NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
644510 |
6ccw   |
30402 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ccw
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 567
_Distance_constraint_stats_list.Viol_count 890
_Distance_constraint_stats_list.Viol_total 1602.562
_Distance_constraint_stats_list.Viol_max 1.140
_Distance_constraint_stats_list.Viol_rms 0.0702
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0126
_Distance_constraint_stats_list.Viol_average_violations_only 0.1200
_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 DT 1.921 0.631 13 1 "[ . 1 + .]"
1 2 DT 17.712 0.743 9 7 "[ ** .* *+-* .]"
1 3 DA 12.550 0.743 9 7 "[ ** .* *+-* .]"
1 4 DG 0.455 0.082 4 0 "[ . 1 .]"
1 5 DG 0.918 0.156 15 0 "[ . 1 .]"
1 6 DG 16.107 0.704 12 8 "[***** * 1-+ .]"
1 7 DT 6.939 0.713 6 5 "[ * *+ * 1 -]"
1 8 DT 20.259 0.713 6 11 "[*****+** 1-* *]"
1 9 DA 0.443 0.075 2 0 "[ . 1 .]"
1 10 DG 1.131 0.169 13 0 "[ . 1 .]"
1 11 DG 0.837 0.169 13 0 "[ . 1 .]"
1 12 DG 2.964 0.403 10 0 "[ . 1 .]"
1 13 DT 13.925 0.878 15 6 "[ ** * - 1 * +]"
1 14 DT 15.500 0.878 15 9 "[ ** * *-*** +]"
1 15 DA 0.243 0.040 6 0 "[ . 1 .]"
1 16 DG 2.987 0.559 1 1 "[+ . 1 .]"
1 17 DG 5.161 0.559 1 1 "[+ . 1 .]"
1 18 DG 2.341 0.171 1 0 "[ . 1 .]"
1 19 DT 12.534 1.140 12 8 "[ .* *** +**-]"
1 20 DT 13.139 1.140 12 8 "[ .* *** +**-]"
1 21 DA 1.483 0.095 11 0 "[ . 1 .]"
1 22 DG 0.512 0.063 5 0 "[ . 1 .]"
1 23 DG 0.499 0.061 4 0 "[ . 1 .]"
1 24 DG 5.634 0.515 3 2 "[ + . - 1 .]"
1 25 DT 15.902 0.607 3 3 "[ + . *- 1 .]"
1 26 DT 10.723 0.607 3 2 "[ + . * 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 DT H1' 1 1 DT H2' 3.290 2.630 3.950 3.040 2.983 3.075 . 0 0 "[ . 1 .]" 1
2 1 1 DT H1' 1 1 DT H2'' 2.300 . 2.760 2.391 2.359 2.453 . 0 0 "[ . 1 .]" 1
3 1 1 DT H1' 1 1 DT H6 2.560 2.040 3.080 2.304 2.264 2.396 . 0 0 "[ . 1 .]" 1
4 1 1 DT H1' 1 1 DT M7 5.080 4.060 6.100 4.258 4.235 4.300 . 0 0 "[ . 1 .]" 1
5 1 1 DT H1' 1 2 DT H6 5.000 4.000 6.000 5.275 4.659 5.893 . 0 0 "[ . 1 .]" 1
6 1 1 DT H2' 1 1 DT H2'' 1.960 . 2.350 1.752 1.731 1.758 . 0 0 "[ . 1 .]" 1
7 1 1 DT H2' 1 1 DT H6 3.950 3.160 4.740 4.277 3.992 4.650 . 0 0 "[ . 1 .]" 1
8 1 1 DT H2' 1 2 DT H6 4.000 3.000 5.000 4.366 3.912 5.088 0.088 1 0 "[ . 1 .]" 1
9 1 1 DT H2' 1 2 DT M7 4.500 3.000 6.000 3.980 3.250 4.519 . 0 0 "[ . 1 .]" 1
10 1 1 DT H2'' 1 1 DT H6 4.370 3.500 5.240 3.863 3.490 4.475 0.010 13 0 "[ . 1 .]" 1
11 1 1 DT H2'' 1 2 DT H6 3.500 2.500 4.500 3.250 2.945 3.625 . 0 0 "[ . 1 .]" 1
12 1 1 DT H2'' 1 2 DT M7 4.800 3.360 6.240 3.725 3.267 4.308 0.093 9 0 "[ . 1 .]" 1
13 1 1 DT H4' 1 1 DT H6 5.010 4.010 6.010 5.357 4.856 5.633 . 0 0 "[ . 1 .]" 1
14 1 1 DT Q5' 1 1 DT H6 6.000 4.800 7.200 5.568 4.667 6.051 0.133 1 0 "[ . 1 .]" 1
15 1 1 DT H6 1 1 DT M7 3.000 2.400 3.600 2.371 2.370 2.373 0.030 15 0 "[ . 1 .]" 1
16 1 1 DT H6 1 2 DT H6 6.000 5.000 7.000 6.534 5.941 7.007 0.007 13 0 "[ . 1 .]" 1
17 1 1 DT H6 1 2 DT M7 6.900 4.900 8.900 6.902 6.395 7.373 . 0 0 "[ . 1 .]" 1
18 1 1 DT M7 1 13 DT M7 5.500 4.000 7.000 4.380 3.369 4.737 0.631 13 1 "[ . 1 + .]" 1
19 1 2 DT H1' 1 2 DT H2' 2.960 2.370 3.550 2.849 2.774 2.926 . 0 0 "[ . 1 .]" 1
20 1 2 DT H1' 1 2 DT H2'' 2.450 . 2.940 2.335 2.310 2.359 . 0 0 "[ . 1 .]" 1
21 1 2 DT H1' 1 2 DT H4' 3.530 2.820 4.240 3.495 3.219 3.748 . 0 0 "[ . 1 .]" 1
22 1 2 DT H1' 1 2 DT H6 3.650 2.920 4.380 3.719 3.674 3.740 . 0 0 "[ . 1 .]" 1
23 1 2 DT H1' 1 2 DT M7 5.540 4.430 6.650 5.158 5.123 5.171 . 0 0 "[ . 1 .]" 1
24 1 2 DT H1' 1 3 DA H2 5.800 3.800 7.800 5.777 5.052 7.437 . 0 0 "[ . 1 .]" 1
25 1 2 DT H1' 1 3 DA H8 5.710 4.210 7.210 6.296 5.470 7.005 . 0 0 "[ . 1 .]" 1
26 1 2 DT H2' 1 2 DT H6 2.440 . 2.930 2.460 1.897 2.838 0.053 4 0 "[ . 1 .]" 1
27 1 2 DT H2' 1 2 DT M7 5.230 4.180 6.280 4.028 3.721 4.250 0.459 4 0 "[ . 1 .]" 1
28 1 2 DT H2' 1 3 DA H2 5.800 3.800 7.800 5.006 4.205 6.229 . 0 0 "[ . 1 .]" 1
29 1 2 DT H2' 1 3 DA H8 3.100 2.100 4.100 3.691 2.903 4.145 0.045 14 0 "[ . 1 .]" 1
30 1 2 DT H2'' 1 2 DT H6 3.890 3.120 4.660 3.838 3.511 4.080 . 0 0 "[ . 1 .]" 1
31 1 2 DT H2'' 1 2 DT M7 5.430 4.340 6.520 5.389 5.131 5.520 . 0 0 "[ . 1 .]" 1
32 1 2 DT H2'' 1 3 DA H2 6.000 4.000 8.000 5.786 4.656 7.593 . 0 0 "[ . 1 .]" 1
33 1 2 DT H2'' 1 3 DA H8 4.000 2.800 5.200 4.374 3.377 5.324 0.124 7 0 "[ . 1 .]" 1
34 1 2 DT H3' 1 2 DT H6 2.490 . 2.990 2.558 1.821 3.179 0.189 12 0 "[ . 1 .]" 1
35 1 2 DT H4' 1 2 DT H6 4.180 3.360 5.000 4.243 4.020 4.465 . 0 0 "[ . 1 .]" 1
36 1 2 DT H5' 1 2 DT H6 4.400 3.520 5.280 4.244 3.400 4.629 0.120 2 0 "[ . 1 .]" 1
37 1 2 DT H5'' 1 2 DT H6 2.600 2.080 3.120 3.022 2.022 3.436 0.316 9 0 "[ . 1 .]" 1
38 1 2 DT H6 1 2 DT M7 3.020 2.420 3.620 2.373 2.367 2.380 0.053 1 0 "[ . 1 .]" 1
39 1 2 DT H6 1 3 DA H61 4.500 3.500 5.500 4.755 4.095 5.493 . 0 0 "[ . 1 .]" 1
40 1 2 DT H6 1 3 DA H8 4.100 3.100 5.100 5.039 4.818 5.135 0.035 13 0 "[ . 1 .]" 1
41 1 2 DT M7 1 3 DA H2 7.000 5.000 9.000 5.097 4.437 5.626 0.563 11 1 "[ . 1+ .]" 1
42 1 2 DT M7 1 3 DA H61 4.200 3.200 5.200 2.812 2.457 3.181 0.743 9 6 "[ ** .* *+- .]" 1
43 1 2 DT M7 1 3 DA H62 4.120 3.120 5.120 2.992 2.671 3.436 0.449 10 0 "[ . 1 .]" 1
44 1 2 DT M7 1 3 DA H8 6.000 5.000 7.000 5.286 4.592 5.682 0.408 7 0 "[ . 1 .]" 1
45 1 3 DA H1' 1 3 DA H2 4.400 3.520 5.280 4.472 4.444 4.526 . 0 0 "[ . 1 .]" 1
46 1 3 DA H1' 1 3 DA H2' 3.130 2.500 3.760 2.996 2.958 3.040 . 0 0 "[ . 1 .]" 1
47 1 3 DA H1' 1 3 DA H2'' 2.400 . 2.880 2.371 2.356 2.414 . 0 0 "[ . 1 .]" 1
48 1 3 DA H1' 1 3 DA H8 3.870 3.100 4.640 3.876 3.852 3.889 . 0 0 "[ . 1 .]" 1
49 1 3 DA H1' 1 4 DG H1 5.200 3.700 6.700 6.096 5.391 6.682 . 0 0 "[ . 1 .]" 1
50 1 3 DA H1' 1 4 DG H22 4.300 3.100 5.500 4.774 3.843 5.582 0.082 4 0 "[ . 1 .]" 1
51 1 3 DA H2 1 3 DA H2' 5.940 4.750 7.130 6.397 5.938 6.806 . 0 0 "[ . 1 .]" 1
52 1 3 DA H2 1 4 DG H1 3.900 3.300 4.500 3.571 3.284 4.512 0.016 13 0 "[ . 1 .]" 1
53 1 3 DA H2 1 12 DG H1 4.800 3.800 5.800 5.007 4.571 5.818 0.018 5 0 "[ . 1 .]" 1
54 1 3 DA H2 1 13 DT M7 6.000 4.000 8.000 5.286 3.932 5.761 0.068 5 0 "[ . 1 .]" 1
55 1 3 DA H2 1 22 DG H1 6.500 5.200 7.800 6.204 5.821 6.973 . 0 0 "[ . 1 .]" 1
