]" 2
264 1 14 G H2' 1 14 G H8 4.500 3.000 6.000 3.571 3.571 3.571 . 0 0 "[ ]" 2
265 1 14 G H2' 1 15 G H8 3.300 2.300 4.300 2.303 2.303 2.303 . 0 0 "[ ]" 2
266 1 14 G H3' 1 15 G H8 4.000 2.800 5.000 3.447 3.447 3.447 . 0 0 "[ ]" 2
267 1 14 G H4' 1 14 G H8 5.000 3.500 6.500 4.176 4.176 4.176 . 0 0 "[ ]" 2
268 1 14 G H4' 1 22 A H2 4.000 3.200 4.800 3.629 3.629 3.629 . 0 0 "[ ]" 2
269 1 14 G H5' 1 22 A H2 4.500 3.700 5.500 4.055 4.055 4.055 . 0 0 "[ ]" 2
270 1 15 G H1' 1 15 G H2' 2.500 . 3.000 2.866 2.866 2.866 . 0 0 "[ ]" 2
271 1 15 G H1' 1 15 G H3' 4.300 3.800 5.300 3.985 3.985 3.985 . 0 0 "[ ]" 2
272 1 15 G H1' 1 15 G H4' 3.300 2.300 3.800 3.356 3.356 3.356 . 0 0 "[ ]" 2
273 1 15 G H2' 1 15 G H3' 2.500 . 3.000 2.251 2.251 2.251 . 0 0 "[ ]" 2
274 1 15 G H2' 1 15 G H4' 3.300 2.300 4.300 3.983 3.983 3.983 . 0 0 "[ ]" 2
275 1 15 G H3' 1 15 G H4' 2.500 . 3.000 2.955 2.955 2.955 . 0 0 "[ ]" 2
276 1 15 G H3' 1 15 G H5'' 3.300 2.300 3.800 2.213 2.213 2.213 0.087 1 0 "[ ]" 2
277 1 15 G H4' 1 15 G H5'' 3.300 2.800 4.300 3.042 3.042 3.042 . 0 0 "[ ]" 2
278 1 15 G H1' 1 15 G H8 4.300 3.300 5.300 3.702 3.702 3.702 . 0 0 "[ ]" 2
279 1 15 G H1' 1 20 A H8 4.000 2.500 5.500 3.849 3.849 3.849 . 0 0 "[ ]" 2
280 1 15 G H2' 1 15 G H8 5.000 3.500 6.500 3.763 3.763 3.763 . 0 0 "[ ]" 2
281 1 15 G H2' 1 16 A H8 2.500 . 3.200 2.167 2.167 2.167 . 0 0 "[ ]" 2
282 1 15 G H3' 1 15 G H8 4.300 3.300 5.300 3.897 3.897 3.897 . 0 0 "[ ]" 2
283 1 15 G H3' 1 16 A H8 3.300 2.600 4.000 3.583 3.583 3.583 . 0 0 "[ ]" 2
284 1 15 G H4' 1 15 G H8 5.000 4.000 6.000 4.449 4.449 4.449 . 0 0 "[ ]" 2
285 1 15 G H4' 1 19 A H8 3.500 2.500 5.000 2.545 2.545 2.545 . 0 0 "[ ]" 2
286 1 15 G H4' 1 20 A H8 3.500 2.500 4.500 4.009 4.009 4.009 . 0 0 "[ ]" 2
287 1 15 G H5'' 1 15 G H8 3.300 2.300 4.300 2.968 2.968 2.968 . 0 0 "[ ]" 2
288 1 15 G H5' 1 19 A H8 3.500 2.500 5.000 4.132 4.132 4.132 . 0 0 "[ ]" 2
289 1 15 G H5'' 1 19 A H8 4.000 3.000 5.500 5.196 5.196 5.196 . 0 0 "[ ]" 2
290 1 16 A H1' 1 16 A H2' 2.500 . 3.000 2.917 2.917 2.917 . 0 0 "[ ]" 2
291 1 16 A H1' 1 16 A H3' 4.300 3.500 5.100 3.954 3.954 3.954 . 0 0 "[ ]" 2
292 1 16 A H1' 1 16 A H4' 3.300 2.600 4.000 3.122 3.122 3.122 . 0 0 "[ ]" 2
293 1 16 A H2' 1 16 A H3' 2.500 . 3.000 2.223 2.223 2.223 . 0 0 "[ ]" 2
294 1 16 A H2' 1 16 A H4' 3.300 2.600 4.000 3.899 3.899 3.899 . 0 0 "[ ]" 2
