NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
647081 |
6k84   |
36263 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6k84
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 793
_Distance_constraint_stats_list.Viol_count 908
_Distance_constraint_stats_list.Viol_total 2764.300
_Distance_constraint_stats_list.Viol_max 1.904
_Distance_constraint_stats_list.Viol_rms 0.1682
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0349
_Distance_constraint_stats_list.Viol_average_violations_only 0.3044
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 G 7.011 0.653 7 2 "[ . + -]"
1 2 G 30.864 1.868 9 10 [********+-]
1 3 A 23.548 1.306 9 10 [***-****+*]
1 4 G 6.694 0.688 5 2 "[ + - 1]"
1 5 G 16.846 1.904 7 10 [******+*-*]
1 6 A 19.839 1.683 4 9 "[** +**-***]"
1 7 G 7.164 0.332 9 0 "[ . 1]"
1 8 G 18.986 1.904 7 9 "[*** **+*-*]"
1 9 A 11.966 0.633 10 6 "[ *-.* **+]"
1 10 G 5.510 0.445 7 0 "[ . 1]"
1 11 G 52.733 1.868 9 10 [-*******+*]
1 12 A 27.229 1.041 6 10 [*****+*-**]
1 13 A 42.766 1.839 6 10 [*-***+****]
1 14 G 9.624 0.986 6 8 "[* ***+ **-]"
1 15 G 17.657 1.538 2 10 [*+*******-]
1 16 A 7.865 0.309 1 0 "[ . 1]"
1 17 G 6.236 0.916 3 2 "[ + .- 1]"
1 18 G 9.200 1.543 9 7 "[** *- *+*]"
1 19 A 17.475 1.846 3 10 [*-+*******]
1 20 G 1.827 0.390 7 0 "[ . 1]"
1 21 G 19.686 1.543 9 9 "[*** *-**+*]"
1 22 A 10.138 0.376 8 0 "[ . 1]"
1 23 G 10.833 0.466 10 0 "[ . 1]"
1 24 G 48.727 1.538 2 10 [*+-*******]
1 25 A 20.780 1.488 3 9 "[**+ *****-]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 G H1 1 1 G H1' 1.800 . 6.700 5.860 5.829 5.891 . 0 0 "[ . 1]" 1
2 1 1 G H1 1 1 G H21 1.800 . 5.700 2.117 2.065 2.150 . 0 0 "[ . 1]" 1
3 1 1 G H1 1 1 G H22 1.800 . 4.400 3.372 3.335 3.395 . 0 0 "[ . 1]" 1
4 1 1 G H1 1 2 G H1 1.800 . 5.300 4.031 3.818 4.301 . 0 0 "[ . 1]" 1
5 1 1 G H1 1 2 G H8 1.800 . 7.800 6.837 6.619 6.965 . 0 0 "[ . 1]" 1
6 1 1 G H1 1 3 A H61 1.800 . 6.600 6.532 6.344 6.640 0.040 9 0 "[ . 1]" 1
7 1 1 G H1 1 3 A H62 1.800 . 6.700 4.932 4.794 5.060 . 0 0 "[ . 1]" 1
8 1 1 G H1 1 4 G H8 1.800 . 7.800 6.120 5.912 6.302 . 0 0 "[ . 1]" 1
9 1 1 G H1 1 10 G H1 1.800 . 6.600 3.968 3.875 4.042 . 0 0 "[ . 1]" 1
10 1 1 G H1 1 20 G H1 1.800 . 6.400 3.115 3.012 3.267 . 0 0 "[ . 1]" 1
11 1 1 G H1 1 20 G H1' 1.800 . 7.000 7.073 7.014 7.170 0.170 10 0 "[ . 1]" 1
12 1 1 G H1 1 20 G H21 1.800 . 7.000 3.977 3.850 4.126 . 0 0 "[ . 1]" 1
13 1 1 G H1 1 23 G H8 1.800 . 7.000 6.156 5.895 6.366 . 0 0 "[ . 1]" 1
14 1 1 G H1' 1 1 G H3' 1.800 . 6.300 3.688 3.662 3.709 . 0 0 "[ . 1]" 1
15 1 1 G H1' 1 1 G H4' 1.800 . 5.700 3.081 2.833 3.245 . 0 0 "[ . 1]" 1
16 1 1 G H1' 1 1 G H5' 1.800 . 6.500 4.658 4.547 4.726 . 0 0 "[ . 1]" 1
17 1 1 G H1' 1 1 G H5'' 1.800 . 6.500 4.853 4.779 4.902 . 0 0 "[ . 1]" 1
18 1 1 G H1' 1 1 G H8 1.800 . 6.800 3.826 3.733 3.877 . 0 0 "[ . 1]" 1
19 1 1 G H1' 1 1 G HO2' 1.800 . 6.500 2.941 2.736 3.324 . 0 0 "[ . 1]" 1
20 1 1 G H1' 1 2 G Q5' 1.800 . 7.700 3.874 3.685 4.213 . 0 0 "[ . 1]" 1
21 1 1 G H1' 1 2 G H8 1.800 . 5.300 2.497 2.336 2.733 . 0 0 "[ . 1]" 1
22 1 1 G H1' 1 2 G HO2' 1.800 . 6.600 6.994 6.783 7.253 0.653 7 2 "[ . + -]" 1
23 1 1 G H1' 1 23 G H1' 1.800 . 6.200 3.919 3.777 4.038 . 0 0 "[ . 1]" 1
24 1 1 G H1' 1 23 G H8 1.800 . 7.700 4.922 4.739 5.150 . 0 0 "[ . 1]" 1
25 1 1 G H21 1 1 G H22 1.800 . 5.200 1.760 1.757 1.764 0.043 4 0 "[ . 1]" 1
26 1 1 G H21 1 3 A H61 1.800 . 6.900 6.158 6.002 6.296 . 0 0 "[ . 1]" 1
27 1 1 G H21 1 4 G H8 1.800 . 6.500 4.071 3.930 4.206 . 0 0 "[ . 1]" 1
28 1 1 G H21 1 5 G H8 1.800 . 6.600 5.725 5.334 6.061 . 0 0 "[ . 1]" 1
29 1 1 G H22 1 2 G H1 1.800 . 7.600 4.476 4.293 4.603 . 0 0 "[ . 1]" 1
30 1 1 G H22 1 2 G HO2' 1.800 . 7.800 7.109 6.870 7.699 . 0 0 "[ . 1]" 1
31 1 1 G H22 1 3 A H61 1.800 . 6.800 4.827 4.683 4.990 . 0 0 "[ . 1]" 1
32 1 1 G H22 1 3 A H62 1.800 . 7.900 3.127 2.979 3.287 . 0 0 "[ . 1]" 1
33 1 1 G H22 1 4 G H8 1.800 . 6.400 4.052 3.969 4.134 . 0 0 "[ . 1]" 1
34 1 1 G H22 1 20 G H1 1.800 . 7.700 4.670 4.474 5.019 . 0 0 "[ . 1]" 1
35 1 1 G H22 1 23 G H8 1.800 . 6.600 5.186 4.927 5.406 . 0 0 "[ . 1]" 1
36 1 1 G H3' 1 1 G H5' 1.800 . 5.300 3.666 3.640 3.687 . 0 0 "[ . 1]" 1
37 1 1 G H3' 1 1 G H5'' 1.800 . 5.300 2.490 2.423 2.594 . 0 0 "[ . 1]" 1
38 1 1 G H3' 1 1 G H8 1.800 . 6.900 4.711 4.646 4.751 . 0 0 "[ . 1]" 1
39 1 1 G H3' 1 2 G H8 1.800 . 7.500 4.364 4.235 4.577 . 0 0 "[ . 1]" 1
40 1 1 G H4' 1 1 G H5' 1.800 . 4.200 2.434 2.372 2.453 . 0 0 "[ . 1]" 1
41 1 1 G H4' 1 1 G H5'' 1.800 . 4.200 2.444 2.421 2.476 . 0 0 "[ . 1]" 1
42 1 1 G H4' 1 1 G H8 1.800 . 6.700 5.315 5.085 5.485 . 0 0 "[ . 1]" 1
43 1 1 G H4' 1 1 G HO2' 1.800 . 5.300 4.307 4.102 4.559 . 0 0 "[ . 1]" 1
44 1 1 G H4' 1 2 G H4' 1.800 . 6.800 6.022 5.037 6.711 . 0 0 "[ . 1]" 1
45 1 1 G H4' 1 2 G Q5' 1.800 . 6.800 3.406 2.478 4.048 . 0 0 "[ . 1]" 1
46 1 1 G H4' 1 2 G H8 1.800 . 6.400 4.596 3.811 5.255 . 0 0 "[ . 1]" 1
47 1 1 G H4' 1 3 A H2 1.800 . 7.000 4.839 4.511 5.026 . 0 0 "[ . 1]" 1
48 1 1 G H5' 1 1 G H8 1.800 . 6.900 5.130 4.655 5.779 . 0 0 "[ . 1]" 1
49 1 1 G H5' 1 1 G HO2' 1.800 . 5.600 5.785 5.720 5.837 0.237 8 0 "[ . 1]" 1
50 1 1 G H5' 1 2 G H8 1.800 . 7.000 6.610 6.122 7.015 0.015 10 0 "[ . 1]" 1
51 1 1 G H5'' 1 1 G H8 1.800 . 6.800 5.523 5.022 6.123 . 0 0 "[ . 1]" 1
52 1 1 G H5'' 1 1 G HO2' 1.800 . 5.700 5.063 4.933 5.210 . 0 0 "[ . 1]" 1
53 1 1 G H5'' 1 2 G H8 1.800 . 6.900 6.252 5.863 6.632 . 0 0 "[ . 1]" 1
54 1 1 G H8 1 1 G HO2' 1.800 . 6.300 4.456 4.108 4.675 . 0 0 "[ . 1]" 1
55 1 1 G H8 1 2 G H8 1.800 . 7.600 5.512 5.267 5.598 . 0 0 "[ . 1]" 1
56 1 1 G H8 1 10 G H1 1.800 . 7.000 5.681 5.489 5.932 . 0 0 "[ . 1]" 1
57 1 1 G H8 1 11 G H1 1.800 . 6.800 4.960 4.853 5.085 . 0 0 "[ . 1]" 1
58 1 1 G H8 1 11 G H21 1.800 . 6.400 3.942 3.800 4.017 . 0 0 "[ . 1]" 1
59 1 1 G H8 1 13 A H2 1.800 . 6.400 6.324 6.209 6.391 . 0 0 "[ . 1]" 1
60 1 1 G H8 1 23 G H1 1.800 . 7.700 6.059 5.899 6.308 . 0 0 "[ . 1]" 1
61 1 1 G H8 1 23 G H1' 1.800 . 6.700 3.202 2.976 3.404 . 0 0 "[ . 1]" 1
62 1 1 G HO2' 1 2 G H8 1.800 . 6.500 2.335 2.092 2.764 . 0 0 "[ . 1]" 1
63 1 1 G HO2' 1 23 G H1' 1.800 . 6.300 5.853 5.525 6.112 . 0 0 "[ . 1]" 1
64 1 2 G H1 1 2 G H1' 1.800 . 7.600 5.779 5.723 5.837 . 0 0 "[ . 1]" 1
65 1 2 G H1 1 2 G H21 1.800 . 6.300 2.329 2.301 2.375 . 0 0 "[ . 1]" 1
66 1 2 G H1 1 2 G H22 1.800 . 6.300 3.556 3.535 3.586 . 0 0 "[ . 1]" 1
67 1 2 G H1 1 4 G H8 1.800 . 6.700 5.618 5.388 5.834 . 0 0 "[ . 1]" 1