56 1 3 DA H2' 1 3 DA H8 2.350 . 2.820 2.629 2.274 2.954 0.134 1 0 "[ . 1 .]" 1
57 1 3 DA H2'' 1 3 DA H8 3.850 3.080 4.620 4.096 3.741 4.384 . 0 0 "[ . 1 .]" 1
58 1 3 DA H2'' 1 4 DG H1 5.500 4.000 7.000 6.262 5.533 6.760 . 0 0 "[ . 1 .]" 1
59 1 3 DA H2'' 1 4 DG H22 4.000 2.800 5.200 3.708 2.803 4.284 . 0 0 "[ . 1 .]" 1
60 1 3 DA H8 1 22 DG H8 4.000 2.800 5.200 5.143 4.791 5.214 0.014 13 0 "[ . 1 .]" 1
61 1 4 DG H1 1 4 DG H21 2.300 . 2.760 2.219 2.215 2.223 . 0 0 "[ . 1 .]" 1
62 1 4 DG H1 1 4 DG H22 3.580 2.870 4.290 3.486 3.484 3.491 . 0 0 "[ . 1 .]" 1
63 1 4 DG H1 1 5 DG H8 5.500 4.120 6.880 6.818 6.555 6.898 0.018 4 0 "[ . 1 .]" 1
64 1 4 DG H1 1 22 DG H8 5.360 4.290 6.430 5.075 4.670 5.398 . 0 0 "[ . 1 .]" 1
65 1 4 DG H1 1 23 DG H1 3.600 2.880 4.340 4.046 3.765 4.326 . 0 0 "[ . 1 .]" 1
66 1 4 DG H1' 1 4 DG H2' 3.210 2.570 3.850 3.048 3.009 3.066 . 0 0 "[ . 1 .]" 1
67 1 4 DG H1' 1 4 DG H2'' 2.080 . 2.500 2.404 2.378 2.424 . 0 0 "[ . 1 .]" 1
68 1 4 DG H1' 1 4 DG H3' 3.580 2.860 4.300 3.864 3.799 3.938 . 0 0 "[ . 1 .]" 1
69 1 4 DG H1' 1 4 DG H4' 3.620 2.900 4.340 3.253 2.961 3.494 . 0 0 "[ . 1 .]" 1
70 1 4 DG H1' 1 4 DG H8 2.620 2.100 3.140 2.558 2.549 2.589 . 0 0 "[ . 1 .]" 1
71 1 4 DG H1' 1 5 DG H3' 4.900 3.920 5.880 5.107 4.441 5.421 . 0 0 "[ . 1 .]" 1
72 1 4 DG H1' 1 5 DG H5' 2.700 2.100 3.300 2.275 2.077 3.141 0.023 15 0 "[ . 1 .]" 1
73 1 4 DG H1' 1 5 DG H5'' 3.300 2.640 3.960 3.925 3.723 3.991 0.031 9 0 "[ . 1 .]" 1
74 1 4 DG H1' 1 5 DG H8 4.170 3.340 5.000 4.255 4.023 4.447 . 0 0 "[ . 1 .]" 1
75 1 4 DG H2' 1 4 DG H3' 2.390 . 2.870 2.378 2.326 2.406 . 0 0 "[ . 1 .]" 1
76 1 4 DG H2' 1 4 DG H8 4.380 3.540 5.220 4.405 4.160 4.573 . 0 0 "[ . 1 .]" 1
77 1 4 DG H2' 1 5 DG H8 2.750 2.200 3.300 2.731 2.187 3.293 0.013 12 0 "[ . 1 .]" 1
78 1 4 DG H2'' 1 4 DG H3' 3.080 2.460 3.700 2.733 2.688 2.847 . 0 0 "[ . 1 .]" 1
79 1 4 DG H2'' 1 4 DG H8 4.280 3.430 5.130 4.030 3.791 4.236 . 0 0 "[ . 1 .]" 1
80 1 4 DG H2'' 1 5 DG H8 2.340 . 2.810 2.233 2.144 2.328 . 0 0 "[ . 1 .]" 1
81 1 4 DG H21 1 22 DG H8 3.180 2.540 3.820 3.045 2.730 3.332 . 0 0 "[ . 1 .]" 1
82 1 4 DG H3' 1 4 DG H4' 2.680 2.140 3.220 2.753 2.671 2.893 . 0 0 "[ . 1 .]" 1
83 1 4 DG H3' 1 4 DG H5' 2.600 2.080 3.120 2.389 2.114 2.682 . 0 0 "[ . 1 .]" 1
84 1 4 DG H3' 1 4 DG H5'' 2.620 2.100 3.140 2.867 2.482 3.156 0.016 12 0 "[ . 1 .]" 1
85 1 4 DG H3' 1 4 DG H8 5.500 4.400 6.600 6.065 5.959 6.136 . 0 0 "[ . 1 .]" 1
86 1 4 DG H3' 1 5 DG H8 4.500 3.600 5.400 4.260 3.723 4.782 . 0 0 "[ . 1 .]" 1
87 1 4 DG H4' 1 4 DG H8 5.530 4.420 6.640 5.618 5.377 5.810 . 0 0 "[ . 1 .]" 1
88 1 4 DG H5' 1 4 DG H8 6.040 4.830 7.250 6.997 6.737 7.172 . 0 0 "[ . 1 .]" 1
89 1 4 DG H5'' 1 4 DG H8 5.800 4.640 6.960 5.969 5.531 6.243 . 0 0 "[ . 1 .]" 1
90 1 4 DG H8 1 5 DG H1' 4.020 3.220 4.820 3.880 3.430 4.450 . 0 0 "[ . 1 .]" 1
91 1 4 DG H8 1 5 DG H3' 5.110 4.090 6.130 6.044 5.756 6.166 0.036 9 0 "[ . 1 .]" 1
92 1 4 DG H8 1 5 DG H4' 4.100 3.280 4.920 4.296 3.998 4.570 . 0 0 "[ . 1 .]" 1
93 1 4 DG H8 1 5 DG H5' 3.730 2.980 4.480 3.816 3.369 4.051 . 0 0 "[ . 1 .]" 1
94 1 4 DG H8 1 5 DG H5'' 4.800 3.800 5.800 5.339 5.010 5.566 . 0 0 "[ . 1 .]" 1
95 1 4 DG H8 1 5 DG H8 4.300 3.440 5.160 4.865 4.668 5.087 . 0 0 "[ . 1 .]" 1
96 1 4 DG H8 1 12 DG H1 5.340 4.270 6.410 5.200 4.920 5.461 . 0 0 "[ . 1 .]" 1
97 1 5 DG H1 1 5 DG H21 2.300 . 2.760 2.218 2.217 2.220 . 0 0 "[ . 1 .]" 1
98 1 5 DG H1 1 6 DG H1 3.600 2.940 4.260 3.990 3.760 4.265 0.005 4 0 "[ . 1 .]" 1
99 1 5 DG H1 1 11 DG H8 5.370 4.300 6.440 5.134 4.711 5.504 . 0 0 "[ . 1 .]" 1
100 1 5 DG H1 1 12 DG H1 3.620 2.900 4.340 3.739 3.316 4.161 . 0 0 "[ . 1 .]" 1
101 1 5 DG H1 1 23 DG H1 3.980 2.990 4.970 4.302 4.211 4.431 . 0 0 "[ . 1 .]" 1
102 1 5 DG H1' 1 5 DG H2' 3.100 2.480 3.720 2.983 2.928 3.051 . 0 0 "[ . 1 .]" 1
103 1 5 DG H1' 1 5 DG H2'' 2.280 . 2.740 2.365 2.339 2.423 . 0 0 "[ . 1 .]" 1
104 1 5 DG H1' 1 5 DG H3' 3.730 2.980 4.480 3.941 3.853 3.969 . 0 0 "[ . 1 .]" 1
105 1 5 DG H1' 1 5 DG H4' 3.270 2.620 3.920 2.941 2.781 3.062 . 0 0 "[ . 1 .]" 1
106 1 5 DG H1' 1 5 DG H8 3.790 3.030 4.550 3.876 3.847 3.890 . 0 0 "[ . 1 .]" 1
107 1 5 DG H1' 1 6 DG H8 4.150 3.320 4.980 4.306 3.952 4.683 . 0 0 "[ . 1 .]" 1
108 1 5 DG H2' 1 5 DG H8 2.770 2.220 3.320 2.664 2.247 3.093 . 0 0 "[ . 1 .]" 1
109 1 5 DG H2' 1 6 DG H8 2.980 2.380 3.580 2.775 2.375 3.380 0.005 5 0 "[ . 1 .]" 1
110 1 5 DG H2'' 1 5 DG H3' 3.190 2.550 3.830 2.897 2.743 2.970 . 0 0 "[ . 1 .]" 1
111 1 5 DG H2'' 1 5 DG H8 3.800 3.040 4.560 4.129 3.783 4.437 . 0 0 "[ . 1 .]" 1
112 1 5 DG H2'' 1 6 DG H8 2.320 . 2.780 2.457 2.172 2.679 . 0 0 "[ . 1 .]" 1
113 1 5 DG H2'' 1 24 DG H1 5.680 4.310 7.050 6.767 6.178 7.075 0.025 14 0 "[ . 1 .]" 1
114 1 5 DG H21 1 11 DG H8 3.190 2.570 3.810 3.135 2.832 3.450 . 0 0 "[ . 1 .]" 1
115 1 5 DG H3' 1 5 DG H4' 2.590 2.070 3.110 2.928 2.794 2.978 . 0 0 "[ . 1 .]" 1
116 1 5 DG H3' 1 5 DG H8 4.040 3.230 4.850 3.790 3.369 4.363 . 0 0 "[ . 1 .]" 1
117 1 5 DG H3' 1 6 DG H8 4.580 3.660 5.500 4.499 3.845 5.207 . 0 0 "[ . 1 .]" 1
118 1 5 DG H4' 1 5 DG H5' 2.350 . 2.820 2.512 2.308 2.596 . 0 0 "[ . 1 .]" 1
119 1 5 DG H4' 1 5 DG H5'' 2.620 2.100 3.140 2.348 2.278 2.566 . 0 0 "[ . 1 .]" 1
120 1 5 DG H4' 1 5 DG H8 4.800 3.840 5.760 4.881 4.711 5.115 . 0 0 "[ . 1 .]" 1
121 1 5 DG H4' 1 6 DG H8 4.900 3.920 5.880 5.861 5.590 6.036 0.156 15 0 "[ . 1 .]" 1
122 1 5 DG H5' 1 5 DG H8 4.800 3.840 5.760 4.533 4.179 5.571 . 0 0 "[ . 1 .]" 1
123 1 5 DG H5'' 1 5 DG H8 5.000 4.000 6.000 5.222 4.975 5.570 . 0 0 "[ . 1 .]" 1
124 1 5 DG H8 1 6 DG H8 4.540 3.630 5.450 4.965 4.349 5.350 . 0 0 "[ . 1 .]" 1
125 1 5 DG H8 1 23 DG H1 5.430 4.340 6.520 4.949 4.545 5.282 . 0 0 "[ . 1 .]" 1
126 1 5 DG H8 1 23 DG H21 3.030 2.420 3.640 3.047 2.672 3.361 . 0 0 "[ . 1 .]" 1
127 1 5 DG H8 1 24 DG H1 5.390 4.310 6.350 5.418 4.882 5.723 . 0 0 "[ . 1 .]" 1
128 1 6 DG H1 1 8 DT H1' 4.500 3.150 5.850 4.519 3.149 5.302 0.001 13 0 "[ . 1 .]" 1
129 1 6 DG H1 1 9 DA H8 5.500 4.250 6.750 4.594 4.247 5.178 0.003 2 0 "[ . 1 .]" 1
130 1 6 DG H1 1 10 DG H8 5.420 4.340 6.500 4.636 4.318 5.162 0.022 8 0 "[ . 1 .]" 1
131 1 6 DG H1 1 11 DG H8 5.350 4.280 6.300 5.980 5.393 6.317 0.017 15 0 "[ . 1 .]" 1