295 1 16 A H3' 1 16 A H4' 2.500 . 3.200 2.916 2.916 2.916 . 0 0 "[ ]" 2
296 1 16 A H3' 1 16 A H5' 3.300 2.300 4.000 3.400 3.400 3.400 . 0 0 "[ ]" 2
297 1 16 A H3' 1 16 A H5'' 3.300 2.300 4.000 2.240 2.240 2.240 0.060 1 0 "[ ]" 2
298 1 16 A H4' 1 16 A H5' 2.500 . 3.100 2.304 2.304 2.304 . 0 0 "[ ]" 2
299 1 16 A H4' 1 16 A H5'' 2.500 . 3.100 2.507 2.507 2.507 . 0 0 "[ ]" 2
300 1 16 A H1' 1 18 A H1' 3.500 2.500 5.000 2.497 2.497 2.497 0.003 1 0 "[ ]" 2
301 1 16 A H5' 1 18 A H1' 5.000 3.500 6.500 5.064 5.064 5.064 . 0 0 "[ ]" 2
302 1 16 A H5'' 1 18 A H1' 5.000 3.500 6.500 5.628 5.628 5.628 . 0 0 "[ ]" 2
303 1 16 A H4' 1 19 A H2' 3.500 2.500 4.700 4.078 4.078 4.078 . 0 0 "[ ]" 2
304 1 16 A H4' 1 19 A H3' 3.500 2.500 4.500 3.300 3.300 3.300 . 0 0 "[ ]" 2
305 1 16 A H5' 1 19 A H2' 3.500 2.500 4.500 2.183 2.183 2.183 0.317 1 0 "[ ]" 2
306 1 16 A H5' 1 19 A H3' 3.500 2.500 4.500 2.718 2.718 2.718 . 0 0 "[ ]" 2
307 1 16 A H5'' 1 19 A H2' 3.500 2.500 4.500 3.588 3.588 3.588 . 0 0 "[ ]" 2
308 1 16 A H5'' 1 19 A H3' 3.500 2.500 4.500 3.812 3.812 3.812 . 0 0 "[ ]" 2
309 1 16 A H1' 1 16 A H8 4.000 3.300 4.700 3.823 3.823 3.823 . 0 0 "[ ]" 2
310 1 16 A H1' 1 18 A H2 5.000 3.500 6.500 4.303 4.303 4.303 . 0 0 "[ ]" 2
311 1 16 A H2' 1 16 A H8 4.000 3.200 4.800 3.176 3.176 3.176 0.024 1 0 "[ ]" 2
312 1 16 A H3' 1 16 A H8 4.000 2.800 5.200 3.659 3.659 3.659 . 0 0 "[ ]" 2
313 1 16 A H4' 1 16 A H8 5.000 4.000 6.000 4.556 4.556 4.556 . 0 0 "[ ]" 2
314 1 16 A H2 1 18 A H2 3.500 2.500 4.500 2.907 2.907 2.907 . 0 0 "[ ]" 2
315 1 19 A H1' 1 19 A H2' 2.500 . 3.200 2.871 2.871 2.871 . 0 0 "[ ]" 2
316 1 19 A H1' 1 19 A H3' 4.300 3.500 5.100 3.858 3.858 3.858 . 0 0 "[ ]" 2
317 1 19 A H1' 1 19 A H4' 3.300 2.500 4.100 3.051 3.051 3.051 . 0 0 "[ ]" 2
318 1 19 A H1' 1 19 A H5' 5.000 4.000 6.000 4.483 4.483 4.483 . 0 0 "[ ]" 2
319 1 19 A H1' 1 19 A H5'' 5.000 4.000 6.000 4.600 4.600 4.600 . 0 0 "[ ]" 2
320 1 19 A H1' 1 20 A H1' 3.500 2.500 4.500 3.108 3.108 3.108 . 0 0 "[ ]" 2
321 1 19 A H2' 1 19 A H3' 2.500 . 3.200 2.192 2.192 2.192 . 0 0 "[ ]" 2
322 1 19 A H2' 1 19 A H4' 3.300 2.600 4.000 3.938 3.938 3.938 . 0 0 "[ ]" 2
323 1 19 A H2' 1 19 A H5' 3.500 . 5.000 3.743 3.743 3.743 . 0 0 "[ ]" 2
324 1 19 A H2' 1 19 A H5'' 3.500 . 5.000 4.869 4.869 4.869 . 0 0 "[ ]" 2
325 1 19 A H3' 1 19 A H4' 2.500 . 3.200 2.986 2.986 2.986 . 0 0 "[ ]" 2
326 1 19 A H3' 1 19 A H5' 3.200 2.200 4.200 2.128 2.128 2.128 0.072 1 0 "[ ]" 2