68 1 2 G H1 1 5 G H1 1.800 . 5.500 4.616 4.541 4.681 . 0 0 "[ . 1]" 1
69 1 2 G H1 1 5 G H8 1.800 . 7.900 4.153 4.039 4.231 . 0 0 "[ . 1]" 1
70 1 2 G H1' 1 2 G H3' 1.800 . 6.400 3.798 3.731 3.858 . 0 0 "[ . 1]" 1
71 1 2 G H1' 1 2 G H4' 1.800 . 6.400 3.300 3.150 3.449 . 0 0 "[ . 1]" 1
72 1 2 G H1' 1 2 G Q5' 1.800 . 6.300 4.148 4.109 4.207 . 0 0 "[ . 1]" 1
73 1 2 G H1' 1 2 G H8 1.800 . 6.800 3.915 3.900 3.939 . 0 0 "[ . 1]" 1
74 1 2 G H1' 1 2 G HO2' 1.800 . 5.500 2.664 2.405 3.443 . 0 0 "[ . 1]" 1
75 1 2 G H1' 1 3 A H5'' 1.800 . 5.600 2.848 2.183 4.650 . 0 0 "[ . 1]" 1
76 1 2 G H1' 1 3 A H8 1.800 . 7.600 3.540 3.097 4.044 . 0 0 "[ . 1]" 1
77 1 2 G H1' 1 22 A H2 1.800 . 8.100 8.090 7.953 8.191 0.091 10 0 "[ . 1]" 1
78 1 2 G H21 1 4 G H1 1.800 . 6.900 5.168 4.874 5.653 . 0 0 "[ . 1]" 1
79 1 2 G H3' 1 2 G H4' 1.800 . 4.100 2.784 2.759 2.818 . 0 0 "[ . 1]" 1
80 1 2 G H3' 1 2 G Q5' 1.800 . 5.200 2.732 2.627 2.789 . 0 0 "[ . 1]" 1
81 1 2 G H3' 1 2 G H8 1.800 . 6.600 4.404 4.172 4.550 . 0 0 "[ . 1]" 1
82 1 2 G H3' 1 2 G HO2' 1.800 . 3.900 2.994 2.793 3.295 . 0 0 "[ . 1]" 1
83 1 2 G H4' 1 2 G Q5' 1.800 . 4.000 2.153 2.133 2.182 . 0 0 "[ . 1]" 1
84 1 2 G H4' 1 2 G H8 1.800 . 6.600 4.912 4.745 5.061 . 0 0 "[ . 1]" 1
85 1 2 G H4' 1 3 A H2 1.800 . 5.500 4.668 4.269 5.201 . 0 0 "[ . 1]" 1
86 1 2 G H5' 1 2 G H5'' 1.800 . 5.400 1.783 1.777 1.793 0.023 1 0 "[ . 1]" 1
87 1 2 G Q5' 1 2 G H8 1.800 . 6.800 3.658 3.295 3.930 . 0 0 "[ . 1]" 1
88 1 2 G Q5' 1 2 G HO2' 1.800 . 6.500 4.949 4.899 5.037 . 0 0 "[ . 1]" 1
89 1 2 G Q5' 1 3 A H1' 1.800 . 7.700 5.307 5.057 6.090 . 0 0 "[ . 1]" 1
90 1 2 G Q5' 1 3 A H2 1.800 . 6.500 3.498 3.135 4.010 . 0 0 "[ . 1]" 1
91 1 2 G Q5' 1 3 A HO2' 1.800 . 6.700 7.738 7.610 8.006 1.306 9 10 [*-******+*] 1
92 1 2 G Q5' 1 4 G H8 1.800 . 7.900 7.456 7.379 7.629 . 0 0 "[ . 1]" 1
93 1 2 G H8 1 2 G HO2' 1.800 . 5.200 4.759 4.535 4.958 . 0 0 "[ . 1]" 1
94 1 2 G H8 1 3 A H61 1.800 . 6.600 5.273 5.101 5.461 . 0 0 "[ . 1]" 1
95 1 2 G H8 1 11 G H1 1.800 . 7.500 5.497 5.355 5.663 . 0 0 "[ . 1]" 1
96 1 2 G H8 1 11 G H21 1.800 . 6.300 3.443 3.300 3.588 . 0 0 "[ . 1]" 1
97 1 2 G HO2' 1 11 G H1 1.800 . 7.000 8.607 8.439 8.868 1.868 9 10 [*-******+*] 1
98 1 3 A H1' 1 3 A H3' 1.800 . 5.200 3.719 3.618 3.880 . 0 0 "[ . 1]" 1
99 1 3 A H1' 1 3 A H4' 1.800 . 5.400 3.502 3.330 3.705 . 0 0 "[ . 1]" 1
100 1 3 A H1' 1 3 A H5'' 1.800 . 6.500 4.698 4.417 5.108 . 0 0 "[ . 1]" 1
101 1 3 A H1' 1 3 A H8 1.800 . 6.300 3.675 3.358 3.772 . 0 0 "[ . 1]" 1
102 1 3 A H1' 1 3 A HO2' 1.800 . 5.300 3.495 3.418 3.560 . 0 0 "[ . 1]" 1
103 1 3 A H1' 1 21 G H8 1.800 . 6.500 6.271 5.797 6.602 0.102 4 0 "[ . 1]" 1
104 1 3 A H1' 1 22 A H2 1.800 . 5.600 2.550 2.324 3.407 . 0 0 "[ . 1]" 1
105 1 3 A H1' 1 23 G H8 1.800 . 7.000 7.240 7.151 7.338 0.338 5 0 "[ . 1]" 1
106 1 3 A H2 1 22 A H1' 1.800 . 5.500 2.462 2.297 2.714 . 0 0 "[ . 1]" 1
107 1 3 A H2 1 22 A H61 1.800 . 6.500 6.653 6.580 6.689 0.189 3 0 "[ . 1]" 1
108 1 3 A H2 1 22 A H8 1.800 . 6.500 4.632 4.097 4.989 . 0 0 "[ . 1]" 1
109 1 3 A H2 1 23 G H4' 1.800 . 6.300 6.116 5.420 6.325 0.025 1 0 "[ . 1]" 1
110 1 3 A H3' 1 3 A H4' 1.800 . 4.500 3.026 2.985 3.045 . 0 0 "[ . 1]" 1
111 1 3 A H3' 1 3 A H5'' 1.800 . 5.300 2.305 2.148 2.981 . 0 0 "[ . 1]" 1
112 1 3 A H3' 1 3 A H8 1.800 . 4.300 2.320 2.112 3.261 . 0 0 "[ . 1]" 1
113 1 3 A H3' 1 3 A HO2' 1.800 . 5.300 3.498 3.353 3.598 . 0 0 "[ . 1]" 1
114 1 3 A H3' 1 4 G H4' 1.800 . 6.500 5.472 4.893 6.096 . 0 0 "[ . 1]" 1
115 1 3 A H3' 1 4 G Q5' 1.800 . 5.700 3.544 2.702 4.408 . 0 0 "[ . 1]" 1
116 1 3 A H3' 1 22 A H2 1.800 . 6.800 6.095 5.881 6.428 . 0 0 "[ . 1]" 1
117 1 3 A H4' 1 3 A H5'' 1.800 . 4.000 2.860 2.290 3.004 . 0 0 "[ . 1]" 1
118 1 3 A H4' 1 4 G H8 1.800 . 5.300 5.290 5.181 5.351 0.051 7 0 "[ . 1]" 1
119 1 3 A H4' 1 22 A H2 1.800 . 6.600 5.057 4.803 5.245 . 0 0 "[ . 1]" 1
120 1 3 A H5' 1 22 A H2 1.800 . 6.900 6.870 5.710 7.139 0.239 7 0 "[ . 1]" 1
121 1 3 A H5'' 1 3 A HO2' 1.800 . 4.500 4.891 4.448 5.032 0.532 5 3 "[ -+ *]" 1
122 1 3 A H5'' 1 4 G H4' 1.800 . 6.800 6.829 6.496 6.976 0.176 9 0 "[ . 1]" 1
123 1 3 A H5'' 1 4 G H8 1.800 . 6.400 5.395 4.864 6.529 0.129 9 0 "[ . 1]" 1
124 1 3 A H5'' 1 22 A H2 1.800 . 6.700 6.836 6.773 6.938 0.238 2 0 "[ . 1]" 1
125 1 3 A H61 1 21 G H1 1.800 . 6.200 6.309 6.273 6.358 0.158 5 0 "[ . 1]" 1
126 1 3 A H61 1 22 A H8 1.800 . 6.800 3.578 3.364 3.991 . 0 0 "[ . 1]" 1
127 1 3 A H61 1 23 G H8 1.800 . 6.400 2.288 2.209 2.479 . 0 0 "[ . 1]" 1
128 1 3 A HO2' 1 22 A H2 1.800 . 6.900 4.854 4.145 6.247 . 0 0 "[ . 1]" 1
129 1 4 G H1 1 4 G H21 1.800 . 5.300 2.252 2.217 2.294 . 0 0 "[ . 1]" 1
130 1 4 G H1 1 4 G H22 1.800 . 6.300 3.487 3.450 3.514 . 0 0 "[ . 1]" 1
131 1 4 G H1 1 5 G H1 1.800 . 6.400 4.611 4.222 4.946 . 0 0 "[ . 1]" 1
132 1 4 G H1 1 5 G H1' 1.800 . 6.900 5.265 4.362 5.653 . 0 0 "[ . 1]" 1
133 1 4 G H1 1 7 G H1 1.800 . 5.500 4.380 4.265 4.477 . 0 0 "[ . 1]" 1
134 1 4 G H1 1 7 G H1' 1.800 . 6.700 6.833 6.742 6.940 0.240 1 0 "[ . 1]" 1
135 1 4 G H1 1 7 G H8 1.800 . 6.500 4.795 4.639 5.018 . 0 0 "[ . 1]" 1
136 1 4 G H1 1 17 G H1 1.800 . 6.300 3.347 3.252 3.474 . 0 0 "[ . 1]" 1
137 1 4 G H1 1 20 G H1 1.800 . 5.700 5.204 4.979 5.437 . 0 0 "[ . 1]" 1
138 1 4 G H1' 1 4 G H3' 1.800 . 6.400 3.795 3.754 3.840 . 0 0 "[ . 1]" 1
139 1 4 G H1' 1 4 G H4' 1.800 . 5.200 3.668 3.599 3.753 . 0 0 "[ . 1]" 1
140 1 4 G H1' 1 4 G Q5' 1.800 . 5.300 4.018 3.944 4.068 . 0 0 "[ . 1]" 1
141 1 4 G H1' 1 4 G H8 1.800 . 6.400 3.176 3.063 3.394 . 0 0 "[ . 1]" 1
142 1 4 G H1' 1 4 G HO2' 1.800 . 5.300 3.102 2.406 3.439 . 0 0 "[ . 1]" 1
143 1 4 G H1' 1 5 G H8 1.800 . 7.600 5.068 4.858 5.266 . 0 0 "[ . 1]" 1
144 1 4 G H1' 1 19 A HO2' 1.800 . 7.500 3.991 2.149 7.093 . 0 0 "[ . 1]" 1
145 1 4 G H21 1 4 G H22 1.800 . 6.300 1.761 1.754 1.767 0.046 7 0 "[ . 1]" 1
146 1 4 G H21 1 5 G H1 1.800 . 6.500 5.416 5.115 5.705 . 0 0 "[ . 1]" 1
147 1 4 G H21 1 7 G H8 1.800 . 6.700 2.939 2.778 3.169 . 0 0 "[ . 1]" 1
148 1 4 G H3' 1 4 G H8 1.800 . 6.800 4.371 3.987 4.550 . 0 0 "[ . 1]" 1
149 1 4 G H3' 1 4 G HO2' 1.800 . 4.100 3.618 3.361 4.077 . 0 0 "[ . 1]" 1
150 1 4 G H3' 1 5 G H8 1.800 . 5.500 2.046 1.913 2.273 . 0 0 "[ . 1]" 1
151 1 4 G H4' 1 4 G H8 1.800 . 6.900 4.441 4.308 4.582 . 0 0 "[ . 1]" 1
152 1 4 G H4' 1 4 G HO2' 1.800 . 5.300 3.458 2.839 3.892 . 0 0 "[ . 1]" 1
153 1 4 G Q5' 1 4 G H8 1.800 . 5.600 2.873 2.323 3.145 . 0 0 "[ . 1]" 1
154 1 4 G Q5' 1 4 G HO2' 1.800 . 4.300 4.631 4.311 4.988 0.688 5 2 "[ + - 1]" 1