132 1 6 DG H1 1 24 DG H1 4.680 3.510 5.850 4.162 4.013 4.328 . 0 0 "[ . 1 .]" 1
133 1 6 DG H1' 1 6 DG H2' 3.000 2.400 3.600 3.014 2.858 3.062 . 0 0 "[ . 1 .]" 1
134 1 6 DG H1' 1 6 DG H2'' 2.630 2.100 3.160 2.386 2.329 2.423 . 0 0 "[ . 1 .]" 1
135 1 6 DG H1' 1 6 DG H3' 3.840 3.070 4.610 3.895 3.817 3.984 . 0 0 "[ . 1 .]" 1
136 1 6 DG H1' 1 6 DG H4' 3.420 2.740 4.100 3.124 2.888 3.547 . 0 0 "[ . 1 .]" 1
137 1 6 DG H1' 1 6 DG Q5' 4.300 3.440 5.160 4.179 3.966 4.323 . 0 0 "[ . 1 .]" 1
138 1 6 DG H1' 1 6 DG H8 3.820 3.060 4.580 3.848 3.587 3.890 . 0 0 "[ . 1 .]" 1
139 1 6 DG H1' 1 8 DT H6 5.000 3.500 6.500 5.151 4.425 6.515 0.015 15 0 "[ . 1 .]" 1
140 1 6 DG H1' 1 8 DT M7 5.700 4.700 6.700 4.528 4.098 5.306 0.602 2 2 "[ + . - 1 .]" 1
141 1 6 DG H2' 1 6 DG H3' 2.430 . 2.920 2.360 2.319 2.397 . 0 0 "[ . 1 .]" 1
142 1 6 DG H2' 1 6 DG H8 3.080 2.460 3.700 2.841 2.414 3.794 0.094 15 0 "[ . 1 .]" 1
143 1 6 DG H2' 1 8 DT H6 4.800 3.800 5.800 4.181 3.757 4.831 0.043 10 0 "[ . 1 .]" 1
144 1 6 DG H2' 1 8 DT M7 4.300 2.980 5.620 2.828 2.276 4.203 0.704 12 3 "[ * 1-+ .]" 1
145 1 6 DG H2'' 1 6 DG H3' 3.040 2.430 3.650 2.807 2.699 3.012 . 0 0 "[ . 1 .]" 1
146 1 6 DG H2'' 1 6 DG H8 4.470 3.580 5.360 4.183 3.797 4.812 . 0 0 "[ . 1 .]" 1
147 1 6 DG H2'' 1 8 DT M7 3.800 2.660 4.940 2.578 2.102 3.683 0.558 11 4 "[- **. 1+ .]" 1
148 1 6 DG H3' 1 6 DG H4' 2.600 2.080 3.120 2.833 2.677 2.986 . 0 0 "[ . 1 .]" 1
149 1 6 DG H3' 1 6 DG Q5' 2.650 2.120 3.180 2.203 2.099 2.345 0.021 4 0 "[ . 1 .]" 1
150 1 6 DG H3' 1 6 DG H8 4.080 3.260 4.900 4.238 3.225 4.936 0.036 15 0 "[ . 1 .]" 1
151 1 6 DG H3' 1 8 DT H6 5.300 4.300 6.300 5.579 5.105 6.173 . 0 0 "[ . 1 .]" 1
152 1 6 DG H3' 1 8 DT M7 4.000 2.800 5.200 3.216 2.610 3.637 0.190 12 0 "[ . 1 .]" 1
153 1 6 DG H4' 1 6 DG H8 4.780 3.820 5.740 4.808 4.531 5.043 . 0 0 "[ . 1 .]" 1
154 1 6 DG Q5' 1 6 DG H8 3.800 3.040 4.560 3.460 2.393 4.104 0.647 2 2 "[ + . - 1 .]" 1
155 1 6 DG H8 1 8 DT M7 6.000 4.500 7.500 4.984 4.145 6.203 0.355 12 0 "[ . 1 .]" 1
156 1 6 DG H8 1 24 DG H1 5.440 4.350 6.530 5.460 5.206 5.723 . 0 0 "[ . 1 .]" 1
157 1 7 DT H1' 1 7 DT H2' 2.870 2.300 3.620 2.929 2.773 3.037 . 0 0 "[ . 1 .]" 1
158 1 7 DT H1' 1 7 DT H2'' 2.380 . 2.850 2.363 2.336 2.394 . 0 0 "[ . 1 .]" 1
159 1 7 DT H1' 1 7 DT H3' 4.100 3.280 4.920 3.918 3.879 3.960 . 0 0 "[ . 1 .]" 1
160 1 7 DT H1' 1 7 DT H4' 3.230 2.580 3.880 3.377 2.935 3.645 . 0 0 "[ . 1 .]" 1
161 1 7 DT H1' 1 7 DT H6 4.300 3.440 5.160 3.624 3.479 3.677 . 0 0 "[ . 1 .]" 1
162 1 7 DT H1' 1 8 DT H6 5.500 3.850 7.150 6.733 5.873 7.168 0.018 14 0 "[ . 1 .]" 1
163 1 7 DT H1' 1 8 DT M7 5.500 3.850 7.150 5.267 4.456 5.877 . 0 0 "[ . 1 .]" 1
164 1 7 DT H2' 1 7 DT H3' 2.600 2.080 3.120 2.372 2.340 2.391 . 0 0 "[ . 1 .]" 1
165 1 7 DT H2' 1 7 DT H6 3.700 2.960 4.440 3.258 2.910 4.031 0.050 8 0 "[ . 1 .]" 1
166 1 7 DT H2' 1 8 DT H6 6.000 4.500 7.500 6.472 5.987 7.262 . 0 0 "[ . 1 .]" 1
167 1 7 DT H2'' 1 7 DT H3' 3.110 2.490 3.730 2.875 2.713 3.047 . 0 0 "[ . 1 .]" 1
168 1 7 DT H2'' 1 7 DT H6 3.950 3.160 4.740 4.326 4.210 4.614 . 0 0 "[ . 1 .]" 1
169 1 7 DT H2'' 1 8 DT H6 6.000 4.500 7.500 6.063 5.082 6.868 . 0 0 "[ . 1 .]" 1
170 1 7 DT H3' 1 7 DT H4' 3.190 2.550 3.830 2.850 2.655 2.998 . 0 0 "[ . 1 .]" 1
171 1 7 DT H3' 1 7 DT H5' 2.900 2.320 3.480 2.761 2.284 3.301 0.036 2 0 "[ . 1 .]" 1
172 1 7 DT H3' 1 7 DT H5'' 2.500 . 3.000 2.539 2.129 2.943 . 0 0 "[ . 1 .]" 1
173 1 7 DT H3' 1 7 DT H6 3.480 2.790 4.170 3.601 2.775 4.223 0.053 1 0 "[ . 1 .]" 1
174 1 7 DT H3' 1 8 DT H6 5.000 3.500 6.500 4.734 3.819 5.943 . 0 0 "[ . 1 .]" 1
175 1 7 DT H3' 1 8 DT M7 4.800 3.360 6.240 4.558 3.765 5.091 . 0 0 "[ . 1 .]" 1
176 1 7 DT H4' 1 7 DT H5' 2.640 2.110 3.170 2.391 2.195 2.643 . 0 0 "[ . 1 .]" 1
177 1 7 DT H4' 1 7 DT H6 4.940 3.950 5.930 4.101 3.942 4.394 0.008 6 0 "[ . 1 .]" 1
178 1 7 DT H4' 1 8 DT H6 5.000 3.500 6.500 3.714 3.459 4.387 0.041 13 0 "[ . 1 .]" 1
179 1 7 DT H4' 1 8 DT M7 4.000 2.800 5.200 2.714 2.262 3.282 0.538 3 2 "[ + . 1 -]" 1
180 1 7 DT H5' 1 7 DT H6 3.740 2.990 4.490 3.943 3.556 4.501 0.011 10 0 "[ . 1 .]" 1
181 1 7 DT H5' 1 8 DT M7 4.000 2.800 5.200 2.882 2.087 3.728 0.713 6 3 "[ -+ * 1 .]" 1
182 1 7 DT H5'' 1 7 DT H6 2.880 2.290 3.470 2.526 2.278 3.480 0.012 7 0 "[ . 1 .]" 1
183 1 7 DT H5'' 1 8 DT M7 4.300 3.010 5.590 4.080 3.406 4.561 . 0 0 "[ . 1 .]" 1
184 1 7 DT H6 1 7 DT M7 2.940 2.350 3.530 2.382 2.325 2.409 0.025 10 0 "[ . 1 .]" 1
185 1 7 DT H6 1 8 DT M7 6.000 4.000 8.000 5.496 4.862 6.274 . 0 0 "[ . 1 .]" 1
186 1 8 DT H1' 1 8 DT H2' 2.980 2.380 3.580 2.991 2.930 3.047 . 0 0 "[ . 1 .]" 1
187 1 8 DT H1' 1 8 DT H2'' 2.480 . 2.980 2.365 2.337 2.400 . 0 0 "[ . 1 .]" 1
188 1 8 DT H1' 1 8 DT H3' 3.600 2.880 4.320 3.949 3.876 4.009 . 0 0 "[ . 1 .]" 1
189 1 8 DT H1' 1 8 DT H4' 3.050 2.440 3.660 3.147 2.879 3.611 . 0 0 "[ . 1 .]" 1
190 1 8 DT H1' 1 8 DT H6 4.200 3.360 5.040 3.666 3.546 3.734 . 0 0 "[ . 1 .]" 1
191 1 8 DT H1' 1 9 DA H8 4.100 2.900 5.300 3.695 3.032 4.591 . 0 0 "[ . 1 .]" 1
192 1 8 DT H2' 1 8 DT H3' 2.700 2.160 3.240 2.343 2.313 2.398 . 0 0 "[ . 1 .]" 1
193 1 8 DT H2' 1 8 DT H6 2.920 2.340 3.500 2.908 2.356 3.464 . 0 0 "[ . 1 .]" 1
194 1 8 DT H2'' 1 8 DT H3' 2.810 2.250 3.370 2.845 2.697 2.938 . 0 0 "[ . 1 .]" 1
195 1 8 DT H2'' 1 8 DT H6 3.770 3.030 4.510 4.219 3.855 4.550 0.040 4 0 "[ . 1 .]" 1
196 1 8 DT H3' 1 8 DT H4' 3.010 2.410 3.610 2.857 2.662 2.953 . 0 0 "[ . 1 .]" 1
197 1 8 DT H3' 1 8 DT H5' 3.180 2.540 3.820 3.646 3.481 3.707 . 0 0 "[ . 1 .]" 1
198 1 8 DT H3' 1 8 DT H5'' 2.920 2.340 3.500 2.675 2.326 3.216 0.014 13 0 "[ . 1 .]" 1
199 1 8 DT H3' 1 8 DT H6 3.570 2.860 4.280 3.854 3.375 4.291 0.011 3 0 "[ . 1 .]" 1
200 1 8 DT H4' 1 8 DT H6 4.400 3.520 5.280 4.340 4.107 4.505 . 0 0 "[ . 1 .]" 1
201 1 8 DT H5' 1 8 DT H6 3.430 2.740 4.120 3.658 2.735 4.144 0.024 14 0 "[ . 1 .]" 1
202 1 8 DT H5'' 1 8 DT H6 4.350 3.480 5.220 4.381 3.803 4.782 . 0 0 "[ . 1 .]" 1
203 1 8 DT H6 1 8 DT M7 3.000 2.400 3.600 2.373 2.369 2.374 0.031 14 0 "[ . 1 .]" 1
204 1 9 DA H1' 1 9 DA H2 5.450 4.360 6.540 4.792 4.615 4.972 . 0 0 "[ . 1 .]" 1
205 1 9 DA H1' 1 9 DA H2' 3.520 2.800 4.240 2.989 2.848 3.063 . 0 0 "[ . 1 .]" 1