327 1 19 A H3' 1 19 A H5'' 3.200 2.200 4.200 3.424 3.424 3.424 . 0 0 "[ ]" 2
328 1 19 A H4' 1 19 A H5' 2.500 . 3.200 2.999 2.999 2.999 . 0 0 "[ ]" 2
329 1 19 A H4' 1 19 A H5'' 2.500 . 3.200 2.535 2.535 2.535 . 0 0 "[ ]" 2
330 1 19 A H1' 1 19 A H8 4.300 3.300 5.300 3.265 3.265 3.265 0.035 1 0 "[ ]" 2
331 1 19 A H1' 1 20 A H8 4.500 3.000 6.000 2.732 2.732 2.732 0.268 1 0 "[ ]" 2
332 1 19 A H3' 1 19 A H8 3.500 2.200 4.800 4.124 4.124 4.124 . 0 0 "[ ]" 2
333 1 19 A H2 1 20 A H2 4.500 2.500 6.500 6.110 6.110 6.110 . 0 0 "[ ]" 2
334 1 17 G H1' 1 17 G H2' 2.500 . 3.000 2.898 2.898 2.898 . 0 0 "[ ]" 2
335 1 17 G H1' 1 17 G H3' 4.000 3.000 5.000 4.091 4.091 4.091 . 0 0 "[ ]" 2
336 1 17 G H1' 1 17 G H4' 3.300 2.600 4.000 3.928 3.928 3.928 . 0 0 "[ ]" 2
337 1 17 G H2' 1 17 G H3' 2.500 . 3.200 2.439 2.439 2.439 . 0 0 "[ ]" 2
338 1 17 G H2' 1 17 G H4' 4.000 3.300 4.700 3.956 3.956 3.956 . 0 0 "[ ]" 2
339 1 17 G H3' 1 17 G H4' 2.500 . 3.200 2.599 2.599 2.599 . 0 0 "[ ]" 2
340 1 17 G H3' 1 17 G H5' 3.000 . 4.500 1.965 1.965 1.965 . 0 0 "[ ]" 2
341 1 17 G H3' 1 17 G H5'' 3.000 . 4.500 3.037 3.037 3.037 . 0 0 "[ ]" 2
342 1 17 G H4' 1 17 G H5' 2.500 . 3.200 2.490 2.490 2.490 . 0 0 "[ ]" 2
343 1 17 G H4' 1 17 G H5'' 2.500 . 3.200 2.943 2.943 2.943 . 0 0 "[ ]" 2
344 1 17 G H1' 1 17 G H8 3.000 2.200 3.800 3.621 3.621 3.621 . 0 0 "[ ]" 2
345 1 17 G H2' 1 17 G H8 4.000 3.000 5.000 3.566 3.566 3.566 . 0 0 "[ ]" 2
346 1 17 G H3' 1 17 G H8 4.000 3.000 5.000 4.173 4.173 4.173 . 0 0 "[ ]" 2
347 1 18 A H1' 1 18 A H2' 2.500 . 3.000 2.739 2.739 2.739 . 0 0 "[ ]" 2
348 1 18 A H1' 1 18 A H3' 4.000 3.300 4.700 3.942 3.942 3.942 . 0 0 "[ ]" 2
349 1 18 A H1' 1 18 A H4' 3.300 2.600 4.000 3.685 3.685 3.685 . 0 0 "[ ]" 2
350 1 18 A H2' 1 18 A H3' 2.500 . 3.000 2.303 2.303 2.303 . 0 0 "[ ]" 2
351 1 18 A H2' 1 18 A H4' 4.000 3.200 4.800 4.001 4.001 4.001 . 0 0 "[ ]" 2
352 1 18 A H3' 1 18 A H4' 2.500 . 3.200 2.902 2.902 2.902 . 0 0 "[ ]" 2
353 1 18 A H3' 1 18 A H5' 3.000 . 4.500 2.292 2.292 2.292 . 0 0 "[ ]" 2
354 1 18 A H3' 1 18 A H5'' 3.000 . 4.500 2.199 2.199 2.199 . 0 0 "[ ]" 2
355 1 18 A H1' 1 18 A H8 3.500 2.500 4.500 3.858 3.858 3.858 . 0 0 "[ ]" 2
356 1 18 A H2' 1 18 A H8 3.500 2.200 5.000 2.274 2.274 2.274 . 0 0 "[ ]" 2
357 1 18 A H3' 1 18 A H8 3.500 2.500 5.000 2.337 2.337 2.337 0.163 1 0 "[ ]" 2