155 1 4 G Q5' 1 5 G H1' 1.800 . 5.400 5.200 4.825 5.471 0.071 4 0 "[ . 1]" 1
156 1 4 G H8 1 4 G HO2' 1.800 . 6.200 5.794 5.109 6.052 . 0 0 "[ . 1]" 1
157 1 4 G H8 1 5 G H8 1.800 . 5.300 4.717 4.440 4.947 . 0 0 "[ . 1]" 1
158 1 4 G H8 1 20 G H1 1.800 . 7.600 6.689 6.344 7.049 . 0 0 "[ . 1]" 1
159 1 4 G H8 1 22 A H2 1.800 . 6.800 6.630 6.359 6.839 0.039 9 0 "[ . 1]" 1
160 1 4 G H8 1 22 A H61 1.800 . 6.700 3.449 2.976 4.110 . 0 0 "[ . 1]" 1
161 1 4 G HO2' 1 5 G H8 1.800 . 5.600 5.444 5.133 5.885 0.285 5 0 "[ . 1]" 1
162 1 5 G H1 1 5 G H1' 1.800 . 6.700 6.432 6.218 6.643 . 0 0 "[ . 1]" 1
163 1 5 G H1 1 5 G H21 1.800 . 5.600 2.240 2.189 2.292 . 0 0 "[ . 1]" 1
164 1 5 G H1 1 5 G H22 1.800 . 6.300 3.476 3.438 3.504 . 0 0 "[ . 1]" 1
165 1 5 G H1 1 7 G H8 1.800 . 6.500 5.968 5.732 6.174 . 0 0 "[ . 1]" 1
166 1 5 G H1 1 8 G H8 1.800 . 7.700 4.710 4.465 4.928 . 0 0 "[ . 1]" 1
167 1 5 G H1 1 8 G HO2' 1.800 . 6.700 8.116 6.750 8.604 1.904 7 9 "[*** **+*-*]" 1
168 1 5 G H1' 1 5 G H3' 1.800 . 5.700 3.793 3.707 3.844 . 0 0 "[ . 1]" 1
169 1 5 G H1' 1 5 G H5' 1.800 . 6.800 4.863 4.779 4.966 . 0 0 "[ . 1]" 1
170 1 5 G H1' 1 5 G H5'' 1.800 . 7.500 4.424 4.369 4.456 . 0 0 "[ . 1]" 1
171 1 5 G H1' 1 5 G H8 1.800 . 6.900 3.422 2.976 3.670 . 0 0 "[ . 1]" 1
172 1 5 G H1' 1 5 G HO2' 1.800 . 5.500 2.923 2.611 3.457 . 0 0 "[ . 1]" 1
173 1 5 G H1' 1 6 A H5' 1.800 . 5.700 4.323 3.790 5.091 . 0 0 "[ . 1]" 1
174 1 5 G H21 1 8 G H8 1.800 . 6.800 2.846 2.623 3.019 . 0 0 "[ . 1]" 1
175 1 5 G H3' 1 5 G H8 1.800 . 6.400 5.447 5.280 5.710 . 0 0 "[ . 1]" 1
176 1 5 G H4' 1 6 A H2 1.800 . 6.700 3.922 3.328 6.708 0.008 6 0 "[ . 1]" 1
177 1 5 G H5' 1 5 G H8 1.800 . 6.700 5.449 5.163 5.762 . 0 0 "[ . 1]" 1
178 1 5 G H5' 1 6 A H2 1.800 . 6.700 5.907 5.510 6.604 . 0 0 "[ . 1]" 1
179 1 5 G H5'' 1 6 A H2 1.800 . 7.600 6.015 5.445 6.626 . 0 0 "[ . 1]" 1
180 1 5 G H8 1 5 G HO2' 1.800 . 5.300 5.272 4.833 5.939 0.639 4 3 "[ +.* -1]" 1
181 1 6 A H1' 1 6 A H2 1.800 . 5.600 5.792 5.647 6.012 0.412 3 0 "[ . 1]" 1
182 1 6 A H1' 1 6 A H3' 1.800 . 5.600 3.884 3.547 3.983 . 0 0 "[ . 1]" 1
183 1 6 A H1' 1 6 A H4' 1.800 . 4.200 3.667 3.117 3.774 . 0 0 "[ . 1]" 1
184 1 6 A H1' 1 6 A H5' 1.800 . 5.600 4.444 4.010 5.129 . 0 0 "[ . 1]" 1
185 1 6 A H1' 1 6 A H5'' 1.800 . 5.400 4.562 4.190 4.996 . 0 0 "[ . 1]" 1
186 1 6 A H1' 1 6 A H8 1.800 . 4.300 2.805 2.111 3.106 . 0 0 "[ . 1]" 1
187 1 6 A H1' 1 6 A HO2' 1.800 . 4.400 2.818 2.371 3.425 . 0 0 "[ . 1]" 1
188 1 6 A H2 1 6 A H3' 1.800 . 6.300 5.747 5.627 6.198 . 0 0 "[ . 1]" 1
189 1 6 A H2 1 6 A H4' 1.800 . 7.000 7.140 6.677 7.272 0.272 8 0 "[ . 1]" 1
190 1 6 A H2 1 6 A H5' 1.800 . 6.500 5.229 3.955 6.554 0.054 6 0 "[ . 1]" 1
191 1 6 A H2 1 6 A H5'' 1.800 . 6.900 5.632 4.720 6.268 . 0 0 "[ . 1]" 1
192 1 6 A H2 1 6 A HO2' 1.800 . 6.500 5.593 4.465 6.659 0.159 3 0 "[ . 1]" 1
193 1 6 A H3' 1 6 A H8 1.800 . 5.300 5.587 5.530 5.628 0.328 6 0 "[ . 1]" 1
194 1 6 A H3' 1 6 A HO2' 1.800 . 4.100 2.986 2.729 3.736 . 0 0 "[ . 1]" 1
195 1 6 A H4' 1 6 A H8 1.800 . 4.400 4.403 4.248 4.748 0.348 3 0 "[ . 1]" 1
196 1 6 A H4' 1 6 A HO2' 1.800 . 5.300 4.488 4.254 5.199 . 0 0 "[ . 1]" 1
197 1 6 A H5' 1 6 A H8 1.800 . 5.300 4.665 4.046 5.348 0.048 3 0 "[ . 1]" 1
198 1 6 A H5' 1 6 A HO2' 1.800 . 5.500 4.939 4.437 5.748 0.248 6 0 "[ . 1]" 1
199 1 6 A H5'' 1 6 A HO2' 1.800 . 5.500 5.251 4.217 5.878 0.378 3 0 "[ . 1]" 1
200 1 6 A H8 1 6 A HO2' 1.800 . 4.300 5.380 4.223 5.983 1.683 4 9 "[** +**-***]" 1
201 1 6 A HO2' 1 17 G H1' 1.800 . 6.900 4.876 3.266 6.697 . 0 0 "[ . 1]" 1
202 1 7 G H1 1 7 G H1' 1.800 . 6.500 5.763 5.623 5.941 . 0 0 "[ . 1]" 1
203 1 7 G H1 1 7 G H21 1.800 . 5.200 2.357 2.326 2.394 . 0 0 "[ . 1]" 1
204 1 7 G H1 1 7 G H22 1.800 . 6.300 3.530 3.499 3.554 . 0 0 "[ . 1]" 1
205 1 7 G H1 1 8 G H1 1.800 . 6.400 3.934 3.765 4.061 . 0 0 "[ . 1]" 1
206 1 7 G H1 1 8 G H1' 1.800 . 7.700 7.409 6.854 7.691 . 0 0 "[ . 1]" 1
207 1 7 G H1 1 9 A H61 1.800 . 6.600 6.475 6.119 6.630 0.030 2 0 "[ . 1]" 1
208 1 7 G H1 1 9 A H8 1.800 . 6.700 6.536 6.192 6.769 0.069 9 0 "[ . 1]" 1
209 1 7 G H1 1 10 G H1 1.800 . 6.600 3.622 3.378 3.841 . 0 0 "[ . 1]" 1
210 1 7 G H1 1 10 G H8 1.800 . 6.900 5.685 5.459 5.966 . 0 0 "[ . 1]" 1
211 1 7 G H1 1 11 G H1 1.800 . 5.300 5.531 5.450 5.632 0.332 9 0 "[ . 1]" 1
212 1 7 G H1 1 14 G H1 1.800 . 5.200 4.419 4.196 4.608 . 0 0 "[ . 1]" 1
213 1 7 G H1 1 14 G H1' 1.800 . 7.600 7.658 7.568 7.778 0.178 5 0 "[ . 1]" 1
214 1 7 G H1 1 14 G H21 1.800 . 6.600 5.159 4.849 5.422 . 0 0 "[ . 1]" 1
215 1 7 G H1 1 17 G H8 1.800 . 7.600 7.012 6.693 7.365 . 0 0 "[ . 1]" 1
216 1 7 G H1' 1 7 G H3' 1.800 . 5.700 3.730 3.619 3.845 . 0 0 "[ . 1]" 1
217 1 7 G H1' 1 7 G H8 1.800 . 6.600 3.812 3.660 3.912 . 0 0 "[ . 1]" 1
218 1 7 G H1' 1 7 G HO2' 1.800 . 5.500 2.979 2.633 3.430 . 0 0 "[ . 1]" 1
219 1 7 G H1' 1 8 G H5' 1.800 . 6.800 4.655 4.150 5.372 . 0 0 "[ . 1]" 1
220 1 7 G H1' 1 8 G H5'' 1.800 . 6.800 5.981 5.487 6.578 . 0 0 "[ . 1]" 1
221 1 7 G H1' 1 8 G H8 1.800 . 5.600 4.259 3.144 5.119 . 0 0 "[ . 1]" 1
222 1 7 G H1' 1 14 G H1 1.800 . 7.500 7.544 7.378 7.646 0.146 7 0 "[ . 1]" 1
223 1 7 G H21 1 7 G H22 1.800 . 5.600 1.735 1.731 1.738 0.069 10 0 "[ . 1]" 1
224 1 7 G H21 1 8 G H1 1.800 . 7.900 3.579 3.459 3.772 . 0 0 "[ . 1]" 1
225 1 7 G H21 1 9 A H61 1.800 . 6.900 5.518 5.290 5.675 . 0 0 "[ . 1]" 1
226 1 7 G H21 1 9 A H62 1.800 . 7.600 3.814 3.556 3.970 . 0 0 "[ . 1]" 1
227 1 7 G H21 1 9 A H8 1.800 . 6.900 4.216 3.909 4.436 . 0 0 "[ . 1]" 1
228 1 7 G H21 1 10 G H4' 1.800 . 7.000 7.147 7.089 7.204 0.204 5 0 "[ . 1]" 1
229 1 7 G H21 1 10 G H8 1.800 . 5.400 3.495 3.279 3.750 . 0 0 "[ . 1]" 1
230 1 7 G H21 1 14 G H1 1.800 . 6.900 4.780 4.480 5.087 . 0 0 "[ . 1]" 1
231 1 7 G H22 1 10 G H8 1.800 . 5.700 3.869 3.712 4.040 . 0 0 "[ . 1]" 1
232 1 7 G H3' 1 7 G H8 1.800 . 6.400 5.083 4.860 5.261 . 0 0 "[ . 1]" 1
233 1 7 G H3' 1 7 G HO2' 1.800 . 4.500 2.917 2.631 3.874 . 0 0 "[ . 1]" 1
234 1 7 G H4' 1 7 G H8 1.800 . 6.800 5.042 4.746 5.327 . 0 0 "[ . 1]" 1
235 1 7 G H4' 1 9 A H2 1.800 . 6.300 5.444 3.922 6.181 . 0 0 "[ . 1]" 1
236 1 7 G H5' 1 7 G H8 1.800 . 7.600 4.493 4.296 5.047 . 0 0 "[ . 1]" 1
237 1 7 G H5'' 1 7 G H8 1.800 . 7.500 5.454 5.127 5.640 . 0 0 "[ . 1]" 1
238 1 7 G H8 1 7 G HO2' 1.800 . 5.600 5.136 4.626 5.621 0.021 2 0 "[ . 1]" 1
239 1 7 G HO2' 1 8 G H5' 1.800 . 6.900 4.353 3.051 5.029 . 0 0 "[ . 1]" 1
240 1 7 G HO2' 1 8 G H8 1.800 . 6.500 2.804 2.265 3.235 . 0 0 "[ . 1]" 1