206 1 9 DA H1' 1 9 DA H2'' 2.380 . 2.940 2.370 2.327 2.413 . 0 0 "[ . 1 .]" 1
207 1 9 DA H1' 1 9 DA H3' 3.900 3.120 4.680 3.948 3.817 4.054 . 0 0 "[ . 1 .]" 1
208 1 9 DA H1' 1 9 DA H4' 3.680 2.940 4.420 3.323 3.073 3.604 . 0 0 "[ . 1 .]" 1
209 1 9 DA H1' 1 9 DA H5'' 5.040 4.030 6.050 5.016 4.812 5.138 . 0 0 "[ . 1 .]" 1
210 1 9 DA H1' 1 9 DA H8 3.360 2.690 4.030 3.694 3.573 3.802 . 0 0 "[ . 1 .]" 1
211 1 9 DA H2 1 10 DG H1 5.000 3.500 6.500 5.209 3.522 6.027 . 0 0 "[ . 1 .]" 1
212 1 9 DA H2 1 18 DG H1 5.350 4.280 6.420 5.616 4.737 6.204 . 0 0 "[ . 1 .]" 1
213 1 9 DA H2 1 18 DG H1' 5.200 3.640 6.760 5.695 5.091 6.414 . 0 0 "[ . 1 .]" 1
214 1 9 DA H2 1 18 DG H2' 4.000 2.800 5.200 3.604 2.876 4.351 . 0 0 "[ . 1 .]" 1
215 1 9 DA H2 1 18 DG H2'' 4.500 3.300 5.700 4.736 3.896 5.728 0.028 11 0 "[ . 1 .]" 1
216 1 9 DA H2 1 18 DG H3' 5.500 3.850 7.150 5.645 4.474 6.403 . 0 0 "[ . 1 .]" 1
217 1 9 DA H2 1 18 DG H8 5.000 3.900 6.100 4.369 3.890 4.722 0.010 8 0 "[ . 1 .]" 1
218 1 9 DA H2' 1 9 DA H3' 2.670 2.140 3.200 2.352 2.311 2.402 . 0 0 "[ . 1 .]" 1
219 1 9 DA H2' 1 9 DA H8 3.750 3.000 4.500 3.621 3.219 3.942 . 0 0 "[ . 1 .]" 1
220 1 9 DA H2'' 1 9 DA H3' 2.720 2.180 3.260 2.805 2.694 2.993 . 0 0 "[ . 1 .]" 1
221 1 9 DA H2'' 1 9 DA H8 4.290 3.430 5.150 4.710 4.431 4.893 . 0 0 "[ . 1 .]" 1
222 1 9 DA H3' 1 9 DA H4' 2.570 2.060 3.080 2.804 2.675 2.959 . 0 0 "[ . 1 .]" 1
223 1 9 DA H3' 1 9 DA H5'' 2.880 2.300 3.460 2.557 2.225 2.967 0.075 2 0 "[ . 1 .]" 1
224 1 9 DA H3' 1 9 DA H8 4.700 3.760 5.640 4.632 3.744 5.146 0.016 6 0 "[ . 1 .]" 1
225 1 9 DA H4' 1 9 DA H5' 2.800 2.240 3.360 2.428 2.239 2.608 0.001 2 0 "[ . 1 .]" 1
226 1 9 DA H4' 1 9 DA H5'' 2.470 . 2.960 2.434 2.273 2.678 . 0 0 "[ . 1 .]" 1
227 1 9 DA H4' 1 9 DA H8 4.490 3.590 5.390 4.499 4.351 4.619 . 0 0 "[ . 1 .]" 1
228 1 9 DA H4' 1 10 DG H8 4.300 3.010 5.590 4.567 3.134 5.458 . 0 0 "[ . 1 .]" 1
229 1 9 DA H5' 1 9 DA H8 4.290 3.440 5.140 3.678 3.413 4.326 0.027 9 0 "[ . 1 .]" 1
230 1 9 DA H5'' 1 9 DA H8 4.000 3.200 4.800 4.617 4.087 4.861 0.061 8 0 "[ . 1 .]" 1
231 1 9 DA H8 1 10 DG H1 5.600 4.100 7.100 4.877 4.289 5.976 . 0 0 "[ . 1 .]" 1
232 1 10 DG H1 1 11 DG H1 3.610 2.930 4.290 4.215 3.757 4.305 0.015 6 0 "[ . 1 .]" 1
233 1 10 DG H1 1 17 DG H8 5.370 4.300 6.440 6.347 6.069 6.470 0.030 3 0 "[ . 1 .]" 1
234 1 10 DG H1 1 18 DG H1 4.940 3.700 6.180 4.281 4.100 4.439 . 0 0 "[ . 1 .]" 1
235 1 10 DG H1 1 18 DG H8 5.440 4.350 6.530 5.046 4.528 5.453 . 0 0 "[ . 1 .]" 1
236 1 10 DG H1' 1 10 DG H2' 3.290 2.640 3.940 3.014 2.986 3.063 . 0 0 "[ . 1 .]" 1
237 1 10 DG H1' 1 10 DG H2'' 2.350 . 2.820 2.377 2.364 2.407 . 0 0 "[ . 1 .]" 1
238 1 10 DG H1' 1 10 DG H3' 4.130 3.300 4.960 3.946 3.837 4.005 . 0 0 "[ . 1 .]" 1
239 1 10 DG H1' 1 10 DG H4' 3.320 2.660 3.980 3.315 2.827 3.530 . 0 0 "[ . 1 .]" 1
240 1 10 DG H1' 1 10 DG H8 2.630 2.100 3.160 2.556 2.538 2.663 . 0 0 "[ . 1 .]" 1
241 1 10 DG H1' 1 11 DG H5' 4.800 3.840 5.760 4.480 4.128 5.408 . 0 0 "[ . 1 .]" 1
242 1 10 DG H1' 1 11 DG H5'' 3.500 2.800 4.200 3.907 3.532 4.226 0.026 3 0 "[ . 1 .]" 1
243 1 10 DG H2' 1 10 DG H3' 2.700 2.160 3.240 2.345 2.312 2.400 . 0 0 "[ . 1 .]" 1
244 1 10 DG H2' 1 10 DG H8 4.440 3.550 5.330 4.446 4.285 4.674 . 0 0 "[ . 1 .]" 1
245 1 10 DG H2' 1 11 DG H1 4.900 3.670 6.130 4.374 4.004 4.966 . 0 0 "[ . 1 .]" 1
246 1 10 DG H2'' 1 10 DG H3' 3.130 2.510 3.750 2.777 2.691 2.906 . 0 0 "[ . 1 .]" 1
247 1 10 DG H2'' 1 10 DG H8 4.480 3.590 5.370 4.267 4.036 4.656 . 0 0 "[ . 1 .]" 1
248 1 10 DG H2'' 1 11 DG H1 5.320 4.260 6.380 5.239 4.933 5.888 . 0 0 "[ . 1 .]" 1
249 1 10 DG H3' 1 10 DG H5' 2.800 2.240 3.360 2.321 2.143 3.064 0.097 15 0 "[ . 1 .]" 1
250 1 10 DG H3' 1 10 DG H5'' 2.890 2.320 3.460 2.937 2.257 3.325 0.063 6 0 "[ . 1 .]" 1
251 1 10 DG H3' 1 10 DG H8 5.310 4.250 6.370 6.097 5.994 6.139 . 0 0 "[ . 1 .]" 1
252 1 10 DG H4' 1 10 DG H8 4.920 3.940 5.900 5.545 5.171 5.739 . 0 0 "[ . 1 .]" 1
253 1 10 DG H8 1 11 DG H1' 4.600 3.680 5.520 4.353 3.511 5.070 0.169 13 0 "[ . 1 .]" 1
254 1 10 DG H8 1 11 DG H3' 6.500 5.200 7.800 6.848 6.295 7.216 . 0 0 "[ . 1 .]" 1
255 1 10 DG H8 1 11 DG H4' 4.720 3.780 5.660 5.102 4.444 5.566 . 0 0 "[ . 1 .]" 1
256 1 10 DG H8 1 11 DG H5'' 5.000 4.120 5.880 5.647 5.133 6.021 0.141 12 0 "[ . 1 .]" 1
257 1 10 DG H8 1 11 DG H8 4.500 3.600 5.400 4.728 4.201 5.103 . 0 0 "[ . 1 .]" 1
258 1 11 DG H1 1 11 DG H21 2.300 . 2.760 2.219 2.216 2.228 . 0 0 "[ . 1 .]" 1
259 1 11 DG H1 1 16 DG H1 3.600 2.900 4.300 4.134 3.703 4.306 0.006 2 0 "[ . 1 .]" 1
260 1 11 DG H1 1 17 DG H8 5.430 4.340 6.520 4.547 4.326 4.793 0.014 1 0 "[ . 1 .]" 1
261 1 11 DG H1' 1 11 DG H2' 3.200 2.560 3.840 3.046 2.992 3.070 . 0 0 "[ . 1 .]" 1
262 1 11 DG H1' 1 11 DG H2'' 2.300 . 2.760 2.411 2.356 2.436 . 0 0 "[ . 1 .]" 1
263 1 11 DG H1' 1 11 DG H3' 3.730 2.980 4.480 3.824 3.768 3.919 . 0 0 "[ . 1 .]" 1
264 1 11 DG H1' 1 11 DG H4' 2.830 2.260 3.400 2.877 2.695 3.227 . 0 0 "[ . 1 .]" 1
265 1 11 DG H1' 1 11 DG H8 2.760 2.210 3.310 2.605 2.537 2.730 . 0 0 "[ . 1 .]" 1
266 1 11 DG H1' 1 12 DG H5' 3.800 2.800 4.800 3.439 2.785 4.213 0.015 4 0 "[ . 1 .]" 1
267 1 11 DG H1' 1 12 DG H8 4.500 3.600 5.400 4.775 4.190 5.273 . 0 0 "[ . 1 .]" 1
268 1 11 DG H2' 1 11 DG H8 4.120 3.300 4.940 4.167 3.559 4.511 . 0 0 "[ . 1 .]" 1
269 1 11 DG H2' 1 12 DG H8 2.880 2.080 3.680 2.489 2.156 2.954 . 0 0 "[ . 1 .]" 1
270 1 11 DG H2'' 1 11 DG H8 3.320 2.660 3.980 3.675 3.214 4.031 0.051 15 0 "[ . 1 .]" 1
271 1 11 DG H2'' 1 12 DG H8 3.000 2.200 3.800 2.799 2.182 3.843 0.043 13 0 "[ . 1 .]" 1
272 1 11 DG H3' 1 11 DG H4' 2.680 2.140 3.220 2.858 2.727 2.939 . 0 0 "[ . 1 .]" 1
273 1 11 DG H3' 1 11 DG H8 5.200 4.160 6.240 5.878 5.583 6.050 . 0 0 "[ . 1 .]" 1
274 1 11 DG H3' 1 12 DG H8 4.450 3.560 5.340 4.138 3.613 4.535 . 0 0 "[ . 1 .]" 1
275 1 11 DG H4' 1 11 DG H8 5.400 4.320 6.480 5.410 5.229 5.773 . 0 0 "[ . 1 .]" 1
276 1 11 DG H5'' 1 11 DG H8 6.320 5.060 7.580 6.395 6.028 6.649 . 0 0 "[ . 1 .]" 1
277 1 11 DG H8 1 12 DG H1' 4.500 3.600 5.400 5.085 4.808 5.338 . 0 0 "[ . 1 .]" 1
278 1 11 DG H8 1 12 DG H4' 4.600 3.600 5.600 5.330 5.121 5.511 . 0 0 "[ . 1 .]" 1