358 1 18 A H4' 1 18 A H8 4.000 3.000 5.000 4.650 4.650 4.650 . 0 0 "[ ]" 2
359 1 18 A H5' 1 18 A H8 4.000 3.000 5.500 4.009 4.009 4.009 . 0 0 "[ ]" 2
360 1 18 A H5'' 1 18 A H8 4.000 3.000 5.500 2.826 2.826 2.826 0.174 1 0 "[ ]" 2
361 1 20 A H1' 1 20 A H2' 2.500 . 3.000 2.885 2.885 2.885 . 0 0 "[ ]" 2
362 1 20 A H1' 1 20 A H3' 4.300 3.600 5.000 3.929 3.929 3.929 . 0 0 "[ ]" 2
363 1 20 A H1' 1 20 A H4' 3.500 2.800 4.200 3.059 3.059 3.059 . 0 0 "[ ]" 2
364 1 20 A H2' 1 20 A H3' 2.500 . 3.000 2.275 2.275 2.275 . 0 0 "[ ]" 2
365 1 20 A H2' 1 21 C H1' 4.500 3.000 5.500 3.485 3.485 3.485 . 0 0 "[ ]" 2
366 1 20 A H2' 1 21 C H3' 5.000 4.000 6.000 4.806 4.806 4.806 . 0 0 "[ ]" 2
367 1 20 A H3' 1 20 A H4' 2.500 . 3.200 2.961 2.961 2.961 . 0 0 "[ ]" 2
368 1 20 A H3' 1 20 A H5' 2.800 2.100 3.500 2.900 2.900 2.900 . 0 0 "[ ]" 2
369 1 20 A H3' 1 20 A H5'' 2.800 2.100 3.500 2.148 2.148 2.148 . 0 0 "[ ]" 2
370 1 20 A H4' 1 20 A H5' 2.500 . 3.200 2.309 2.309 2.309 . 0 0 "[ ]" 2
371 1 20 A H4' 1 20 A H5'' 2.500 . 3.200 2.969 2.969 2.969 . 0 0 "[ ]" 2
372 1 19 A H2 1 20 A H1' 4.000 2.500 5.500 4.707 4.707 4.707 . 0 0 "[ ]" 2
373 1 20 A H1' 1 20 A H8 3.500 2.700 4.300 3.821 3.821 3.821 . 0 0 "[ ]" 2
374 1 20 A H1' 1 21 C H6 5.000 4.000 6.000 5.375 5.375 5.375 . 0 0 "[ ]" 2
375 1 20 A H2' 1 21 C H5 4.500 3.500 6.000 3.736 3.736 3.736 . 0 0 "[ ]" 2
376 1 20 A H2' 1 21 C H6 2.500 . 3.000 2.577 2.577 2.577 . 0 0 "[ ]" 2
377 1 20 A H3' 1 20 A H8 3.500 2.500 4.500 3.722 3.722 3.722 . 0 0 "[ ]" 2
378 1 20 A H3' 1 21 C H5 4.500 3.000 6.000 2.962 2.962 2.962 0.038 1 0 "[ ]" 2
379 1 20 A H3' 1 21 C H6 3.700 2.700 4.700 2.810 2.810 2.810 . 0 0 "[ ]" 2
380 1 20 A H5' 1 20 A H8 4.500 3.500 5.500 4.849 4.849 4.849 . 0 0 "[ ]" 2
381 1 20 A H5'' 1 20 A H8 4.500 3.500 5.500 3.371 3.371 3.371 0.129 1 0 "[ ]" 2
382 1 21 C H1' 1 21 C H2' 2.500 . 3.000 2.831 2.831 2.831 . 0 0 "[ ]" 2
383 1 21 C H1' 1 21 C H3' 4.300 3.300 5.300 3.961 3.961 3.961 . 0 0 "[ ]" 2
384 1 21 C H1' 1 21 C H4' 3.300 2.500 4.100 3.439 3.439 3.439 . 0 0 "[ ]" 2
385 1 21 C H2' 1 21 C H3' 2.500 . 3.000 2.254 2.254 2.254 . 0 0 "[ ]" 2
386 1 21 C H2' 1 22 A H1' 4.500 3.500 6.000 3.657 3.657 3.657 . 0 0 "[ ]" 2
387 1 21 C H2' 1 22 A H5' 3.500 2.700 4.300 4.308 4.308 4.308 0.008 1 0 "[ ]" 2
388 1 21 C H2' 1 22 A H5'' 3.500 2.700 4.300 3.256 3.256 3.256 . 0 0 "[ ]" 2
389 1 21 C H3' 1 21 C H5' 3.300 2.300 4.300 3.527 3.527 3.527 . 0 0 "[ ]" 2