241 1 8 G H1 1 8 G H1' 1.800 . 7.000 5.971 5.887 6.015 . 0 0 "[ . 1]" 1
242 1 8 G H1 1 8 G H21 1.800 . 5.500 2.133 2.093 2.182 . 0 0 "[ . 1]" 1
243 1 8 G H1 1 8 G H22 1.800 . 5.500 3.392 3.361 3.426 . 0 0 "[ . 1]" 1
244 1 8 G H1 1 10 G H1 1.800 . 7.700 4.528 4.217 4.794 . 0 0 "[ . 1]" 1
245 1 8 G H1 1 10 G H3' 1.800 . 7.800 5.352 5.042 5.830 . 0 0 "[ . 1]" 1
246 1 8 G H1 1 10 G H4' 1.800 . 6.500 6.736 6.655 6.801 0.301 7 0 "[ . 1]" 1
247 1 8 G H1 1 10 G H8 1.800 . 6.700 5.042 4.543 5.374 . 0 0 "[ . 1]" 1
248 1 8 G H1 1 11 G H8 1.800 . 6.700 4.841 4.573 5.103 . 0 0 "[ . 1]" 1
249 1 8 G H1' 1 8 G H3' 1.800 . 6.300 3.799 3.745 3.844 . 0 0 "[ . 1]" 1
250 1 8 G H1' 1 8 G H4' 1.800 . 5.600 3.246 3.017 3.447 . 0 0 "[ . 1]" 1
251 1 8 G H1' 1 8 G H5' 1.800 . 6.200 4.691 4.619 4.819 . 0 0 "[ . 1]" 1
252 1 8 G H1' 1 8 G H8 1.800 . 7.000 3.864 3.827 3.877 . 0 0 "[ . 1]" 1
253 1 8 G H1' 1 8 G HO2' 1.800 . 5.400 2.706 2.294 3.394 . 0 0 "[ . 1]" 1
254 1 8 G H1' 1 9 A H1' 1.800 . 7.000 6.073 5.823 6.440 . 0 0 "[ . 1]" 1
255 1 8 G H1' 1 9 A H2 1.800 . 7.800 7.155 6.656 7.764 . 0 0 "[ . 1]" 1
256 1 8 G H1' 1 9 A H3' 1.800 . 6.600 3.689 3.379 4.129 . 0 0 "[ . 1]" 1
257 1 8 G H1' 1 9 A H4' 1.800 . 5.600 5.268 4.928 5.440 . 0 0 "[ . 1]" 1
258 1 8 G H1' 1 9 A Q5' 1.800 . 5.500 2.255 2.010 2.445 . 0 0 "[ . 1]" 1
259 1 8 G H1' 1 9 A H8 1.800 . 6.900 3.607 3.444 3.945 . 0 0 "[ . 1]" 1
260 1 8 G H1' 1 10 G H8 1.800 . 7.900 5.656 5.232 6.079 . 0 0 "[ . 1]" 1
261 1 8 G H21 1 10 G H8 1.800 . 6.800 4.453 4.190 4.729 . 0 0 "[ . 1]" 1
262 1 8 G H21 1 11 G H8 1.800 . 6.200 3.316 3.101 3.442 . 0 0 "[ . 1]" 1
263 1 8 G H22 1 10 G H8 1.800 . 6.600 3.880 3.610 4.116 . 0 0 "[ . 1]" 1
264 1 8 G H22 1 11 G H8 1.800 . 6.200 4.364 4.230 4.475 . 0 0 "[ . 1]" 1
265 1 8 G H3' 1 8 G H5' 1.800 . 4.400 3.669 3.570 3.730 . 0 0 "[ . 1]" 1
266 1 8 G H3' 1 8 G H5'' 1.800 . 5.500 2.497 2.304 2.635 . 0 0 "[ . 1]" 1
267 1 8 G H3' 1 8 G H8 1.800 . 5.500 4.368 4.201 4.521 . 0 0 "[ . 1]" 1
268 1 8 G H3' 1 8 G HO2' 1.800 . 3.700 3.067 2.814 3.771 0.071 4 0 "[ . 1]" 1
269 1 8 G H4' 1 8 G H5' 1.800 . 4.000 2.407 2.315 2.487 . 0 0 "[ . 1]" 1
270 1 8 G H4' 1 8 G H5'' 1.800 . 4.000 2.441 2.365 2.511 . 0 0 "[ . 1]" 1
271 1 8 G H4' 1 8 G H8 1.800 . 7.600 4.894 4.706 5.173 . 0 0 "[ . 1]" 1
272 1 8 G H5' 1 8 G H8 1.800 . 7.600 4.344 3.926 5.019 . 0 0 "[ . 1]" 1
273 1 8 G H5' 1 8 G HO2' 1.800 . 6.300 5.832 5.754 5.963 . 0 0 "[ . 1]" 1
274 1 8 G H5' 1 9 A H2 1.800 . 6.600 3.593 3.190 4.005 . 0 0 "[ . 1]" 1
275 1 8 G H5' 1 9 A H8 1.800 . 8.000 5.800 5.272 6.412 . 0 0 "[ . 1]" 1
276 1 8 G H5'' 1 8 G H8 1.800 . 7.900 4.787 4.449 5.257 . 0 0 "[ . 1]" 1
277 1 8 G H5'' 1 8 G HO2' 1.800 . 6.500 5.277 5.152 5.745 . 0 0 "[ . 1]" 1
278 1 8 G H5'' 1 9 A H2 1.800 . 7.500 4.816 4.472 5.212 . 0 0 "[ . 1]" 1
279 1 8 G H8 1 8 G HO2' 1.800 . 4.400 4.554 3.561 4.820 0.420 8 0 "[ . 1]" 1
280 1 9 A H1' 1 9 A H3' 1.800 . 5.500 3.890 3.842 3.948 . 0 0 "[ . 1]" 1
281 1 9 A H1' 1 9 A H4' 1.800 . 5.400 3.599 3.428 3.698 . 0 0 "[ . 1]" 1
282 1 9 A H1' 1 9 A Q5' 1.800 . 6.500 4.224 4.124 4.338 . 0 0 "[ . 1]" 1
283 1 9 A H1' 1 9 A H8 1.800 . 6.400 3.739 3.683 3.812 . 0 0 "[ . 1]" 1
284 1 9 A H1' 1 10 G H8 1.800 . 6.700 4.849 4.598 5.473 . 0 0 "[ . 1]" 1
285 1 9 A H1' 1 16 A H1' 1.800 . 5.600 4.395 3.945 5.128 . 0 0 "[ . 1]" 1
286 1 9 A H1' 1 16 A H2 1.800 . 5.400 2.584 2.382 2.850 . 0 0 "[ . 1]" 1
287 1 9 A H2 1 16 A H1' 1.800 . 5.500 2.106 1.913 2.348 . 0 0 "[ . 1]" 1
288 1 9 A H2 1 16 A H3' 1.800 . 6.700 4.976 4.783 5.264 . 0 0 "[ . 1]" 1
289 1 9 A H2 1 16 A H4' 1.800 . 5.400 5.520 5.462 5.603 0.203 5 0 "[ . 1]" 1
290 1 9 A H2 1 16 A H5' 1.800 . 6.600 6.770 6.651 6.853 0.253 1 0 "[ . 1]" 1
291 1 9 A H2 1 16 A H5'' 1.800 . 6.500 5.803 5.698 5.910 . 0 0 "[ . 1]" 1
292 1 9 A H2 1 17 G H8 1.800 . 7.600 6.134 5.508 6.487 . 0 0 "[ . 1]" 1
293 1 9 A H3' 1 9 A H4' 1.800 . 4.000 2.947 2.923 2.970 . 0 0 "[ . 1]" 1
294 1 9 A H3' 1 9 A Q5' 1.800 . 5.300 2.183 2.088 2.232 . 0 0 "[ . 1]" 1
295 1 9 A H3' 1 9 A H8 1.800 . 4.400 2.126 2.026 2.245 . 0 0 "[ . 1]" 1
296 1 9 A H3' 1 9 A HO2' 1.800 . 5.300 3.450 3.318 3.531 . 0 0 "[ . 1]" 1
297 1 9 A H3' 1 10 G H3' 1.800 . 6.400 5.830 4.971 6.226 . 0 0 "[ . 1]" 1
298 1 9 A H3' 1 10 G H4' 1.800 . 5.500 4.486 3.395 5.213 . 0 0 "[ . 1]" 1
299 1 9 A H3' 1 10 G H8 1.800 . 6.600 3.945 3.275 4.218 . 0 0 "[ . 1]" 1
300 1 9 A H3' 1 16 A H2 1.800 . 6.800 5.858 5.360 6.127 . 0 0 "[ . 1]" 1
301 1 9 A H4' 1 9 A Q5' 1.800 . 3.900 2.326 2.305 2.373 . 0 0 "[ . 1]" 1
302 1 9 A H4' 1 9 A H8 1.800 . 4.300 4.566 4.447 4.606 0.306 8 0 "[ . 1]" 1
303 1 9 A H4' 1 16 A H2 1.800 . 5.400 5.534 5.474 5.603 0.203 5 0 "[ . 1]" 1
304 1 9 A Q5' 1 9 A H8 1.800 . 6.700 3.106 2.653 3.318 . 0 0 "[ . 1]" 1
305 1 9 A Q5' 1 9 A HO2' 1.800 . 4.100 4.589 4.317 4.733 0.633 10 6 "[ *-.* **+]" 1
306 1 9 A H61 1 17 G H8 1.800 . 6.400 4.540 3.260 5.406 . 0 0 "[ . 1]" 1
307 1 9 A H8 1 9 A HO2' 1.800 . 6.400 4.467 4.395 4.626 . 0 0 "[ . 1]" 1
308 1 9 A H8 1 10 G H3' 1.800 . 6.500 6.072 5.368 6.493 . 0 0 "[ . 1]" 1
309 1 9 A H8 1 10 G H4' 1.800 . 6.400 4.885 4.680 5.088 . 0 0 "[ . 1]" 1
310 1 9 A H8 1 10 G H8 1.800 . 5.600 2.363 2.190 2.492 . 0 0 "[ . 1]" 1
311 1 9 A H8 1 16 A H2 1.800 . 6.500 5.590 4.983 5.883 . 0 0 "[ . 1]" 1
312 1 9 A H8 1 16 A H61 1.800 . 6.600 4.432 4.021 4.743 . 0 0 "[ . 1]" 1
313 1 10 G H1 1 10 G H1' 1.800 . 6.900 6.718 6.313 6.894 . 0 0 "[ . 1]" 1
314 1 10 G H1 1 10 G H21 1.800 . 7.700 2.178 2.150 2.206 . 0 0 "[ . 1]" 1
315 1 10 G H1 1 11 G H1 1.800 . 6.500 4.194 3.924 4.484 . 0 0 "[ . 1]" 1
316 1 10 G H1 1 11 G H1' 1.800 . 8.000 7.263 6.960 7.535 . 0 0 "[ . 1]" 1
317 1 10 G H1 1 14 G H1 1.800 . 6.300 4.537 4.344 4.813 . 0 0 "[ . 1]" 1
318 1 10 G H1 1 14 G H8 1.800 . 7.500 5.469 5.256 5.807 . 0 0 "[ . 1]" 1
319 1 10 G H1 1 23 G H1 1.800 . 6.300 3.114 2.904 3.277 . 0 0 "[ . 1]" 1
320 1 10 G H1' 1 10 G H3' 1.800 . 5.400 3.798 3.734 3.843 . 0 0 "[ . 1]" 1
321 1 10 G H1' 1 10 G H4' 1.800 . 5.600 2.324 2.092 2.517 . 0 0 "[ . 1]" 1
322 1 10 G H1' 1 10 G H5' 1.800 . 5.400 4.558 4.164 4.737 . 0 0 "[ . 1]" 1
323 1 10 G H1' 1 10 G H5'' 1.800 . 5.700 4.556 4.472 4.652 . 0 0 "[ . 1]" 1
324 1 10 G H1' 1 10 G H8 1.800 . 6.800 2.981 2.783 3.267 . 0 0 "[ . 1]" 1
325 1 10 G H1' 1 10 G HO2' 1.800 . 5.700 2.610 2.145 2.853 . 0 0 "[ . 1]" 1
326 1 10 G H1' 1 11 G H8 1.800 . 6.300 5.142 4.770 5.304 . 0 0 "[ . 1]" 1