279 1 11 DG H8 1 12 DG H5' 3.600 2.800 4.400 4.180 3.908 4.398 . 0 0 "[ . 1 .]" 1
280 1 11 DG H8 1 12 DG H8 4.500 3.600 5.400 4.972 4.692 5.165 . 0 0 "[ . 1 .]" 1
281 1 12 DG H1 1 16 DG H1 4.420 3.540 5.300 4.080 3.861 4.192 . 0 0 "[ . 1 .]" 1
282 1 12 DG H1' 1 12 DG H2' 3.130 2.510 3.750 3.023 2.996 3.055 . 0 0 "[ . 1 .]" 1
283 1 12 DG H1' 1 12 DG H2'' 2.590 . 3.310 2.391 2.370 2.412 . 0 0 "[ . 1 .]" 1
284 1 12 DG H1' 1 12 DG H3' 3.590 2.870 4.310 3.907 3.845 3.943 . 0 0 "[ . 1 .]" 1
285 1 12 DG H1' 1 12 DG H4' 3.430 2.740 4.120 2.961 2.788 3.163 . 0 0 "[ . 1 .]" 1
286 1 12 DG H1' 1 12 DG H8 4.030 3.220 4.840 3.891 3.883 3.898 . 0 0 "[ . 1 .]" 1
287 1 12 DG H2' 1 12 DG H3' 2.600 2.080 3.120 2.336 2.319 2.369 . 0 0 "[ . 1 .]" 1
288 1 12 DG H2' 1 12 DG H8 2.520 2.020 3.020 2.301 2.221 2.400 . 0 0 "[ . 1 .]" 1
289 1 12 DG H2'' 1 12 DG H3' 2.600 2.080 3.120 2.820 2.744 2.890 . 0 0 "[ . 1 .]" 1
290 1 12 DG H2'' 1 12 DG H8 3.700 2.960 4.440 3.783 3.677 3.935 . 0 0 "[ . 1 .]" 1
291 1 12 DG H3' 1 12 DG H4' 3.230 2.580 3.880 2.877 2.786 2.937 . 0 0 "[ . 1 .]" 1
292 1 12 DG H3' 1 12 DG Q5' 3.520 2.820 4.220 2.647 2.417 2.784 0.403 10 0 "[ . 1 .]" 1
293 1 12 DG H3' 1 12 DG H8 4.320 3.460 5.180 4.073 3.819 4.335 . 0 0 "[ . 1 .]" 1
294 1 12 DG H4' 1 12 DG H8 4.990 3.990 5.990 5.088 5.014 5.174 . 0 0 "[ . 1 .]" 1
295 1 12 DG H5' 1 12 DG H8 4.990 3.990 5.990 4.858 4.477 5.390 . 0 0 "[ . 1 .]" 1
296 1 12 DG H5'' 1 12 DG H8 4.550 3.640 5.460 5.422 5.178 5.562 0.102 12 0 "[ . 1 .]" 1
297 1 12 DG H8 1 16 DG H1 5.370 4.290 6.450 5.262 4.976 5.589 . 0 0 "[ . 1 .]" 1
298 1 13 DT H1' 1 13 DT H2' 3.050 2.440 3.660 2.839 2.772 2.872 . 0 0 "[ . 1 .]" 1
299 1 13 DT H1' 1 13 DT H2'' 2.560 2.050 3.070 2.351 2.337 2.382 . 0 0 "[ . 1 .]" 1
300 1 13 DT H1' 1 13 DT M7 5.550 4.440 6.660 4.262 4.256 4.271 0.184 8 0 "[ . 1 .]" 1
301 1 13 DT H2' 1 13 DT H3 4.680 3.750 5.610 4.355 4.274 4.443 . 0 0 "[ . 1 .]" 1
302 1 13 DT H2'' 1 13 DT H3 5.000 4.000 6.000 5.880 5.839 5.926 . 0 0 "[ . 1 .]" 1
303 1 13 DT H2'' 1 13 DT H6 4.990 3.990 5.990 4.282 4.156 4.438 . 0 0 "[ . 1 .]" 1
304 1 13 DT H3 1 13 DT H6 4.880 3.900 5.860 4.813 4.809 4.816 . 0 0 "[ . 1 .]" 1
305 1 13 DT H3 1 13 DT M7 5.000 4.000 6.000 4.147 4.142 4.151 . 0 0 "[ . 1 .]" 1
306 1 13 DT H3 1 14 DT M7 5.000 3.900 6.100 5.027 4.889 5.117 . 0 0 "[ . 1 .]" 1
307 1 13 DT H3 1 15 DA H2 2.800 2.300 3.300 2.647 2.284 3.331 0.031 9 0 "[ . 1 .]" 1
308 1 13 DT H6 1 13 DT M7 3.000 2.400 3.600 2.372 2.369 2.375 0.031 15 0 "[ . 1 .]" 1
309 1 13 DT H6 1 14 DT H6 6.780 5.280 8.280 6.775 6.089 7.411 . 0 0 "[ . 1 .]" 1
310 1 13 DT H6 1 14 DT M7 5.200 4.200 6.200 4.029 3.322 4.813 0.878 15 4 "[ ** . - 1 +]" 1
311 1 13 DT M7 1 14 DT M7 6.190 4.690 7.690 4.322 3.871 4.814 0.819 2 5 "[ +* * * 1 -]" 1
312 1 14 DT H1' 1 14 DT H2' 2.740 2.190 3.290 2.947 2.759 3.029 . 0 0 "[ . 1 .]" 1
313 1 14 DT H1' 1 14 DT H2'' 2.250 . 2.700 2.353 2.312 2.387 . 0 0 "[ . 1 .]" 1
314 1 14 DT H1' 1 14 DT H6 3.060 2.450 3.670 3.472 3.254 3.647 . 0 0 "[ . 1 .]" 1
315 1 14 DT H1' 1 15 DA H2 6.500 5.200 7.800 6.315 5.566 7.219 . 0 0 "[ . 1 .]" 1
316 1 14 DT H2' 1 15 DA H1' 5.480 4.480 6.480 5.659 5.144 6.311 . 0 0 "[ . 1 .]" 1
317 1 14 DT H2' 1 15 DA H2 5.090 3.890 6.290 4.281 3.850 4.582 0.040 6 0 "[ . 1 .]" 1
318 1 14 DT H2'' 1 14 DT H6 4.890 3.910 5.870 4.594 4.331 4.828 . 0 0 "[ . 1 .]" 1
319 1 14 DT H2'' 1 15 DA H2 5.450 4.150 6.750 4.861 4.138 6.076 0.012 6 0 "[ . 1 .]" 1
320 1 14 DT H4' 1 14 DT H6 4.560 3.650 5.470 4.094 3.833 4.366 . 0 0 "[ . 1 .]" 1
321 1 14 DT Q5' 1 14 DT H6 3.380 2.710 4.050 2.850 1.919 3.535 0.791 7 5 "[ - + *** .]" 1
322 1 14 DT H6 1 14 DT M7 3.080 2.460 3.700 2.316 2.249 2.367 0.211 15 0 "[ . 1 .]" 1
323 1 15 DA H1' 1 15 DA H2 4.810 3.850 5.770 4.539 4.513 4.573 . 0 0 "[ . 1 .]" 1
324 1 15 DA H1' 1 15 DA H2'' 2.540 2.130 2.950 2.389 2.375 2.398 . 0 0 "[ . 1 .]" 1
325 1 15 DA H1' 1 15 DA H8 3.740 2.980 4.500 3.864 3.855 3.878 . 0 0 "[ . 1 .]" 1
326 1 15 DA H2' 1 15 DA H8 2.970 2.370 3.570 2.851 2.713 3.085 . 0 0 "[ . 1 .]" 1
327 1 15 DA H2'' 1 15 DA H8 3.710 2.970 4.450 4.027 3.978 4.121 . 0 0 "[ . 1 .]" 1
328 1 15 DA H4' 1 15 DA H8 4.230 3.380 5.080 4.113 3.924 4.227 . 0 0 "[ . 1 .]" 1
329 1 16 DG H1 1 16 DG H21 2.300 . 2.760 2.216 2.212 2.221 . 0 0 "[ . 1 .]" 1
330 1 16 DG H1 1 17 DG H1 5.000 3.800 6.200 5.620 5.131 6.080 . 0 0 "[ . 1 .]" 1
331 1 16 DG H1 1 22 DG H1 4.300 3.440 5.160 4.427 4.339 4.467 . 0 0 "[ . 1 .]" 1
332 1 16 DG H1' 1 16 DG H2' 3.360 2.690 4.030 3.008 2.933 3.062 . 0 0 "[ . 1 .]" 1
333 1 16 DG H1' 1 16 DG H2'' 2.270 . 2.710 2.367 2.318 2.398 . 0 0 "[ . 1 .]" 1
334 1 16 DG H1' 1 16 DG H3' 3.820 3.060 4.580 3.934 3.860 4.032 . 0 0 "[ . 1 .]" 1
335 1 16 DG H1' 1 16 DG H4' 3.400 2.720 4.080 3.154 2.870 3.561 . 0 0 "[ . 1 .]" 1
336 1 16 DG H1' 1 16 DG H8 2.690 2.160 3.220 2.711 2.537 2.956 . 0 0 "[ . 1 .]" 1
337 1 16 DG H1' 1 17 DG Q5' 3.500 2.800 4.200 2.725 2.241 3.187 0.559 1 1 "[+ . 1 .]" 1
338 1 16 DG H1' 1 17 DG H8 3.890 3.090 4.690 3.670 3.085 4.217 0.005 14 0 "[ . 1 .]" 1
339 1 16 DG H2' 1 16 DG H3' 2.490 . 2.990 2.337 2.287 2.390 . 0 0 "[ . 1 .]" 1
340 1 16 DG H2' 1 16 DG H8 4.580 3.660 5.500 4.583 4.436 4.736 . 0 0 "[ . 1 .]" 1
341 1 16 DG H2' 1 17 DG H8 3.250 2.620 3.880 3.168 2.551 3.960 0.080 5 0 "[ . 1 .]" 1
342 1 16 DG H2'' 1 16 DG H3' 2.990 2.390 3.590 2.831 2.705 2.927 . 0 0 "[ . 1 .]" 1
343 1 16 DG H2'' 1 16 DG H8 4.500 3.600 5.400 4.627 4.272 4.967 . 0 0 "[ . 1 .]" 1
344 1 16 DG H2'' 1 17 DG H8 2.380 . 2.850 2.387 1.948 2.938 0.088 9 0 "[ . 1 .]" 1
345 1 16 DG H3' 1 16 DG H4' 2.870 2.380 3.440 2.837 2.656 2.949 . 0 0 "[ . 1 .]" 1
346 1 16 DG H3' 1 16 DG Q5' 2.580 2.060 3.100 2.473 2.090 2.851 . 0 0 "[ . 1 .]" 1
347 1 16 DG H3' 1 16 DG H8 5.080 4.060 6.100 5.973 5.624 6.140 0.040 3 0 "[ . 1 .]" 1
348 1 16 DG H3' 1 17 DG H8 4.700 3.760 5.640 4.852 4.324 5.634 . 0 0 "[ . 1 .]" 1
349 1 16 DG H4' 1 16 DG Q5' 2.680 2.140 3.220 2.353 2.170 2.524 . 0 0 "[ . 1 .]" 1
350 1 16 DG H4' 1 16 DG H8 4.650 3.720 5.580 5.067 4.824 5.199 . 0 0 "[ . 1 .]" 1
351 1 16 DG H4' 1 17 DG H8 5.800 4.640 6.960 5.903 5.454 6.275 . 0 0 "[ . 1 .]" 1