390 1 21 C H3' 1 21 C H5'' 3.300 2.300 4.300 2.372 2.372 2.372 . 0 0 "[ ]" 2
391 1 21 C H3' 1 22 A H5' 4.300 3.500 5.100 5.027 5.027 5.027 . 0 0 "[ ]" 2
392 1 21 C H3' 1 22 A H5'' 4.300 3.500 5.100 3.789 3.789 3.789 . 0 0 "[ ]" 2
393 1 21 C H4' 1 21 C H5' 2.500 . 3.000 2.344 2.344 2.344 . 0 0 "[ ]" 2
394 1 21 C H4' 1 21 C H5'' 2.500 . 3.000 2.592 2.592 2.592 . 0 0 "[ ]" 2
395 1 21 C H1' 1 21 C H6 4.000 3.000 5.000 3.700 3.700 3.700 . 0 0 "[ ]" 2
396 1 20 A H2 1 21 C H1' 3.300 2.300 4.300 4.066 4.066 4.066 . 0 0 "[ ]" 2
397 1 21 C H2' 1 21 C H6 3.700 2.700 5.200 3.200 3.200 3.200 . 0 0 "[ ]" 2
398 1 21 C H2' 1 22 A H8 2.500 . 3.300 3.061 3.061 3.061 . 0 0 "[ ]" 2
399 1 21 C H3' 1 21 C H6 2.800 . 3.600 2.829 2.829 2.829 . 0 0 "[ ]" 2
400 1 21 C H3' 1 22 A H8 3.500 2.500 4.500 4.186 4.186 4.186 . 0 0 "[ ]" 2
401 1 21 C H4' 1 21 C H6 5.000 4.000 6.000 4.047 4.047 4.047 . 0 0 "[ ]" 2
402 1 21 C H5' 1 21 C H6 4.500 3.000 6.000 3.637 3.637 3.637 . 0 0 "[ ]" 2
403 1 21 C H5'' 1 21 C H6 4.500 3.000 6.000 3.520 3.520 3.520 . 0 0 "[ ]" 2
404 1 21 C H5 1 22 A H8 3.800 2.800 4.800 4.099 4.099 4.099 . 0 0 "[ ]" 2
405 1 21 C H6 1 22 A H8 3.800 2.800 4.800 4.201 4.201 4.201 . 0 0 "[ ]" 2
406 1 22 A H1' 1 22 A H2' 2.500 . 3.000 2.930 2.930 2.930 . 0 0 "[ ]" 2
407 1 22 A H1' 1 22 A H3' 3.700 3.000 4.400 3.886 3.886 3.886 . 0 0 "[ ]" 2
408 1 22 A H1' 1 22 A H4' 3.300 2.600 4.000 2.846 2.846 2.846 . 0 0 "[ ]" 2
409 1 22 A H2' 1 22 A H3' 2.500 . 3.200 2.245 2.245 2.245 . 0 0 "[ ]" 2
410 1 22 A H2' 1 22 A H4' 4.000 3.300 4.700 3.861 3.861 3.861 . 0 0 "[ ]" 2
411 1 22 A H3' 1 22 A H4' 2.500 . 3.000 3.020 3.020 3.020 0.020 1 0 "[ ]" 2
412 1 22 A H3' 1 22 A H5' 3.300 2.300 4.300 2.645 2.645 2.645 . 0 0 "[ ]" 2
413 1 22 A H3' 1 22 A H5'' 3.300 2.300 4.300 2.464 2.464 2.464 . 0 0 "[ ]" 2
414 1 22 A H4' 1 22 A H5' 2.500 . 3.100 2.516 2.516 2.516 . 0 0 "[ ]" 2
415 1 22 A H4' 1 22 A H5'' 2.500 . 3.100 3.022 3.022 3.022 . 0 0 "[ ]" 2
416 1 22 A H2' 1 23 A H1' 5.000 4.000 6.500 4.096 4.096 4.096 . 0 0 "[ ]" 2
417 1 22 A H2' 1 23 A H3' 5.000 4.000 6.000 5.078 5.078 5.078 . 0 0 "[ ]" 2
418 1 22 A H1' 1 22 A H8 4.500 3.500 5.500 3.787 3.787 3.787 . 0 0 "[ ]" 2
419 1 22 A H1' 1 23 A H8 5.000 4.000 6.000 5.353 5.353 5.353 . 0 0 "[ ]" 2
420 1 22 A H2' 1 23 A H8 3.300 2.300 4.300 2.668 2.668 2.668 . 0 0 "[ ]" 2