327 1 10 G H1' 1 13 A H1' 1.800 . 6.800 4.808 4.574 5.055 . 0 0 "[ . 1]" 1
328 1 10 G H1' 1 13 A H8 1.800 . 8.000 4.571 4.250 4.782 . 0 0 "[ . 1]" 1
329 1 10 G H1' 1 14 G H3' 1.800 . 5.700 5.412 5.117 5.669 . 0 0 "[ . 1]" 1
330 1 10 G H1' 1 14 G H4' 1.800 . 6.300 3.085 2.580 3.400 . 0 0 "[ . 1]" 1
331 1 10 G H1' 1 14 G H8 1.800 . 6.600 4.418 3.713 4.880 . 0 0 "[ . 1]" 1
332 1 10 G H1' 1 14 G HO2' 1.800 . 6.400 5.713 5.271 6.070 . 0 0 "[ . 1]" 1
333 1 10 G H3' 1 10 G H4' 1.800 . 3.700 2.998 2.980 3.013 . 0 0 "[ . 1]" 1
334 1 10 G H3' 1 10 G H5' 1.800 . 4.100 3.021 2.619 3.754 . 0 0 "[ . 1]" 1
335 1 10 G H3' 1 10 G H5'' 1.800 . 3.700 2.499 2.329 2.846 . 0 0 "[ . 1]" 1
336 1 10 G H3' 1 10 G H8 1.800 . 6.500 5.397 4.981 5.630 . 0 0 "[ . 1]" 1
337 1 10 G H3' 1 10 G HO2' 1.800 . 4.000 3.667 3.219 4.019 0.019 3 0 "[ . 1]" 1
338 1 10 G H3' 1 11 G H8 1.800 . 5.200 2.396 2.028 3.444 . 0 0 "[ . 1]" 1
339 1 10 G H4' 1 10 G H8 1.800 . 5.600 4.158 4.097 4.292 . 0 0 "[ . 1]" 1
340 1 10 G H4' 1 10 G HO2' 1.800 . 4.300 3.627 2.569 4.479 0.179 2 0 "[ . 1]" 1
341 1 10 G H4' 1 11 G H8 1.800 . 6.500 5.128 4.924 5.455 . 0 0 "[ . 1]" 1
342 1 10 G H4' 1 14 G H5' 1.800 . 5.300 4.298 3.328 5.245 . 0 0 "[ . 1]" 1
343 1 10 G H5' 1 10 G H8 1.800 . 7.600 5.621 4.559 6.038 . 0 0 "[ . 1]" 1
344 1 10 G H5'' 1 10 G HO2' 1.800 . 5.500 5.382 4.377 5.945 0.445 7 0 "[ . 1]" 1
345 1 10 G H8 1 10 G HO2' 1.800 . 6.200 5.140 4.793 5.633 . 0 0 "[ . 1]" 1
346 1 10 G H8 1 11 G H8 1.800 . 7.700 6.634 6.427 6.799 . 0 0 "[ . 1]" 1
347 1 10 G H8 1 14 G H1 1.800 . 6.800 6.269 5.969 6.520 . 0 0 "[ . 1]" 1
348 1 10 G H8 1 14 G H1' 1.800 . 7.700 3.881 3.564 4.231 . 0 0 "[ . 1]" 1
349 1 10 G H8 1 16 A H1' 1.800 . 7.600 7.406 7.046 7.629 0.029 8 0 "[ . 1]" 1
350 1 10 G H8 1 16 A H2 1.800 . 6.500 5.731 5.504 5.924 . 0 0 "[ . 1]" 1
351 1 10 G H8 1 16 A H61 1.800 . 6.400 2.797 2.662 2.959 . 0 0 "[ . 1]" 1
352 1 10 G HO2' 1 11 G H8 1.800 . 5.700 4.119 2.879 5.023 . 0 0 "[ . 1]" 1
353 1 10 G HO2' 1 14 G H8 1.800 . 7.800 3.619 2.655 4.867 . 0 0 "[ . 1]" 1
354 1 11 G H1 1 11 G H21 1.800 . 5.500 2.246 2.209 2.281 . 0 0 "[ . 1]" 1
355 1 11 G H1 1 11 G H22 1.800 . 5.600 3.478 3.452 3.503 . 0 0 "[ . 1]" 1
356 1 11 G H1' 1 11 G H3' 1.800 . 6.600 3.948 3.892 3.981 . 0 0 "[ . 1]" 1
357 1 11 G H1' 1 11 G H4' 1.800 . 5.700 3.137 3.011 3.295 . 0 0 "[ . 1]" 1
358 1 11 G H1' 1 11 G H5' 1.800 . 6.400 4.336 4.261 4.414 . 0 0 "[ . 1]" 1
359 1 11 G H1' 1 11 G H5'' 1.800 . 6.500 4.968 4.925 5.044 . 0 0 "[ . 1]" 1
360 1 11 G H1' 1 11 G H8 1.800 . 5.700 3.882 3.851 3.904 . 0 0 "[ . 1]" 1
361 1 11 G H1' 1 11 G HO2' 1.800 . 5.400 2.906 2.829 2.971 . 0 0 "[ . 1]" 1
362 1 11 G H1' 1 12 A H2 1.800 . 7.000 3.789 3.642 3.945 . 0 0 "[ . 1]" 1
363 1 11 G H1' 1 12 A H4' 1.800 . 6.800 6.545 6.428 6.731 . 0 0 "[ . 1]" 1
364 1 11 G H1' 1 12 A H8 1.800 . 7.700 5.359 5.154 5.549 . 0 0 "[ . 1]" 1
365 1 11 G H1' 1 13 A H1' 1.800 . 8.000 5.889 5.775 6.036 . 0 0 "[ . 1]" 1
366 1 11 G H1' 1 13 A H2 1.800 . 6.700 6.748 6.691 6.819 0.119 7 0 "[ . 1]" 1
367 1 11 G H1' 1 13 A H8 1.800 . 6.500 4.090 3.919 4.238 . 0 0 "[ . 1]" 1
368 1 11 G H1' 1 13 A HO2' 1.800 . 6.400 8.094 7.860 8.239 1.839 6 10 [-****+****] 1
369 1 11 G H3' 1 11 G H4' 1.800 . 4.100 2.819 2.776 2.847 . 0 0 "[ . 1]" 1
370 1 11 G H3' 1 11 G H5' 1.800 . 5.600 3.443 3.420 3.460 . 0 0 "[ . 1]" 1
371 1 11 G H3' 1 11 G H5'' 1.800 . 4.000 2.814 2.617 2.933 . 0 0 "[ . 1]" 1
372 1 11 G H3' 1 11 G H8 1.800 . 6.500 3.603 3.439 3.812 . 0 0 "[ . 1]" 1
373 1 11 G H3' 1 11 G HO2' 1.800 . 3.900 3.310 3.023 3.909 0.009 2 0 "[ . 1]" 1
374 1 11 G H3' 1 12 A H2 1.800 . 7.000 7.055 6.964 7.098 0.098 7 0 "[ . 1]" 1
375 1 11 G H3' 1 12 A H8 1.800 . 6.500 4.864 4.816 4.959 . 0 0 "[ . 1]" 1
376 1 11 G H3' 1 13 A H1' 1.800 . 6.600 5.494 5.362 5.628 . 0 0 "[ . 1]" 1
377 1 11 G H3' 1 13 A H8 1.800 . 6.500 4.944 4.860 5.023 . 0 0 "[ . 1]" 1
378 1 11 G H3' 1 13 A HO2' 1.800 . 7.100 8.106 7.808 8.299 1.199 6 10 [-****+****] 1
379 1 11 G H4' 1 11 G H5' 1.800 . 4.300 2.538 2.485 2.588 . 0 0 "[ . 1]" 1
380 1 11 G H4' 1 11 G H8 1.800 . 6.500 4.479 4.346 4.587 . 0 0 "[ . 1]" 1
381 1 11 G H4' 1 12 A H2 1.800 . 6.700 4.792 4.690 4.910 . 0 0 "[ . 1]" 1
382 1 11 G H4' 1 12 A H8 1.800 . 6.900 4.134 4.015 4.217 . 0 0 "[ . 1]" 1
383 1 11 G H4' 1 13 A H1' 1.800 . 6.700 4.003 3.863 4.169 . 0 0 "[ . 1]" 1
384 1 11 G H4' 1 13 A H8 1.800 . 6.800 3.706 3.604 3.860 . 0 0 "[ . 1]" 1
385 1 11 G H5' 1 12 A H2 1.800 . 7.500 6.169 6.089 6.248 . 0 0 "[ . 1]" 1
386 1 11 G H5' 1 12 A H8 1.800 . 6.300 6.570 6.539 6.600 0.300 8 0 "[ . 1]" 1
387 1 11 G H5' 1 13 A H1' 1.800 . 6.900 2.113 2.011 2.248 . 0 0 "[ . 1]" 1
388 1 11 G H5' 1 13 A H2 1.800 . 6.700 6.774 6.726 6.823 0.123 7 0 "[ . 1]" 1
389 1 11 G H5' 1 13 A HO2' 1.800 . 7.000 4.701 4.405 4.889 . 0 0 "[ . 1]" 1
390 1 11 G H5'' 1 11 G H8 1.800 . 6.700 4.380 4.129 4.567 . 0 0 "[ . 1]" 1
391 1 11 G H5'' 1 12 A H1' 1.800 . 7.600 5.557 5.354 5.873 . 0 0 "[ . 1]" 1
392 1 11 G H5'' 1 12 A H2 1.800 . 6.800 6.874 6.771 6.945 0.145 8 0 "[ . 1]" 1
393 1 11 G H5'' 1 12 A H8 1.800 . 6.800 5.651 5.608 5.698 . 0 0 "[ . 1]" 1
394 1 11 G H5'' 1 13 A H1' 1.800 . 6.800 3.112 2.892 3.299 . 0 0 "[ . 1]" 1
395 1 11 G H5'' 1 13 A H2 1.800 . 7.000 7.205 7.126 7.292 0.292 9 0 "[ . 1]" 1
396 1 11 G H5'' 1 13 A H8 1.800 . 7.600 3.822 3.768 3.911 . 0 0 "[ . 1]" 1
397 1 11 G H5'' 1 13 A HO2' 1.800 . 6.800 5.634 5.395 5.936 . 0 0 "[ . 1]" 1
398 1 11 G H8 1 11 G HO2' 1.800 . 5.300 4.787 4.249 5.127 . 0 0 "[ . 1]" 1
399 1 11 G HO2' 1 13 A H8 1.800 . 6.600 6.257 6.123 6.368 . 0 0 "[ . 1]" 1
400 1 12 A H1' 1 12 A H2 1.800 . 6.600 4.490 4.444 4.526 . 0 0 "[ . 1]" 1
401 1 12 A H1' 1 12 A H3' 1.800 . 5.500 3.921 3.905 3.938 . 0 0 "[ . 1]" 1
402 1 12 A H1' 1 12 A H4' 1.800 . 5.300 3.544 3.507 3.606 . 0 0 "[ . 1]" 1
403 1 12 A H1' 1 12 A Q5' 1.800 . 6.600 4.248 4.209 4.269 . 0 0 "[ . 1]" 1
404 1 12 A H1' 1 12 A H8 1.800 . 5.400 3.872 3.859 3.889 . 0 0 "[ . 1]" 1
405 1 12 A H1' 1 12 A HO2' 1.800 . 5.300 2.340 2.280 2.670 . 0 0 "[ . 1]" 1
406 1 12 A H1' 1 13 A H2 1.800 . 6.500 3.724 3.158 3.911 . 0 0 "[ . 1]" 1
407 1 12 A H1' 1 13 A H3' 1.800 . 7.500 6.210 5.998 6.388 . 0 0 "[ . 1]" 1
408 1 12 A H1' 1 13 A H5' 1.800 . 6.600 4.065 3.946 4.232 . 0 0 "[ . 1]" 1
409 1 12 A H1' 1 13 A H8 1.800 . 6.900 6.638 6.474 6.766 . 0 0 "[ . 1]" 1
410 1 12 A H1' 1 13 A HO2' 1.800 . 7.000 7.839 7.705 8.041 1.041 6 10 [*-***+****] 1