352 1 16 DG H8 1 17 DG H1' 3.830 3.060 4.600 3.945 3.456 4.490 . 0 0 "[ . 1 .]" 1
353 1 16 DG H8 1 17 DG H4' 4.700 3.760 5.640 4.879 4.431 5.291 . 0 0 "[ . 1 .]" 1
354 1 16 DG H8 1 17 DG Q5' 5.070 4.060 6.080 4.746 4.136 5.499 . 0 0 "[ . 1 .]" 1
355 1 16 DG H8 1 17 DG H8 4.330 3.460 5.200 5.215 5.165 5.237 0.037 14 0 "[ . 1 .]" 1
356 1 16 DG H8 1 22 DG H1 5.340 4.270 6.410 4.416 4.263 4.708 0.007 8 0 "[ . 1 .]" 1
357 1 17 DG H1 1 17 DG H21 2.300 . 2.760 2.218 2.212 2.224 . 0 0 "[ . 1 .]" 1
358 1 17 DG H1 1 18 DG H1 4.000 3.200 4.800 4.447 4.014 4.748 . 0 0 "[ . 1 .]" 1
359 1 17 DG H1 1 22 DG H1 3.630 2.900 4.360 4.027 3.656 4.368 0.008 14 0 "[ . 1 .]" 1
360 1 17 DG H1 1 23 DG H8 5.480 4.380 6.580 5.392 4.985 5.657 . 0 0 "[ . 1 .]" 1
361 1 17 DG H1' 1 17 DG H2' 3.360 2.690 4.030 2.976 2.922 3.054 . 0 0 "[ . 1 .]" 1
362 1 17 DG H1' 1 17 DG H2'' 2.590 2.070 3.110 2.357 2.335 2.406 . 0 0 "[ . 1 .]" 1
363 1 17 DG H1' 1 17 DG H3' 3.940 3.150 4.730 3.922 3.833 3.964 . 0 0 "[ . 1 .]" 1
364 1 17 DG H1' 1 17 DG H4' 2.970 2.380 3.560 2.886 2.755 3.086 . 0 0 "[ . 1 .]" 1
365 1 17 DG H1' 1 17 DG H8 3.840 3.070 4.610 3.867 3.829 3.898 . 0 0 "[ . 1 .]" 1
366 1 17 DG H1' 1 18 DG H4' 5.300 4.240 6.360 4.660 4.172 5.114 0.068 3 0 "[ . 1 .]" 1
367 1 17 DG H1' 1 18 DG H5' 4.500 3.300 5.700 5.314 4.633 5.739 0.039 10 0 "[ . 1 .]" 1
368 1 17 DG H1' 1 18 DG H5'' 4.300 3.040 5.560 4.921 3.518 5.609 0.049 13 0 "[ . 1 .]" 1
369 1 17 DG H1' 1 18 DG H8 3.040 2.430 3.650 3.624 3.171 3.821 0.171 1 0 "[ . 1 .]" 1
370 1 17 DG H2' 1 17 DG H3' 2.520 2.020 3.020 2.328 2.319 2.376 . 0 0 "[ . 1 .]" 1
371 1 17 DG H2' 1 17 DG H8 2.560 2.050 3.070 2.769 2.394 3.108 0.038 9 0 "[ . 1 .]" 1
372 1 17 DG H2' 1 18 DG H8 2.880 2.310 3.450 3.144 2.662 3.498 0.048 12 0 "[ . 1 .]" 1
373 1 17 DG H2'' 1 17 DG H3' 2.950 2.360 3.540 2.912 2.744 2.991 . 0 0 "[ . 1 .]" 1
374 1 17 DG H2'' 1 17 DG H8 3.660 2.930 4.390 4.201 3.884 4.441 0.051 9 0 "[ . 1 .]" 1
375 1 17 DG H2'' 1 18 DG H8 2.400 . 2.880 2.386 1.920 2.543 0.000 8 0 "[ . 1 .]" 1
376 1 17 DG H21 1 23 DG H8 3.020 2.420 3.620 3.437 3.162 3.618 . 0 0 "[ . 1 .]" 1
377 1 17 DG H3' 1 17 DG H4' 2.530 2.020 3.040 2.944 2.792 2.999 . 0 0 "[ . 1 .]" 1
378 1 17 DG H3' 1 17 DG Q5' 2.900 2.320 3.480 2.596 2.185 2.937 0.135 9 0 "[ . 1 .]" 1
379 1 17 DG H3' 1 17 DG H8 3.700 2.960 4.440 3.770 3.329 4.472 0.032 10 0 "[ . 1 .]" 1
380 1 17 DG H3' 1 18 DG H8 4.400 3.510 5.280 5.047 4.692 5.349 0.069 7 0 "[ . 1 .]" 1
381 1 17 DG H4' 1 17 DG H8 4.400 3.520 5.280 4.864 4.710 5.081 . 0 0 "[ . 1 .]" 1
382 1 17 DG H4' 1 18 DG H8 5.000 3.500 6.500 5.648 5.084 6.073 . 0 0 "[ . 1 .]" 1
383 1 17 DG H5' 1 17 DG H8 4.500 3.600 5.400 4.814 4.076 5.426 0.026 7 0 "[ . 1 .]" 1
384 1 17 DG H5'' 1 17 DG H8 4.840 3.870 5.810 5.056 3.841 5.330 0.029 9 0 "[ . 1 .]" 1
385 1 17 DG H8 1 18 DG H8 4.420 3.500 5.340 5.215 4.948 5.364 0.024 9 0 "[ . 1 .]" 1
386 1 18 DG H1 1 23 DG H8 4.520 3.390 5.650 5.424 4.879 5.655 0.005 1 0 "[ . 1 .]" 1
387 1 18 DG H1 1 24 DG H8 5.440 4.350 6.530 4.731 4.344 5.215 0.006 8 0 "[ . 1 .]" 1
388 1 18 DG H1 1 25 DT M7 5.300 4.240 6.360 4.663 4.209 5.137 0.031 6 0 "[ . 1 .]" 1
389 1 18 DG H1' 1 18 DG H2' 3.110 2.490 3.730 3.020 2.937 3.059 . 0 0 "[ . 1 .]" 1
390 1 18 DG H1' 1 18 DG H2'' 2.490 . 2.990 2.386 2.338 2.418 . 0 0 "[ . 1 .]" 1
391 1 18 DG H1' 1 18 DG H3' 3.900 3.120 4.680 3.914 3.826 4.013 . 0 0 "[ . 1 .]" 1
392 1 18 DG H1' 1 18 DG H4' 3.480 2.780 4.180 3.276 2.974 3.546 . 0 0 "[ . 1 .]" 1
393 1 18 DG H1' 1 18 DG H5' 4.780 3.820 5.740 4.977 4.884 5.034 . 0 0 "[ . 1 .]" 1
394 1 18 DG H1' 1 18 DG H8 4.070 3.260 4.880 3.751 3.652 3.865 . 0 0 "[ . 1 .]" 1
395 1 18 DG H2' 1 18 DG H8 2.940 2.350 3.530 3.365 2.848 3.621 0.091 8 0 "[ . 1 .]" 1
396 1 18 DG H2'' 1 18 DG H8 4.000 3.200 4.800 4.562 4.214 4.717 . 0 0 "[ . 1 .]" 1
397 1 18 DG H3' 1 18 DG H4' 2.800 2.240 3.360 2.778 2.688 2.920 . 0 0 "[ . 1 .]" 1
398 1 18 DG H3' 1 18 DG H5' 2.530 2.020 3.040 2.686 2.169 3.144 0.104 1 0 "[ . 1 .]" 1
399 1 18 DG H3' 1 18 DG H5'' 2.780 2.230 3.330 2.542 2.149 3.067 0.081 1 0 "[ . 1 .]" 1
400 1 18 DG H3' 1 18 DG H8 4.370 3.500 5.240 4.679 4.104 5.152 . 0 0 "[ . 1 .]" 1
401 1 18 DG H5'' 1 18 DG H8 3.000 . 4.000 3.277 2.227 4.023 0.023 9 0 "[ . 1 .]" 1
402 1 19 DT H1' 1 19 DT H2' 2.800 2.240 3.360 2.979 2.792 3.058 . 0 0 "[ . 1 .]" 1
403 1 19 DT H1' 1 19 DT H2'' 2.360 . 2.830 2.377 2.324 2.411 . 0 0 "[ . 1 .]" 1
404 1 19 DT H1' 1 19 DT H4' 3.600 2.860 4.340 3.349 2.858 3.849 0.002 11 0 "[ . 1 .]" 1
405 1 19 DT H1' 1 19 DT H6 2.380 . 2.860 2.291 2.237 2.338 . 0 0 "[ . 1 .]" 1
406 1 19 DT H1' 1 20 DT H6 6.000 5.000 7.000 5.918 4.992 7.001 0.008 15 0 "[ . 1 .]" 1
407 1 19 DT H1' 1 20 DT M7 6.500 5.000 8.000 4.907 3.860 6.490 1.140 12 6 "[ . ** +**-]" 1
408 1 19 DT H2' 1 19 DT H6 4.480 3.590 5.370 4.005 3.577 4.350 0.013 9 0 "[ . 1 .]" 1
409 1 19 DT H2' 1 20 DT H6 5.500 4.500 6.500 6.193 5.315 6.583 0.083 6 0 "[ . 1 .]" 1
410 1 19 DT H2' 1 20 DT M7 6.000 4.500 7.500 5.115 3.744 6.089 0.756 8 2 "[ . +-1 .]" 1
411 1 19 DT H2'' 1 19 DT H6 4.050 3.240 4.860 3.710 3.386 4.427 . 0 0 "[ . 1 .]" 1
412 1 19 DT H2'' 1 20 DT H6 5.500 4.500 6.500 4.933 4.491 6.295 0.009 2 0 "[ . 1 .]" 1
413 1 19 DT H3' 1 20 DT H6 6.000 5.000 7.000 5.537 4.911 6.564 0.089 6 0 "[ . 1 .]" 1
414 1 19 DT H3' 1 20 DT M7 6.500 5.000 8.000 5.064 4.115 6.346 0.885 6 2 "[ .+ 1 -.]" 1
415 1 19 DT H4' 1 19 DT H6 4.800 3.840 5.760 5.484 5.181 5.690 . 0 0 "[ . 1 .]" 1
416 1 19 DT H5' 1 19 DT H6 5.500 4.000 7.000 6.379 5.782 6.991 . 0 0 "[ . 1 .]" 1
417 1 19 DT H6 1 19 DT M7 2.530 2.020 3.040 2.362 2.303 2.408 . 0 0 "[ . 1 .]" 1
418 1 19 DT H6 1 20 DT M7 6.500 5.000 8.000 5.674 3.989 6.583 1.011 12 2 "[ . - + .]" 1
419 1 20 DT H1' 1 20 DT H2' 2.900 2.320 3.480 3.020 2.786 3.058 . 0 0 "[ . 1 .]" 1
420 1 20 DT H1' 1 20 DT H2'' 2.230 . 2.680 2.391 2.352 2.409 . 0 0 "[ . 1 .]" 1
421 1 20 DT H1' 1 20 DT H4' 3.670 2.940 4.400 3.301 2.939 3.508 0.001 6 0 "[ . 1 .]" 1
422 1 20 DT H1' 1 20 DT H6 3.900 3.120 4.680 3.617 3.185 3.715 . 0 0 "[ . 1 .]" 1
423 1 20 DT H1' 1 21 DA H8 4.000 3.000 5.000 4.956 4.503 5.056 0.056 9 0 "[ . 1 .]" 1