421 1 22 A H3' 1 22 A H8 4.300 3.300 5.300 3.841 3.841 3.841 . 0 0 "[ ]" 2
422 1 22 A H3' 1 23 A H8 3.300 2.800 4.300 2.936 2.936 2.936 . 0 0 "[ ]" 2
423 1 22 A H5' 1 22 A H8 4.000 2.500 5.500 5.146 5.146 5.146 . 0 0 "[ ]" 2
424 1 22 A H5' 1 23 A H8 5.000 4.000 6.000 5.281 5.281 5.281 . 0 0 "[ ]" 2
425 1 22 A H5'' 1 22 A H8 4.000 2.500 5.500 3.703 3.703 3.703 . 0 0 "[ ]" 2
426 1 22 A H5'' 1 23 A H8 5.000 4.000 6.000 5.359 5.359 5.359 . 0 0 "[ ]" 2
427 1 23 A H1' 1 23 A H2' 2.500 . 3.000 2.715 2.715 2.715 . 0 0 "[ ]" 2
428 1 23 A H1' 1 23 A H3' 4.300 3.300 5.800 3.829 3.829 3.829 . 0 0 "[ ]" 2
429 1 23 A H1' 1 23 A H4' 3.300 2.300 4.300 3.616 3.616 3.616 . 0 0 "[ ]" 2
430 1 23 A H2' 1 23 A H3' 2.500 . 3.000 2.259 2.259 2.259 . 0 0 "[ ]" 2
431 1 23 A H2' 1 23 A H4' 4.300 3.300 5.300 3.948 3.948 3.948 . 0 0 "[ ]" 2
432 1 23 A H3' 1 23 A H4' 3.300 2.800 4.300 3.002 3.002 3.002 . 0 0 "[ ]" 2
433 1 23 A H3' 1 23 A H5' 3.200 2.200 4.200 3.529 3.529 3.529 . 0 0 "[ ]" 2
434 1 23 A H3' 1 23 A H5'' 3.200 2.200 4.200 2.426 2.426 2.426 . 0 0 "[ ]" 2
435 1 23 A H4' 1 23 A H5' 2.500 . 3.000 2.353 2.353 2.353 . 0 0 "[ ]" 2
436 1 23 A H4' 1 23 A H5'' 2.500 . 3.000 2.609 2.609 2.609 . 0 0 "[ ]" 2
437 1 23 A H2' 1 24 A H1' 4.500 3.000 6.000 4.727 4.727 4.727 . 0 0 "[ ]" 2
438 1 23 A H1' 1 23 A H8 4.300 3.300 5.800 3.828 3.828 3.828 . 0 0 "[ ]" 2
439 1 23 A H1' 1 24 A H8 5.000 4.000 6.500 4.345 4.345 4.345 . 0 0 "[ ]" 2
440 1 22 A H2 1 23 A H1' 4.300 3.800 5.800 4.986 4.986 4.986 . 0 0 "[ ]" 2
441 1 23 A H2' 1 24 A H8 2.500 . 3.000 2.339 2.339 2.339 . 0 0 "[ ]" 2
442 1 23 A H3' 1 24 A H8 3.300 2.300 4.300 4.338 4.338 4.338 0.038 1 0 "[ ]" 2
443 1 24 A H1' 1 24 A H2' 2.500 . 3.000 2.794 2.794 2.794 . 0 0 "[ ]" 2
444 1 24 A H1' 1 24 A H3' 5.000 4.000 6.000 3.903 3.903 3.903 0.097 1 0 "[ ]" 2
445 1 24 A H1' 1 24 A H4' 4.300 3.300 5.300 3.428 3.428 3.428 . 0 0 "[ ]" 2
446 1 24 A H2' 1 24 A H3' 2.500 . 3.000 2.308 2.308 2.308 . 0 0 "[ ]" 2
447 1 24 A H2' 1 24 A H4' 4.500 3.500 5.500 3.945 3.945 3.945 . 0 0 "[ ]" 2
448 1 24 A H2' 1 24 A H5' 4.300 3.300 5.300 4.792 4.792 4.792 . 0 0 "[ ]" 2
449 1 24 A H2' 1 24 A H5'' 4.300 3.300 5.300 4.189 4.189 4.189 . 0 0 "[ ]" 2
450 1 24 A H3' 1 24 A H4' 3.300 . 4.300 3.028 3.028 3.028 . 0 0 "[ ]" 2
451 1 24 A H3' 1 24 A H5' 3.300 . 4.300 2.703 2.703 2.703 . 0 0 "[ ]" 2
452 1 24 A H3' 1 24 A H5'' 3.300 . 4.300 2.281 2.281 2.281 . 0 0 "[ ]" 2