411 1 12 A H2 1 12 A H3' 1.800 . 7.800 8.043 8.015 8.070 0.270 9 0 "[ . 1]" 1
412 1 12 A H2 1 12 A H4' 1.800 . 7.500 6.889 6.739 6.946 . 0 0 "[ . 1]" 1
413 1 12 A H2 1 12 A HO2' 1.800 . 6.800 6.680 6.523 7.072 0.272 8 0 "[ . 1]" 1
414 1 12 A H2 1 13 A H1' 1.800 . 7.800 6.632 6.522 6.741 . 0 0 "[ . 1]" 1
415 1 12 A H2 1 13 A H5' 1.800 . 6.200 6.280 6.199 6.397 0.197 8 0 "[ . 1]" 1
416 1 12 A H2 1 13 A H5'' 1.800 . 6.300 5.567 5.437 5.928 . 0 0 "[ . 1]" 1
417 1 12 A H2 1 24 G H1' 1.800 . 7.100 5.104 4.851 5.304 . 0 0 "[ . 1]" 1
418 1 12 A H3' 1 12 A Q5' 1.800 . 4.200 2.610 2.553 2.643 . 0 0 "[ . 1]" 1
419 1 12 A H3' 1 12 A H8 1.800 . 5.600 3.754 3.601 4.017 . 0 0 "[ . 1]" 1
420 1 12 A H4' 1 12 A H8 1.800 . 6.200 4.833 4.722 4.925 . 0 0 "[ . 1]" 1
421 1 12 A H4' 1 12 A HO2' 1.800 . 4.100 4.126 4.047 4.232 0.132 6 0 "[ . 1]" 1
422 1 12 A H4' 1 13 A H1' 1.800 . 6.600 4.593 4.355 4.810 . 0 0 "[ . 1]" 1
423 1 12 A H4' 1 13 A H8 1.800 . 6.700 5.983 5.728 6.093 . 0 0 "[ . 1]" 1
424 1 12 A Q5' 1 12 A H8 1.800 . 6.500 3.726 3.640 3.797 . 0 0 "[ . 1]" 1
425 1 12 A Q5' 1 12 A HO2' 1.800 . 4.200 4.976 4.862 5.019 0.819 9 10 [*******-+*] 1
426 1 12 A Q5' 1 13 A H8 1.800 . 6.600 5.129 5.046 5.160 . 0 0 "[ . 1]" 1
427 1 12 A H8 1 12 A HO2' 1.800 . 4.400 4.636 4.586 4.706 0.306 8 0 "[ . 1]" 1
428 1 12 A H8 1 13 A H8 1.800 . 7.700 7.775 7.719 7.837 0.137 9 0 "[ . 1]" 1
429 1 13 A H1' 1 13 A H2 1.800 . 7.100 6.176 6.156 6.203 . 0 0 "[ . 1]" 1
430 1 13 A H1' 1 13 A H3' 1.800 . 6.800 3.901 3.860 3.957 . 0 0 "[ . 1]" 1
431 1 13 A H1' 1 13 A H4' 1.800 . 5.400 3.568 3.510 3.657 . 0 0 "[ . 1]" 1
432 1 13 A H1' 1 13 A H5' 1.800 . 6.200 4.484 4.362 4.570 . 0 0 "[ . 1]" 1
433 1 13 A H1' 1 13 A H5'' 1.800 . 6.700 4.266 4.155 4.331 . 0 0 "[ . 1]" 1
434 1 13 A H1' 1 13 A H8 1.800 . 5.400 2.522 2.486 2.544 . 0 0 "[ . 1]" 1
435 1 13 A H1' 1 13 A HO2' 1.800 . 5.500 2.617 2.378 2.696 . 0 0 "[ . 1]" 1
436 1 13 A H1' 1 14 G H8 1.800 . 6.900 3.876 3.528 4.306 . 0 0 "[ . 1]" 1
437 1 13 A H1' 1 24 G H1' 1.800 . 7.400 7.096 6.767 7.365 . 0 0 "[ . 1]" 1
438 1 13 A H2 1 13 A H3' 1.800 . 6.800 5.297 5.011 5.461 . 0 0 "[ . 1]" 1
439 1 13 A H2 1 13 A H4' 1.800 . 6.200 6.121 6.029 6.209 0.009 4 0 "[ . 1]" 1
440 1 13 A H2 1 13 A HO2' 1.800 . 6.600 6.610 6.536 6.673 0.073 8 0 "[ . 1]" 1
441 1 13 A H2 1 23 G HO2' 1.800 . 5.500 4.259 4.064 4.421 . 0 0 "[ . 1]" 1
442 1 13 A H2 1 24 G H8 1.800 . 6.500 6.656 6.614 6.708 0.208 9 0 "[ . 1]" 1
443 1 13 A H3' 1 13 A H4' 1.800 . 4.200 2.717 2.693 2.763 . 0 0 "[ . 1]" 1
444 1 13 A H3' 1 13 A H5' 1.800 . 4.300 2.318 2.167 2.456 . 0 0 "[ . 1]" 1
445 1 13 A H3' 1 13 A H5'' 1.800 . 4.300 3.570 3.444 3.662 . 0 0 "[ . 1]" 1
446 1 13 A H3' 1 13 A H8 1.800 . 6.500 6.023 5.942 6.066 . 0 0 "[ . 1]" 1
447 1 13 A H3' 1 13 A HO2' 1.800 . 5.500 3.150 3.083 3.347 . 0 0 "[ . 1]" 1
448 1 13 A H4' 1 13 A H5' 1.800 . 4.000 2.971 2.935 2.995 . 0 0 "[ . 1]" 1
449 1 13 A H4' 1 13 A H5'' 1.800 . 3.800 2.787 2.764 2.819 . 0 0 "[ . 1]" 1
450 1 13 A H4' 1 13 A H8 1.800 . 6.400 5.780 5.732 5.854 . 0 0 "[ . 1]" 1
451 1 13 A H4' 1 13 A HO2' 1.800 . 5.400 4.464 4.326 4.540 . 0 0 "[ . 1]" 1
452 1 13 A H5' 1 13 A H8 1.800 . 6.900 6.023 5.852 6.118 . 0 0 "[ . 1]" 1
453 1 13 A H5' 1 13 A HO2' 1.800 . 5.500 4.755 4.593 4.905 . 0 0 "[ . 1]" 1
454 1 13 A H5'' 1 13 A H8 1.800 . 6.800 5.510 5.259 5.641 . 0 0 "[ . 1]" 1
455 1 13 A H5'' 1 13 A HO2' 1.800 . 5.500 5.449 5.356 5.500 0.000 2 0 "[ . 1]" 1
456 1 13 A H8 1 13 A HO2' 1.800 . 4.400 4.353 4.089 4.547 0.147 5 0 "[ . 1]" 1
457 1 13 A H8 1 24 G H1' 1.800 . 8.500 6.708 6.365 6.998 . 0 0 "[ . 1]" 1
458 1 13 A HO2' 1 24 G H1' 1.800 . 6.700 6.608 6.244 6.889 0.189 9 0 "[ . 1]" 1
459 1 14 G H1 1 14 G H1' 1.800 . 6.800 5.830 5.744 5.897 . 0 0 "[ . 1]" 1
460 1 14 G H1 1 14 G H21 1.800 . 4.400 2.193 2.163 2.207 . 0 0 "[ . 1]" 1
461 1 14 G H1 1 14 G H22 1.800 . 5.500 3.430 3.402 3.447 . 0 0 "[ . 1]" 1
462 1 14 G H1 1 15 G H1 1.800 . 6.200 3.938 3.744 4.190 . 0 0 "[ . 1]" 1
463 1 14 G H1 1 15 G H8 1.800 . 7.900 5.531 5.037 5.773 . 0 0 "[ . 1]" 1
464 1 14 G H1 1 16 A H61 1.800 . 6.500 6.544 6.497 6.609 0.109 6 0 "[ . 1]" 1
465 1 14 G H1 1 16 A H62 1.800 . 8.000 4.869 4.829 4.936 . 0 0 "[ . 1]" 1
466 1 14 G H1 1 17 G H8 1.800 . 7.800 5.496 5.334 5.633 . 0 0 "[ . 1]" 1
467 1 14 G H1 1 24 G H1 1.800 . 7.600 4.867 4.666 5.114 . 0 0 "[ . 1]" 1
468 1 14 G H1' 1 14 G H3' 1.800 . 6.600 3.746 3.662 3.851 . 0 0 "[ . 1]" 1
469 1 14 G H1' 1 14 G H4' 1.800 . 5.700 2.969 2.806 3.174 . 0 0 "[ . 1]" 1
470 1 14 G H1' 1 14 G H5' 1.800 . 6.800 4.593 4.531 4.915 . 0 0 "[ . 1]" 1
471 1 14 G H1' 1 14 G H5'' 1.800 . 6.500 4.795 4.410 4.900 . 0 0 "[ . 1]" 1
472 1 14 G H1' 1 14 G H8 1.800 . 6.400 3.872 3.840 3.893 . 0 0 "[ . 1]" 1
473 1 14 G H1' 1 14 G HO2' 1.800 . 6.500 2.574 2.408 2.751 . 0 0 "[ . 1]" 1
474 1 14 G H1' 1 15 G H5' 1.800 . 7.000 3.337 2.828 4.717 . 0 0 "[ . 1]" 1
475 1 14 G H1' 1 15 G H5'' 1.800 . 6.800 4.788 4.393 5.178 . 0 0 "[ . 1]" 1
476 1 14 G H1' 1 15 G H8 1.800 . 5.200 4.321 4.166 4.583 . 0 0 "[ . 1]" 1
477 1 14 G H1' 1 15 G HO2' 1.800 . 7.500 7.490 7.251 7.776 0.276 6 0 "[ . 1]" 1
478 1 14 G H21 1 14 G H22 1.800 . 4.400 1.753 1.750 1.756 0.050 5 0 "[ . 1]" 1
479 1 14 G H21 1 15 G H1 1.800 . 7.900 4.871 4.638 5.097 . 0 0 "[ . 1]" 1
480 1 14 G H21 1 16 A H61 1.800 . 6.600 5.771 5.613 5.843 . 0 0 "[ . 1]" 1
481 1 14 G H21 1 16 A H62 1.800 . 7.900 4.033 3.882 4.119 . 0 0 "[ . 1]" 1
482 1 14 G H21 1 17 G H8 1.800 . 6.600 3.630 3.467 3.772 . 0 0 "[ . 1]" 1
483 1 14 G H22 1 16 A H61 1.800 . 6.900 4.176 3.976 4.273 . 0 0 "[ . 1]" 1
484 1 14 G H22 1 17 G H8 1.800 . 6.500 4.243 4.093 4.376 . 0 0 "[ . 1]" 1
485 1 14 G H3' 1 14 G H4' 1.800 . 4.400 2.832 2.774 2.880 . 0 0 "[ . 1]" 1
486 1 14 G H3' 1 14 G H5' 1.800 . 5.300 3.543 2.510 3.690 . 0 0 "[ . 1]" 1
487 1 14 G H3' 1 14 G H5'' 1.800 . 4.400 2.780 2.533 2.935 . 0 0 "[ . 1]" 1
488 1 14 G H3' 1 14 G H8 1.800 . 6.300 4.835 4.671 4.966 . 0 0 "[ . 1]" 1
489 1 14 G H3' 1 14 G HO2' 1.800 . 4.400 3.140 3.037 3.354 . 0 0 "[ . 1]" 1
490 1 14 G H4' 1 14 G H5' 1.800 . 4.500 2.544 2.393 2.612 . 0 0 "[ . 1]" 1
491 1 14 G H4' 1 14 G H5'' 1.800 . 4.400 2.336 2.209 3.046 . 0 0 "[ . 1]" 1
492 1 14 G H4' 1 14 G H8 1.800 . 6.900 4.900 4.746 5.008 . 0 0 "[ . 1]" 1
493 1 14 G H4' 1 15 G H8 1.800 . 7.800 6.487 6.352 6.581 . 0 0 "[ . 1]" 1
494 1 14 G H5' 1 14 G H8 1.800 . 6.700 4.336 4.063 4.997 . 0 0 "[ . 1]" 1
495 1 14 G H5'' 1 14 G H8 1.800 . 6.600 5.226 3.500 5.589 . 0 0 "[ . 1]" 1