424 1 20 DT H2' 1 21 DA H8 5.500 4.300 6.700 6.278 5.738 6.768 0.068 14 0 "[ . 1 .]" 1
425 1 20 DT H2'' 1 20 DT H6 4.000 3.200 4.800 4.091 3.611 4.797 . 0 0 "[ . 1 .]" 1
426 1 20 DT H2'' 1 21 DA H8 5.200 4.200 6.200 4.824 4.175 5.618 0.025 15 0 "[ . 1 .]" 1
427 1 20 DT H3' 1 21 DA H8 6.000 4.440 7.560 5.565 4.663 7.108 . 0 0 "[ . 1 .]" 1
428 1 20 DT H4' 1 20 DT H6 4.860 3.890 5.830 4.318 4.001 4.739 . 0 0 "[ . 1 .]" 1
429 1 20 DT H4' 1 21 DA H8 4.500 3.500 5.500 5.116 3.472 5.535 0.035 6 0 "[ . 1 .]" 1
430 1 20 DT H5' 1 20 DT H6 4.240 3.390 5.090 4.122 3.360 5.117 0.030 11 0 "[ . 1 .]" 1
431 1 20 DT H6 1 20 DT M7 3.000 . 4.000 2.358 2.308 2.409 . 0 0 "[ . 1 .]" 1
432 1 21 DA H1' 1 21 DA H2 4.940 3.950 5.930 4.607 4.487 4.750 . 0 0 "[ . 1 .]" 1
433 1 21 DA H1' 1 21 DA H2' 2.850 2.280 3.420 2.892 2.783 3.049 . 0 0 "[ . 1 .]" 1
434 1 21 DA H1' 1 21 DA H2'' 2.140 . 2.570 2.344 2.330 2.397 . 0 0 "[ . 1 .]" 1
435 1 21 DA H1' 1 21 DA H4' 3.060 2.450 3.670 3.231 3.004 3.551 . 0 0 "[ . 1 .]" 1
436 1 21 DA H1' 1 21 DA H5' 4.970 3.980 5.960 4.666 4.406 5.069 . 0 0 "[ . 1 .]" 1
437 1 21 DA H1' 1 21 DA H5'' 5.120 4.100 6.140 5.003 4.556 5.114 . 0 0 "[ . 1 .]" 1
438 1 21 DA H1' 1 21 DA H8 4.000 3.200 4.800 3.807 3.719 3.886 . 0 0 "[ . 1 .]" 1
439 1 21 DA H2' 1 21 DA H8 2.800 . 3.600 3.411 2.296 3.645 0.045 10 0 "[ . 1 .]" 1
440 1 21 DA H2'' 1 21 DA H8 3.820 3.060 4.580 4.532 3.778 4.633 0.053 2 0 "[ . 1 .]" 1
441 1 21 DA H3' 1 21 DA H8 3.970 3.180 4.760 3.450 3.108 4.855 0.095 11 0 "[ . 1 .]" 1
442 1 21 DA H4' 1 21 DA H8 5.000 4.000 6.000 4.494 4.182 4.801 . 0 0 "[ . 1 .]" 1
443 1 21 DA H5' 1 21 DA H8 4.130 3.300 4.960 4.057 3.280 4.986 0.026 14 0 "[ . 1 .]" 1
444 1 21 DA H5'' 1 21 DA H8 4.000 3.000 5.000 4.203 3.025 4.769 . 0 0 "[ . 1 .]" 1
445 1 22 DG H1 1 22 DG H21 2.300 . 2.760 2.222 2.217 2.228 . 0 0 "[ . 1 .]" 1
446 1 22 DG H1 1 23 DG H8 5.500 4.120 6.880 6.720 6.373 6.904 0.024 12 0 "[ . 1 .]" 1
447 1 22 DG H1' 1 22 DG H2' 3.100 2.480 3.720 3.023 2.950 3.060 . 0 0 "[ . 1 .]" 1
448 1 22 DG H1' 1 22 DG H2'' 2.500 . 3.000 2.382 2.339 2.410 . 0 0 "[ . 1 .]" 1
449 1 22 DG H1' 1 22 DG H3' 4.500 3.600 5.400 3.924 3.850 4.050 . 0 0 "[ . 1 .]" 1
450 1 22 DG H1' 1 22 DG H4' 2.990 2.390 3.590 3.382 3.102 3.653 0.063 5 0 "[ . 1 .]" 1
451 1 22 DG H1' 1 22 DG H8 2.700 2.160 3.240 2.547 2.535 2.569 . 0 0 "[ . 1 .]" 1
452 1 22 DG H1' 1 23 DG H4' 4.300 3.440 5.160 3.859 3.534 4.308 . 0 0 "[ . 1 .]" 1
453 1 22 DG H1' 1 23 DG H5' 2.540 2.030 3.050 2.307 2.085 2.567 . 0 0 "[ . 1 .]" 1
454 1 22 DG H1' 1 23 DG H5'' 3.750 3.000 4.500 3.931 3.608 4.294 . 0 0 "[ . 1 .]" 1
455 1 22 DG H1' 1 23 DG H8 4.170 3.340 5.000 4.098 3.809 4.379 . 0 0 "[ . 1 .]" 1
456 1 22 DG H2' 1 22 DG H3' 2.500 . 3.000 2.365 2.323 2.400 . 0 0 "[ . 1 .]" 1
457 1 22 DG H2' 1 22 DG H8 4.400 3.520 5.280 4.450 4.246 4.555 . 0 0 "[ . 1 .]" 1
458 1 22 DG H2' 1 23 DG H8 2.900 2.320 3.480 2.833 2.304 3.329 0.016 12 0 "[ . 1 .]" 1
459 1 22 DG H2'' 1 22 DG H3' 2.900 2.320 3.480 2.749 2.698 2.848 . 0 0 "[ . 1 .]" 1
460 1 22 DG H2'' 1 22 DG H8 4.240 3.390 5.090 4.218 3.941 4.414 . 0 0 "[ . 1 .]" 1
461 1 22 DG H2'' 1 23 DG H8 2.450 . 2.940 2.283 2.163 2.543 . 0 0 "[ . 1 .]" 1
462 1 22 DG H3' 1 22 DG H5'' 3.000 2.400 3.600 2.979 2.364 3.655 0.055 6 0 "[ . 1 .]" 1
463 1 22 DG H3' 1 22 DG H8 5.760 4.610 6.910 6.101 6.016 6.141 . 0 0 "[ . 1 .]" 1
464 1 22 DG H3' 1 23 DG H8 4.500 3.600 5.400 4.481 3.784 4.933 . 0 0 "[ . 1 .]" 1
465 1 22 DG H4' 1 22 DG H5'' 2.830 2.260 3.400 2.735 2.297 3.018 . 0 0 "[ . 1 .]" 1
466 1 22 DG H4' 1 22 DG H8 5.520 4.420 6.620 5.610 5.396 5.758 . 0 0 "[ . 1 .]" 1
467 1 22 DG H5' 1 22 DG H8 6.000 4.800 7.200 6.461 5.255 7.070 . 0 0 "[ . 1 .]" 1
468 1 22 DG H5'' 1 22 DG H8 6.070 4.860 7.280 6.111 5.191 7.106 . 0 0 "[ . 1 .]" 1
469 1 22 DG H8 1 23 DG H1' 4.000 3.200 4.800 3.877 3.252 4.512 . 0 0 "[ . 1 .]" 1
470 1 22 DG H8 1 23 DG H3' 5.480 4.380 6.580 6.186 5.969 6.490 . 0 0 "[ . 1 .]" 1
471 1 22 DG H8 1 23 DG H4' 4.700 3.760 5.640 4.387 3.989 4.903 . 0 0 "[ . 1 .]" 1
472 1 22 DG H8 1 23 DG H5' 4.500 3.600 5.400 4.068 3.594 4.438 0.006 5 0 "[ . 1 .]" 1
473 1 22 DG H8 1 23 DG H5'' 4.940 3.950 5.930 5.592 5.286 5.924 . 0 0 "[ . 1 .]" 1
474 1 22 DG H8 1 23 DG H8 4.490 3.600 5.380 4.858 4.472 5.312 . 0 0 "[ . 1 .]" 1
475 1 23 DG H1 1 23 DG H21 2.300 . 2.760 2.217 2.215 2.219 . 0 0 "[ . 1 .]" 1
476 1 23 DG H1 1 24 DG H1 3.600 2.900 4.300 3.988 3.244 4.309 0.009 11 0 "[ . 1 .]" 1
477 1 23 DG H1' 1 23 DG H2' 3.100 2.480 3.720 3.011 2.960 3.049 . 0 0 "[ . 1 .]" 1
478 1 23 DG H1' 1 23 DG H2'' 2.500 . 3.000 2.379 2.347 2.412 . 0 0 "[ . 1 .]" 1
479 1 23 DG H1' 1 23 DG H3' 3.850 3.080 4.620 3.901 3.848 3.951 . 0 0 "[ . 1 .]" 1
480 1 23 DG H1' 1 23 DG H4' 3.400 2.720 4.080 2.834 2.714 2.983 0.006 7 0 "[ . 1 .]" 1
481 1 23 DG H1' 1 23 DG H8 3.900 3.120 4.680 3.882 3.863 3.893 . 0 0 "[ . 1 .]" 1
482 1 23 DG H1' 1 24 DG H4' 4.930 3.950 5.910 5.319 4.668 5.915 0.005 13 0 "[ . 1 .]" 1
483 1 23 DG H1' 1 24 DG H8 4.140 3.300 4.980 3.989 3.818 4.385 . 0 0 "[ . 1 .]" 1
484 1 23 DG H2' 1 23 DG H8 2.460 . 2.950 2.648 2.325 2.974 0.024 3 0 "[ . 1 .]" 1
485 1 23 DG H2' 1 24 DG H8 2.800 2.240 3.360 3.124 2.345 3.421 0.061 4 0 "[ . 1 .]" 1
486 1 23 DG H2'' 1 23 DG H3' 2.890 2.310 3.470 2.874 2.782 2.954 . 0 0 "[ . 1 .]" 1
487 1 23 DG H2'' 1 23 DG H8 3.760 3.010 4.510 4.093 3.873 4.371 . 0 0 "[ . 1 .]" 1
488 1 23 DG H2'' 1 24 DG H8 2.340 . 2.810 2.417 2.197 2.684 . 0 0 "[ . 1 .]" 1
489 1 23 DG H3' 1 23 DG H4' 2.920 2.340 3.500 2.924 2.839 2.983 . 0 0 "[ . 1 .]" 1
490 1 23 DG H3' 1 23 DG H8 4.230 3.380 5.080 4.010 3.608 4.390 . 0 0 "[ . 1 .]" 1
491 1 23 DG H3' 1 24 DG H8 4.480 3.590 5.370 4.914 4.121 5.393 0.023 4 0 "[ . 1 .]" 1
492 1 23 DG H4' 1 23 DG H8 4.590 3.670 5.510 4.952 4.798 5.073 . 0 0 "[ . 1 .]" 1
493 1 23 DG H4' 1 24 DG H8 5.000 4.000 6.000 5.874 5.589 6.040 0.040 13 0 "[ . 1 .]" 1
494 1 23 DG H5' 1 23 DG H8 4.600 3.680 5.520 4.762 4.346 5.280 . 0 0 "[ . 1 .]" 1
495 1 23 DG H5'' 1 23 DG H8 4.600 3.680 5.520 5.358 5.138 5.542 0.022 5 0 "[ . 1 .]" 1
496 1 23 DG H8 1 24 DG H8 4.400 3.520 5.280 5.032 4.727 5.300 0.020 9 0 "[ . 1 .]" 1