453 1 24 A H4' 1 24 A H5' 2.500 . 3.000 2.521 2.521 2.521 . 0 0 "[ ]" 2
454 1 24 A H4' 1 24 A H5'' 2.500 . 3.000 3.001 3.001 3.001 0.001 1 0 "[ ]" 2
455 1 24 A H1' 1 24 A H8 4.300 2.300 5.300 3.723 3.723 3.723 . 0 0 "[ ]" 2
456 1 24 A H1' 1 25 G H8 4.500 3.000 6.000 5.163 5.163 5.163 . 0 0 "[ ]" 2
457 1 24 A H2' 1 25 G H8 2.500 . 3.500 2.391 2.391 2.391 . 0 0 "[ ]" 2
458 1 24 A H3' 1 24 A H8 4.300 2.800 5.300 3.336 3.336 3.336 . 0 0 "[ ]" 2
459 1 24 A H3' 1 25 G H8 3.300 2.300 4.300 2.804 2.804 2.804 . 0 0 "[ ]" 2
460 1 24 A H4' 1 24 A H8 4.300 3.300 5.800 4.363 4.363 4.363 . 0 0 "[ ]" 2
461 1 24 A H5' 1 24 A H8 3.500 2.500 4.500 4.208 4.208 4.208 . 0 0 "[ ]" 2
462 1 24 A H5'' 1 24 A H8 4.000 2.500 5.500 2.590 2.590 2.590 . 0 0 "[ ]" 2
463 1 25 G H1' 1 25 G H2' 2.500 . 3.000 2.717 2.717 2.717 . 0 0 "[ ]" 2
464 1 25 G H1' 1 25 G H3' 4.300 3.300 5.300 3.846 3.846 3.846 . 0 0 "[ ]" 2
465 1 25 G H1' 1 25 G H4' 3.300 2.300 4.300 3.678 3.678 3.678 . 0 0 "[ ]" 2
466 1 25 G H2' 1 25 G H3' 2.500 . 3.300 2.321 2.321 2.321 . 0 0 "[ ]" 2
467 1 25 G H2' 1 25 G H4' 3.800 3.000 4.600 3.960 3.960 3.960 . 0 0 "[ ]" 2
468 1 25 G H3' 1 25 G H4' 2.500 . 3.300 2.974 2.974 2.974 . 0 0 "[ ]" 2
469 1 25 G H3' 1 25 G H5' 3.200 2.200 4.200 2.916 2.916 2.916 . 0 0 "[ ]" 2
470 1 25 G H3' 1 25 G H5'' 3.200 2.200 4.200 2.122 2.122 2.122 0.078 1 0 "[ ]" 2
471 1 25 G H4' 1 25 G H5' 2.500 . 3.300 2.321 2.321 2.321 . 0 0 "[ ]" 2
472 1 25 G H4' 1 25 G H5'' 2.500 . 3.300 3.039 3.039 3.039 . 0 0 "[ ]" 2
473 1 25 G H2' 1 26 U H1' 4.500 2.500 6.000 3.119 3.119 3.119 . 0 0 "[ ]" 2
474 1 24 A H2 1 25 G H1' 4.000 2.500 5.500 4.646 4.646 4.646 . 0 0 "[ ]" 2
475 1 25 G H1' 1 26 U H6 5.000 4.000 6.000 5.267 5.267 5.267 . 0 0 "[ ]" 2
476 1 25 G H2' 1 26 U H5 3.300 2.300 4.300 4.340 4.340 4.340 0.040 1 0 "[ ]" 2
477 1 25 G H2' 1 26 U H6 2.500 . 3.500 2.828 2.828 2.828 . 0 0 "[ ]" 2
478 1 25 G H3' 1 25 G H8 3.300 2.300 4.300 3.331 3.331 3.331 . 0 0 "[ ]" 2
479 1 25 G H3' 1 26 U H5 4.300 2.800 5.300 3.557 3.557 3.557 . 0 0 "[ ]" 2
480 1 25 G H3' 1 26 U H6 3.300 2.300 4.300 2.392 2.392 2.392 . 0 0 "[ ]" 2
481 1 26 U H1' 1 26 U H2' 2.500 . 3.000 2.774 2.774 2.774 . 0 0 "[ ]" 2
482 1 26 U H1' 1 26 U H3' 4.300 3.300 5.300 3.936 3.936 3.936 . 0 0 "[ ]" 2
483 1 26 U H1' 1 26 U H4' 3.300 2.500 4.100 3.365 3.365 3.365 . 0 0 "[ ]" 2