496 1 14 G H8 1 14 G HO2' 1.800 . 5.500 5.103 4.913 5.299 . 0 0 "[ . 1]" 1
497 1 14 G H8 1 15 G H8 1.800 . 6.600 5.335 5.073 5.645 . 0 0 "[ . 1]" 1
498 1 14 G H8 1 23 G H1 1.800 . 7.900 5.134 4.921 5.501 . 0 0 "[ . 1]" 1
499 1 14 G H8 1 24 G H1 1.800 . 6.300 5.784 5.519 6.021 . 0 0 "[ . 1]" 1
500 1 14 G H8 1 24 G H1' 1.800 . 6.700 5.695 5.484 5.993 . 0 0 "[ . 1]" 1
501 1 14 G H8 1 24 G H21 1.800 . 5.500 4.289 4.048 4.468 . 0 0 "[ . 1]" 1
502 1 14 G HO2' 1 15 G H8 1.800 . 6.800 2.682 2.391 2.938 . 0 0 "[ . 1]" 1
503 1 14 G HO2' 1 24 G H1 1.800 . 6.300 6.997 6.558 7.286 0.986 6 8 "[* ***+ **-]" 1
504 1 14 G HO2' 1 24 G H21 1.800 . 7.700 4.997 4.466 5.336 . 0 0 "[ . 1]" 1
505 1 15 G H1 1 15 G H1' 1.800 . 7.800 5.804 5.737 5.877 . 0 0 "[ . 1]" 1
506 1 15 G H1 1 15 G H21 1.800 . 6.300 2.274 2.251 2.292 . 0 0 "[ . 1]" 1
507 1 15 G H1 1 15 G H22 1.800 . 6.400 3.493 3.471 3.518 . 0 0 "[ . 1]" 1
508 1 15 G H1 1 17 G H8 1.800 . 6.800 6.793 6.670 6.927 0.127 6 0 "[ . 1]" 1
509 1 15 G H1 1 18 G H1 1.800 . 4.400 4.262 4.126 4.412 0.012 7 0 "[ . 1]" 1
510 1 15 G H1 1 18 G H8 1.800 . 7.800 5.039 4.606 5.370 . 0 0 "[ . 1]" 1
511 1 15 G H1 1 24 G H1 1.800 . 7.800 4.372 4.251 4.523 . 0 0 "[ . 1]" 1
512 1 15 G H1 1 25 A H2 1.800 . 8.000 5.964 4.911 6.714 . 0 0 "[ . 1]" 1
513 1 15 G H1' 1 15 G H3' 1.800 . 6.800 3.695 3.651 3.772 . 0 0 "[ . 1]" 1
514 1 15 G H1' 1 15 G H4' 1.800 . 5.600 2.982 2.798 3.096 . 0 0 "[ . 1]" 1
515 1 15 G H1' 1 15 G H5' 1.800 . 6.300 4.574 4.491 4.752 . 0 0 "[ . 1]" 1
516 1 15 G H1' 1 15 G H5'' 1.800 . 6.900 4.800 4.500 4.890 . 0 0 "[ . 1]" 1
517 1 15 G H1' 1 15 G H8 1.800 . 6.700 3.895 3.847 3.924 . 0 0 "[ . 1]" 1
518 1 15 G H1' 1 15 G HO2' 1.800 . 5.600 2.846 2.572 3.436 . 0 0 "[ . 1]" 1
519 1 15 G H1' 1 16 A H1' 1.800 . 7.900 7.331 7.141 7.474 . 0 0 "[ . 1]" 1
520 1 15 G H1' 1 16 A H4' 1.800 . 6.300 6.090 5.818 6.444 0.144 5 0 "[ . 1]" 1
521 1 15 G H1' 1 16 A H5'' 1.800 . 5.500 3.404 3.221 3.582 . 0 0 "[ . 1]" 1
522 1 15 G H1' 1 16 A H8 1.800 . 6.900 5.147 4.825 5.414 . 0 0 "[ . 1]" 1
523 1 15 G H1' 1 25 A H2 1.800 . 8.100 5.818 5.129 6.588 . 0 0 "[ . 1]" 1
524 1 15 G H3' 1 15 G H4' 1.800 . 4.100 2.832 2.774 2.888 . 0 0 "[ . 1]" 1
525 1 15 G H3' 1 15 G H5' 1.800 . 4.300 3.540 2.705 3.653 . 0 0 "[ . 1]" 1
526 1 15 G H3' 1 15 G H5'' 1.800 . 5.400 2.568 2.303 2.706 . 0 0 "[ . 1]" 1
527 1 15 G H3' 1 15 G H8 1.800 . 6.300 4.680 4.504 4.902 . 0 0 "[ . 1]" 1
528 1 15 G H3' 1 15 G HO2' 1.800 . 3.600 2.954 2.794 3.038 . 0 0 "[ . 1]" 1
529 1 15 G H3' 1 16 A H2 1.800 . 6.400 6.409 6.209 6.478 0.078 1 0 "[ . 1]" 1
530 1 15 G H3' 1 25 A H2 1.800 . 8.000 6.876 5.854 8.009 0.009 10 0 "[ . 1]" 1
531 1 15 G H4' 1 15 G H5' 1.800 . 4.200 2.457 2.260 2.556 . 0 0 "[ . 1]" 1
532 1 15 G H4' 1 15 G H5'' 1.800 . 3.900 2.436 2.321 3.017 . 0 0 "[ . 1]" 1
533 1 15 G H4' 1 15 G H8 1.800 . 6.500 5.208 4.991 5.404 . 0 0 "[ . 1]" 1
534 1 15 G H4' 1 15 G HO2' 1.800 . 5.400 4.315 3.991 4.788 . 0 0 "[ . 1]" 1
535 1 15 G H5' 1 15 G H5'' 1.800 . 4.400 1.772 1.767 1.787 0.033 10 0 "[ . 1]" 1
536 1 15 G H5' 1 15 G H8 1.800 . 6.700 4.909 4.546 5.510 . 0 0 "[ . 1]" 1
537 1 15 G H5' 1 15 G HO2' 1.800 . 6.400 5.755 5.335 5.918 . 0 0 "[ . 1]" 1
538 1 15 G H5' 1 16 A H1' 1.800 . 6.900 6.459 5.943 6.926 0.026 2 0 "[ . 1]" 1
539 1 15 G H5' 1 16 A H2 1.800 . 6.400 3.891 3.626 4.149 . 0 0 "[ . 1]" 1
540 1 15 G H5' 1 17 G H8 1.800 . 7.800 7.700 7.414 7.928 0.128 5 0 "[ . 1]" 1
541 1 15 G H5'' 1 15 G H8 1.800 . 6.800 5.411 4.169 5.699 . 0 0 "[ . 1]" 1
542 1 15 G H5'' 1 15 G HO2' 1.800 . 6.400 5.249 4.906 5.399 . 0 0 "[ . 1]" 1
543 1 15 G H5'' 1 16 A H2 1.800 . 6.400 4.113 3.708 5.715 . 0 0 "[ . 1]" 1
544 1 15 G H8 1 15 G HO2' 1.800 . 4.300 4.599 4.003 5.115 0.815 5 3 "[ +* -]" 1
545 1 15 G H8 1 16 A H61 1.800 . 6.600 5.853 5.557 6.026 . 0 0 "[ . 1]" 1
546 1 15 G H8 1 24 G H1 1.800 . 6.300 4.785 4.714 4.983 . 0 0 "[ . 1]" 1
547 1 15 G H8 1 24 G H21 1.800 . 5.400 2.997 2.915 3.195 . 0 0 "[ . 1]" 1
548 1 15 G H8 1 25 A H2 1.800 . 6.500 3.918 3.147 4.726 . 0 0 "[ . 1]" 1
549 1 15 G HO2' 1 24 G H1 1.800 . 6.900 8.140 7.911 8.438 1.538 2 10 [*+*-******] 1
550 1 15 G HO2' 1 25 A H2 1.800 . 7.000 5.224 3.894 6.368 . 0 0 "[ . 1]" 1
551 1 16 A H1' 1 16 A H3' 1.800 . 5.200 4.002 3.958 4.061 . 0 0 "[ . 1]" 1
552 1 16 A H1' 1 16 A H4' 1.800 . 5.500 3.850 3.763 3.883 . 0 0 "[ . 1]" 1
553 1 16 A H1' 1 16 A H5'' 1.800 . 6.400 4.168 4.044 4.258 . 0 0 "[ . 1]" 1
554 1 16 A H1' 1 16 A H8 1.800 . 6.400 3.733 3.704 3.778 . 0 0 "[ . 1]" 1
555 1 16 A H1' 1 16 A HO2' 1.800 . 5.300 3.300 2.895 3.461 . 0 0 "[ . 1]" 1
556 1 16 A H3' 1 16 A H4' 1.800 . 4.300 2.858 2.838 2.893 . 0 0 "[ . 1]" 1
557 1 16 A H3' 1 16 A H5'' 1.800 . 5.300 2.520 2.397 2.868 . 0 0 "[ . 1]" 1
558 1 16 A H3' 1 16 A H8 1.800 . 4.300 2.551 2.395 2.797 . 0 0 "[ . 1]" 1
559 1 16 A H3' 1 16 A HO2' 1.800 . 5.300 3.343 3.178 3.494 . 0 0 "[ . 1]" 1
560 1 16 A H3' 1 17 G H4' 1.800 . 6.500 4.656 4.352 4.960 . 0 0 "[ . 1]" 1
561 1 16 A H4' 1 16 A H5'' 1.800 . 3.800 3.027 3.010 3.044 . 0 0 "[ . 1]" 1
562 1 16 A H4' 1 17 G H8 1.800 . 5.300 5.502 5.333 5.609 0.309 1 0 "[ . 1]" 1
563 1 16 A H5'' 1 16 A HO2' 1.800 . 5.200 5.123 4.895 5.344 0.144 4 0 "[ . 1]" 1
564 1 16 A H5'' 1 17 G H8 1.800 . 6.400 3.931 3.473 4.284 . 0 0 "[ . 1]" 1
565 1 16 A H61 1 16 A H62 1.800 . 5.700 1.775 1.771 1.778 0.029 6 0 "[ . 1]" 1
566 1 17 G H1 1 17 G H21 1.800 . 5.200 2.268 2.253 2.288 . 0 0 "[ . 1]" 1
567 1 17 G H1 1 17 G H22 1.800 . 6.400 3.478 3.465 3.493 . 0 0 "[ . 1]" 1
568 1 17 G H1 1 18 G H1 1.800 . 6.400 4.715 4.425 4.891 . 0 0 "[ . 1]" 1
569 1 17 G H1 1 18 G H1' 1.800 . 8.100 5.742 5.372 6.057 . 0 0 "[ . 1]" 1
570 1 17 G H1 1 20 G H1' 1.800 . 8.000 7.345 7.067 7.550 . 0 0 "[ . 1]" 1
571 1 17 G H1 1 20 G H8 1.800 . 7.800 5.754 5.380 6.127 . 0 0 "[ . 1]" 1
572 1 17 G H1' 1 17 G H3' 1.800 . 6.700 3.840 3.793 3.902 . 0 0 "[ . 1]" 1
573 1 17 G H1' 1 17 G H4' 1.800 . 5.200 3.515 3.051 3.636 . 0 0 "[ . 1]" 1
574 1 17 G H1' 1 17 G Q5' 1.800 . 5.300 4.131 4.068 4.198 . 0 0 "[ . 1]" 1
575 1 17 G H1' 1 17 G H8 1.800 . 6.400 3.604 3.532 3.748 . 0 0 "[ . 1]" 1
576 1 17 G H1' 1 17 G HO2' 1.800 . 5.300 3.209 2.303 3.438 . 0 0 "[ . 1]" 1
577 1 17 G H1' 1 18 G H8 1.800 . 6.700 5.036 4.752 5.396 . 0 0 "[ . 1]" 1
578 1 17 G H21 1 17 G H22 1.800 . 6.200 1.758 1.753 1.762 0.047 10 0 "[ . 1]" 1
579 1 17 G H21 1 20 G H8 1.800 . 6.600 3.740 3.389 4.062 . 0 0 "[ . 1]" 1