497 1 24 DG H1 1 24 DG H1' 5.200 3.900 6.500 5.961 5.879 6.067 . 0 0 "[ . 1 .]" 1
498 1 24 DG H1' 1 24 DG H2' 2.950 2.360 3.540 2.990 2.869 3.051 . 0 0 "[ . 1 .]" 1
499 1 24 DG H1' 1 24 DG H2'' 2.400 . 2.880 2.362 2.318 2.402 . 0 0 "[ . 1 .]" 1
500 1 24 DG H1' 1 24 DG H3' 3.600 2.880 4.320 3.959 3.859 4.007 . 0 0 "[ . 1 .]" 1
501 1 24 DG H1' 1 24 DG H4' 3.600 2.880 4.320 3.386 3.059 3.658 . 0 0 "[ . 1 .]" 1
502 1 24 DG H1' 1 24 DG H8 3.700 2.960 4.440 3.807 3.711 3.880 . 0 0 "[ . 1 .]" 1
503 1 24 DG H1' 1 25 DT H6 4.210 3.370 5.050 4.836 4.041 5.203 0.153 13 0 "[ . 1 .]" 1
504 1 24 DG H1' 1 25 DT M7 5.000 4.000 6.000 4.611 3.895 4.949 0.105 6 0 "[ . 1 .]" 1
505 1 24 DG H2' 1 24 DG H3' 2.320 . 2.780 2.357 2.325 2.395 . 0 0 "[ . 1 .]" 1
506 1 24 DG H2' 1 24 DG H8 3.160 2.530 3.790 3.170 2.712 3.790 . 0 0 "[ . 1 .]" 1
507 1 24 DG H2' 1 25 DT H6 3.300 2.300 4.300 2.890 2.410 3.536 . 0 0 "[ . 1 .]" 1
508 1 24 DG H2' 1 25 DT M7 3.800 2.800 4.800 2.491 2.285 2.762 0.515 3 2 "[ + . - 1 .]" 1
509 1 24 DG H2'' 1 24 DG H3' 2.940 2.350 3.530 2.792 2.703 2.998 . 0 0 "[ . 1 .]" 1
510 1 24 DG H2'' 1 24 DG H8 4.600 3.680 5.520 4.454 4.168 4.785 . 0 0 "[ . 1 .]" 1
511 1 24 DG H2'' 1 25 DT H6 2.700 . 3.700 2.804 2.188 3.508 . 0 0 "[ . 1 .]" 1
512 1 24 DG H2'' 1 25 DT M7 4.200 3.200 5.200 3.530 3.091 4.006 0.109 6 0 "[ . 1 .]" 1
513 1 24 DG H3' 1 24 DG H4' 2.850 2.280 3.420 2.776 2.668 2.985 . 0 0 "[ . 1 .]" 1
514 1 24 DG H3' 1 24 DG H5' 2.500 . 3.000 2.404 2.128 3.018 0.018 13 0 "[ . 1 .]" 1
515 1 24 DG H3' 1 24 DG H8 4.360 3.490 5.230 4.310 3.712 4.982 . 0 0 "[ . 1 .]" 1
516 1 24 DG H4' 1 24 DG H5' 2.350 . 2.820 2.542 2.299 2.741 . 0 0 "[ . 1 .]" 1
517 1 24 DG H4' 1 24 DG H5'' 2.690 2.160 3.220 2.979 2.918 3.018 . 0 0 "[ . 1 .]" 1
518 1 24 DG H4' 1 24 DG H8 4.900 3.920 5.880 4.507 4.284 4.839 . 0 0 "[ . 1 .]" 1
519 1 24 DG H5' 1 24 DG H8 4.000 3.200 4.800 4.161 3.217 4.833 0.033 2 0 "[ . 1 .]" 1
520 1 24 DG H8 1 25 DT H6 5.500 4.300 6.700 5.722 4.783 6.136 . 0 0 "[ . 1 .]" 1
521 1 24 DG H8 1 25 DT M7 4.500 3.150 5.850 3.742 3.036 4.177 0.114 9 0 "[ . 1 .]" 1
522 1 25 DT H1' 1 25 DT H2' 3.210 2.570 3.850 2.915 2.812 3.012 . 0 0 "[ . 1 .]" 1
523 1 25 DT H1' 1 25 DT H2'' 2.770 2.220 3.320 2.339 2.324 2.369 . 0 0 "[ . 1 .]" 1
524 1 25 DT H1' 1 25 DT H3' 3.670 2.940 4.400 3.939 3.902 3.979 . 0 0 "[ . 1 .]" 1
525 1 25 DT H1' 1 25 DT H4' 3.650 2.920 4.380 3.048 2.874 3.324 0.046 4 0 "[ . 1 .]" 1
526 1 25 DT H1' 1 25 DT H5' 5.000 4.000 6.000 4.997 4.892 5.170 . 0 0 "[ . 1 .]" 1
527 1 25 DT H1' 1 25 DT H6 3.500 2.800 4.200 3.599 3.437 3.708 . 0 0 "[ . 1 .]" 1
528 1 25 DT H1' 1 26 DT H6 4.180 3.340 5.020 4.542 4.039 5.104 0.084 3 0 "[ . 1 .]" 1
529 1 25 DT H1' 1 26 DT M7 4.900 3.920 5.880 4.555 4.275 4.811 . 0 0 "[ . 1 .]" 1
530 1 25 DT H2' 1 25 DT H3' 2.400 . 2.880 2.346 2.317 2.380 . 0 0 "[ . 1 .]" 1
531 1 25 DT H2' 1 25 DT H6 3.470 2.780 4.160 3.348 2.743 3.929 0.037 7 0 "[ . 1 .]" 1
532 1 25 DT H2' 1 25 DT M7 5.490 4.400 6.580 4.622 4.197 5.059 0.203 7 0 "[ . 1 .]" 1
533 1 25 DT H2' 1 26 DT H6 3.000 . 4.000 2.364 2.000 3.250 0.000 2 0 "[ . 1 .]" 1
534 1 25 DT H2' 1 26 DT M7 3.800 2.800 4.800 2.419 2.193 2.838 0.607 3 2 "[ + . - 1 .]" 1
535 1 25 DT H2'' 1 25 DT H3' 2.930 2.340 3.520 2.962 2.833 3.030 . 0 0 "[ . 1 .]" 1
536 1 25 DT H2'' 1 26 DT H6 3.000 . 4.000 2.741 2.327 3.598 . 0 0 "[ . 1 .]" 1
537 1 25 DT H2'' 1 26 DT M7 4.300 3.100 5.500 3.750 3.159 4.377 . 0 0 "[ . 1 .]" 1
538 1 25 DT H3' 1 25 DT H4' 2.990 2.390 3.590 2.965 2.875 3.005 . 0 0 "[ . 1 .]" 1
539 1 25 DT H3' 1 25 DT H5' 3.010 2.410 3.610 2.972 2.790 3.272 . 0 0 "[ . 1 .]" 1
540 1 25 DT H3' 1 25 DT H5'' 2.800 2.240 3.360 2.336 2.190 2.559 0.050 13 0 "[ . 1 .]" 1
541 1 25 DT H3' 1 25 DT H6 3.290 2.630 3.950 3.450 2.592 3.990 0.040 2 0 "[ . 1 .]" 1
542 1 25 DT H3' 1 25 DT M7 5.480 4.380 6.580 4.892 4.084 5.428 0.296 1 0 "[ . 1 .]" 1
543 1 25 DT H3' 1 26 DT H6 4.700 3.760 5.640 4.054 3.782 4.573 . 0 0 "[ . 1 .]" 1
544 1 25 DT H3' 1 26 DT M7 4.500 3.600 5.400 3.692 3.041 4.303 0.559 7 2 "[ - . + 1 .]" 1
545 1 25 DT H5' 1 25 DT H6 3.990 3.190 4.790 4.565 3.945 4.819 0.029 4 0 "[ . 1 .]" 1
546 1 25 DT H5'' 1 25 DT H6 2.830 2.260 3.400 3.151 2.360 3.434 0.034 3 0 "[ . 1 .]" 1
547 1 25 DT H6 1 25 DT M7 3.060 2.450 3.670 2.372 2.367 2.374 0.083 12 0 "[ . 1 .]" 1
548 1 25 DT H6 1 26 DT H6 5.100 4.080 6.120 5.545 5.014 6.062 . 0 0 "[ . 1 .]" 1
549 1 25 DT H6 1 26 DT M7 4.000 3.000 5.000 3.860 3.347 4.098 . 0 0 "[ . 1 .]" 1
550 1 25 DT M7 1 26 DT H6 6.500 5.000 8.000 6.079 5.559 6.630 . 0 0 "[ . 1 .]" 1
551 1 26 DT H1' 1 26 DT Q2' 2.560 2.050 3.070 2.258 2.223 2.308 . 0 0 "[ . 1 .]" 1
552 1 26 DT H1' 1 26 DT H3' 4.000 3.200 4.800 3.959 3.892 4.028 . 0 0 "[ . 1 .]" 1
553 1 26 DT H1' 1 26 DT H4' 3.050 2.440 3.660 3.359 2.951 3.743 0.083 8 0 "[ . 1 .]" 1
554 1 26 DT H1' 1 26 DT H6 3.520 2.820 4.220 3.589 3.436 3.728 . 0 0 "[ . 1 .]" 1
555 1 26 DT Q2' 1 26 DT H3' 2.750 2.200 3.300 2.251 2.225 2.293 . 0 0 "[ . 1 .]" 1
556 1 26 DT Q2' 1 26 DT H6 3.600 2.880 4.320 3.230 2.527 3.660 0.353 12 0 "[ . 1 .]" 1
557 1 26 DT Q2' 1 26 DT M7 5.270 4.220 6.320 4.437 3.961 4.742 0.259 7 0 "[ . 1 .]" 1
558 1 26 DT H3' 1 26 DT H4' 2.940 2.350 3.530 2.837 2.651 3.002 . 0 0 "[ . 1 .]" 1
559 1 26 DT H3' 1 26 DT H5' 2.920 2.330 3.510 2.702 2.465 3.020 . 0 0 "[ . 1 .]" 1
560 1 26 DT H3' 1 26 DT H5'' 2.500 . 3.000 2.562 2.191 2.820 . 0 0 "[ . 1 .]" 1
561 1 26 DT H3' 1 26 DT H6 3.570 2.860 4.280 3.788 2.844 4.425 0.145 8 0 "[ . 1 .]" 1
562 1 26 DT H4' 1 26 DT H5' 2.630 2.100 3.160 2.405 2.230 2.618 . 0 0 "[ . 1 .]" 1
563 1 26 DT H4' 1 26 DT H5'' 2.770 2.220 3.320 2.998 2.939 3.021 . 0 0 "[ . 1 .]" 1
564 1 26 DT H4' 1 26 DT H6 4.550 3.640 5.460 4.105 3.748 4.486 . 0 0 "[ . 1 .]" 1
565 1 26 DT H5' 1 26 DT H6 3.980 3.180 4.780 4.067 3.604 4.730 . 0 0 "[ . 1 .]" 1
566 1 26 DT H5'' 1 26 DT H6 2.810 2.250 3.370 2.704 2.220 3.419 0.049 14 0 "[ . 1 .]" 1
567 1 26 DT H6 1 26 DT M7 3.000 2.400 3.600 2.364 2.281 2.373 0.119 12 0 "[ . 1 .]" 1
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Contact the webmaster for help, if required. Tuesday, April 30, 2024 6:21:45 PM GMT (wattos1)