484 1 26 U H2' 1 26 U H4' 3.300 2.300 4.300 3.850 3.850 3.850 . 0 0 "[ ]" 2
485 1 26 U H2' 1 26 U H3' 2.500 . 3.200 2.342 2.342 2.342 . 0 0 "[ ]" 2
486 1 26 U H3' 1 26 U H4' 2.500 . 3.000 2.955 2.955 2.955 . 0 0 "[ ]" 2
487 1 26 U H3' 1 26 U H5' 3.300 2.300 4.300 2.942 2.942 2.942 . 0 0 "[ ]" 2
488 1 26 U H3' 1 26 U H5'' 3.300 2.300 4.300 2.403 2.403 2.403 . 0 0 "[ ]" 2
489 1 26 U H4' 1 26 U H5' 2.500 . 3.200 2.358 2.358 2.358 . 0 0 "[ ]" 2
490 1 26 U H4' 1 26 U H5'' 2.500 . 3.200 2.998 2.998 2.998 . 0 0 "[ ]" 2
491 1 26 U H2' 1 27 C H1' 3.300 2.300 4.300 3.074 3.074 3.074 . 0 0 "[ ]" 2
492 1 26 U H1' 1 26 U H6 3.800 2.800 4.800 3.392 3.392 3.392 . 0 0 "[ ]" 2
493 1 26 U H2' 1 26 U H6 4.000 3.000 5.000 4.088 4.088 4.088 . 0 0 "[ ]" 2
494 1 26 U H2' 1 27 C H6 3.000 2.200 4.000 3.516 3.516 3.516 . 0 0 "[ ]" 2
495 1 26 U H3' 1 26 U H5 4.300 3.300 5.300 5.451 5.451 5.451 0.151 1 0 "[ ]" 2
496 1 26 U H3' 1 26 U H6 3.200 2.200 4.200 3.715 3.715 3.715 . 0 0 "[ ]" 2
497 1 26 U H3' 1 27 C H5 3.500 2.500 5.000 4.777 4.777 4.777 . 0 0 "[ ]" 2
498 1 26 U H3' 1 27 C H6 3.300 2.200 4.100 2.814 2.814 2.814 . 0 0 "[ ]" 2
499 1 26 U H4' 1 26 U H6 4.300 3.300 5.300 4.138 4.138 4.138 . 0 0 "[ ]" 2
500 1 26 U H5' 1 26 U H6 4.000 2.700 5.300 4.311 4.311 4.311 . 0 0 "[ ]" 2
501 1 26 U H5'' 1 26 U H6 4.000 2.700 5.300 2.876 2.876 2.876 . 0 0 "[ ]" 2
502 1 27 C H1' 1 27 C H2' 2.500 . 3.000 2.818 2.818 2.818 . 0 0 "[ ]" 2
503 1 27 C H1' 1 27 C H3' 4.300 3.300 5.300 3.856 3.856 3.856 . 0 0 "[ ]" 2
504 1 27 C H1' 1 27 C H4' 3.300 2.300 4.500 3.146 3.146 3.146 . 0 0 "[ ]" 2
505 1 27 C H2' 1 27 C H3' 2.500 . 3.000 2.294 2.294 2.294 . 0 0 "[ ]" 2
506 1 27 C H2' 1 27 C H5'' 4.300 3.300 5.300 4.304 4.304 4.304 . 0 0 "[ ]" 2
507 1 27 C H3' 1 27 C H4' 3.300 2.300 4.300 2.998 2.998 2.998 . 0 0 "[ ]" 2
508 1 27 C H3' 1 27 C H5'' 3.300 2.300 4.300 2.318 2.318 2.318 . 0 0 "[ ]" 2
509 1 27 C H4' 1 27 C H5' 2.500 . 3.500 2.378 2.378 2.378 . 0 0 "[ ]" 2
510 1 27 C H4' 1 27 C H5'' 2.500 . 3.500 3.017 3.017 3.017 . 0 0 "[ ]" 2
511 1 27 C H1' 1 27 C H6 3.300 2.300 4.300 3.549 3.549 3.549 . 0 0 "[ ]" 2
512 1 27 C H2' 1 27 C H6 3.300 2.300 4.300 3.808 3.808 3.808 . 0 0 "[ ]" 2
513 1 27 C H4' 1 27 C H6 4.300 3.300 5.300 4.317 4.317 4.317 . 0 0 "[ ]" 2
514 1 27 C H5'' 1 27 C H6 4.300 3.300 5.300 3.010 3.010 3.010 0.290 1 0 "[ ]" 2
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