580 1 17 G H3' 1 17 G H8 1.800 . 6.900 3.747 3.322 3.961 . 0 0 "[ . 1]" 1
581 1 17 G H3' 1 17 G HO2' 1.800 . 4.500 3.542 3.344 4.125 . 0 0 "[ . 1]" 1
582 1 17 G H4' 1 17 G H8 1.800 . 6.800 4.371 4.221 4.665 . 0 0 "[ . 1]" 1
583 1 17 G H4' 1 17 G HO2' 1.800 . 5.300 3.197 2.722 4.106 . 0 0 "[ . 1]" 1
584 1 17 G Q5' 1 17 G H8 1.800 . 5.600 2.429 2.135 3.265 . 0 0 "[ . 1]" 1
585 1 17 G Q5' 1 17 G HO2' 1.800 . 4.200 4.515 4.243 5.116 0.916 3 2 "[ + .- 1]" 1
586 1 17 G H8 1 17 G HO2' 1.800 . 6.400 5.801 5.449 5.991 . 0 0 "[ . 1]" 1
587 1 17 G H8 1 18 G H8 1.800 . 7.900 5.774 5.444 6.006 . 0 0 "[ . 1]" 1
588 1 17 G HO2' 1 18 G H5'' 1.800 . 6.300 3.816 3.453 4.743 . 0 0 "[ . 1]" 1
589 1 17 G HO2' 1 18 G H8 1.800 . 5.700 4.295 3.063 5.442 . 0 0 "[ . 1]" 1
590 1 18 G H1 1 18 G H21 1.800 . 5.600 2.242 2.211 2.259 . 0 0 "[ . 1]" 1
591 1 18 G H1 1 18 G H22 1.800 . 5.700 3.477 3.454 3.487 . 0 0 "[ . 1]" 1
592 1 18 G H1 1 20 G H8 1.800 . 8.200 5.880 5.618 6.165 . 0 0 "[ . 1]" 1
593 1 18 G H1 1 21 G H1 1.800 . 5.400 4.438 4.310 4.566 . 0 0 "[ . 1]" 1
594 1 18 G H1 1 21 G H8 1.800 . 7.900 5.125 4.754 5.360 . 0 0 "[ . 1]" 1
595 1 18 G H1 1 21 G HO2' 1.800 . 7.000 7.729 7.323 8.543 1.543 9 7 "[** *- *+*]" 1
596 1 18 G H1' 1 18 G H3' 1.800 . 5.200 3.839 3.708 3.921 . 0 0 "[ . 1]" 1
597 1 18 G H1' 1 18 G H4' 1.800 . 6.700 3.430 3.234 3.651 . 0 0 "[ . 1]" 1
598 1 18 G H1' 1 18 G H5' 1.800 . 7.000 4.823 4.689 5.072 . 0 0 "[ . 1]" 1
599 1 18 G H1' 1 18 G H5'' 1.800 . 6.600 4.717 4.147 4.988 . 0 0 "[ . 1]" 1
600 1 18 G H1' 1 18 G H8 1.800 . 6.900 3.828 3.667 3.882 . 0 0 "[ . 1]" 1
601 1 18 G H1' 1 18 G HO2' 1.800 . 5.600 2.679 2.320 2.995 . 0 0 "[ . 1]" 1
602 1 18 G H1' 1 20 G HO2' 1.800 . 6.600 6.254 5.473 6.990 0.390 7 0 "[ . 1]" 1
603 1 18 G H21 1 21 G H8 1.800 . 6.500 3.188 2.896 3.457 . 0 0 "[ . 1]" 1
604 1 18 G H3' 1 18 G H8 1.800 . 6.400 4.762 4.230 4.985 . 0 0 "[ . 1]" 1
605 1 18 G H4' 1 19 A H2 1.800 . 6.800 4.660 3.211 6.888 0.088 5 0 "[ . 1]" 1
606 1 18 G H5' 1 19 A H2 1.800 . 7.700 5.404 3.898 6.677 . 0 0 "[ . 1]" 1
607 1 18 G H5'' 1 18 G H8 1.800 . 6.800 3.982 2.675 4.717 . 0 0 "[ . 1]" 1
608 1 18 G H5'' 1 18 G HO2' 1.800 . 5.200 5.034 4.647 5.395 0.195 8 0 "[ . 1]" 1
609 1 18 G H5'' 1 19 A H2 1.800 . 6.700 5.056 4.088 5.967 . 0 0 "[ . 1]" 1
610 1 18 G H8 1 18 G HO2' 1.800 . 5.300 5.347 5.016 5.699 0.399 7 0 "[ . 1]" 1
611 1 19 A H1' 1 19 A H2 1.800 . 5.600 5.625 5.507 5.816 0.216 4 0 "[ . 1]" 1
612 1 19 A H1' 1 19 A H3' 1.800 . 5.600 3.904 3.831 3.979 . 0 0 "[ . 1]" 1
613 1 19 A H1' 1 19 A H4' 1.800 . 4.200 3.556 3.448 3.653 . 0 0 "[ . 1]" 1
614 1 19 A H1' 1 19 A H5' 1.800 . 5.700 5.000 4.733 5.088 . 0 0 "[ . 1]" 1
615 1 19 A H1' 1 19 A H5'' 1.800 . 5.400 4.401 4.160 5.049 . 0 0 "[ . 1]" 1
616 1 19 A H1' 1 19 A H8 1.800 . 4.300 3.158 2.852 3.297 . 0 0 "[ . 1]" 1
617 1 19 A H1' 1 19 A HO2' 1.800 . 4.500 2.790 2.347 3.449 . 0 0 "[ . 1]" 1
618 1 19 A H2 1 19 A H4' 1.800 . 6.400 6.076 5.897 6.194 . 0 0 "[ . 1]" 1
619 1 19 A H2 1 19 A H5' 1.800 . 6.500 6.167 5.069 6.630 0.130 2 0 "[ . 1]" 1
620 1 19 A H2 1 19 A H5'' 1.800 . 7.000 5.768 4.644 6.657 . 0 0 "[ . 1]" 1
621 1 19 A H2 1 19 A HO2' 1.800 . 6.400 7.972 7.723 8.246 1.846 3 10 [*-+*******] 1
622 1 19 A H3' 1 19 A H4' 1.800 . 4.300 2.730 2.700 2.757 . 0 0 "[ . 1]" 1
623 1 19 A H3' 1 19 A H8 1.800 . 5.200 4.863 4.608 5.173 . 0 0 "[ . 1]" 1
624 1 19 A H3' 1 19 A HO2' 1.800 . 4.100 2.993 2.781 3.215 . 0 0 "[ . 1]" 1
625 1 19 A H4' 1 19 A HO2' 1.800 . 5.300 4.436 4.183 4.863 . 0 0 "[ . 1]" 1
626 1 19 A H5' 1 19 A HO2' 1.800 . 5.400 5.407 5.123 5.747 0.347 7 0 "[ . 1]" 1
627 1 19 A H5'' 1 19 A H8 1.800 . 6.200 4.989 4.597 5.777 . 0 0 "[ . 1]" 1
628 1 19 A H5'' 1 19 A HO2' 1.800 . 5.500 4.709 4.430 5.185 . 0 0 "[ . 1]" 1
629 1 19 A H8 1 19 A HO2' 1.800 . 4.200 3.372 3.089 3.646 . 0 0 "[ . 1]" 1
630 1 20 G H1 1 20 G H21 1.800 . 5.300 2.268 2.240 2.279 . 0 0 "[ . 1]" 1
631 1 20 G H1 1 20 G H22 1.800 . 6.300 3.505 3.500 3.511 . 0 0 "[ . 1]" 1
632 1 20 G H1 1 21 G H21 1.800 . 6.900 6.358 6.200 6.597 . 0 0 "[ . 1]" 1
633 1 20 G H1 1 22 A H61 1.800 . 6.600 6.297 4.586 6.529 . 0 0 "[ . 1]" 1
634 1 20 G H1 1 22 A H8 1.800 . 7.000 6.339 6.182 6.639 . 0 0 "[ . 1]" 1
635 1 20 G H1 1 23 G H8 1.800 . 7.600 5.188 5.008 5.367 . 0 0 "[ . 1]" 1
636 1 20 G H1' 1 20 G H3' 1.800 . 5.500 3.617 3.570 3.675 . 0 0 "[ . 1]" 1
637 1 20 G H1' 1 20 G H5'' 1.800 . 5.400 4.780 4.572 4.860 . 0 0 "[ . 1]" 1
638 1 20 G H1' 1 20 G H8 1.800 . 6.600 3.874 3.775 3.936 . 0 0 "[ . 1]" 1
639 1 20 G H1' 1 20 G HO2' 1.800 . 5.700 2.974 2.623 3.375 . 0 0 "[ . 1]" 1
640 1 20 G H1' 1 21 G H8 1.800 . 5.700 2.952 2.710 3.135 . 0 0 "[ . 1]" 1
641 1 20 G H21 1 20 G H22 1.800 . 5.600 1.746 1.740 1.750 0.060 10 0 "[ . 1]" 1
642 1 20 G H21 1 22 A H61 1.800 . 7.700 5.289 3.395 5.592 . 0 0 "[ . 1]" 1
643 1 20 G H21 1 22 A H62 1.800 . 7.000 3.883 3.710 5.014 . 0 0 "[ . 1]" 1
644 1 20 G H21 1 22 A H8 1.800 . 6.800 4.152 4.020 4.457 . 0 0 "[ . 1]" 1
645 1 20 G H21 1 23 G H3' 1.800 . 7.700 7.291 7.034 7.469 . 0 0 "[ . 1]" 1
646 1 20 G H21 1 23 G H8 1.800 . 5.400 3.095 2.939 3.248 . 0 0 "[ . 1]" 1
647 1 20 G H22 1 23 G H8 1.800 . 6.300 3.508 3.357 3.621 . 0 0 "[ . 1]" 1
648 1 20 G H3' 1 20 G H8 1.800 . 7.600 4.943 4.857 5.013 . 0 0 "[ . 1]" 1
649 1 20 G H3' 1 20 G HO2' 1.800 . 4.500 2.743 2.659 2.833 . 0 0 "[ . 1]" 1
650 1 20 G H4' 1 20 G H8 1.800 . 7.700 5.480 5.180 5.674 . 0 0 "[ . 1]" 1
651 1 20 G H5' 1 20 G H8 1.800 . 6.900 4.998 3.106 5.563 . 0 0 "[ . 1]" 1
652 1 20 G H5'' 1 20 G H8 1.800 . 6.900 5.625 4.268 6.080 . 0 0 "[ . 1]" 1
653 1 20 G H8 1 20 G HO2' 1.800 . 5.400 4.583 4.285 4.862 . 0 0 "[ . 1]" 1
654 1 20 G HO2' 1 21 G H8 1.800 . 7.500 2.995 2.562 3.523 . 0 0 "[ . 1]" 1
655 1 21 G H1 1 21 G H1' 1.800 . 7.600 5.845 5.792 5.922 . 0 0 "[ . 1]" 1
656 1 21 G H1 1 21 G H21 1.800 . 5.600 2.217 2.182 2.267 . 0 0 "[ . 1]" 1
657 1 21 G H1 1 21 G H22 1.800 . 6.200 3.459 3.443 3.484 . 0 0 "[ . 1]" 1
658 1 21 G H1 1 23 G H1' 1.800 . 7.900 5.929 5.623 6.054 . 0 0 "[ . 1]" 1
659 1 21 G H1 1 23 G H3' 1.800 . 6.500 5.619 4.944 5.952 . 0 0 "[ . 1]" 1
660 1 21 G H1 1 23 G H4' 1.800 . 6.700 6.829 6.797 6.867 0.167 9 0 "[ . 1]" 1
661 1 21 G H1 1 23 G H8 1.800 . 6.300 4.096 3.956 4.200 . 0 0 "[ . 1]" 1
662 1 21 G H1 1 24 G H1 1.800 . 8.000 4.631 4.422 4.758 . 0 0 "[ . 1]" 1
663 1 21 G H1 1 24 G H8 1.800 . 5.700 4.716 4.365 4.968 . 0 0 "[ . 1]" 1
664 1 21 G H1' 1 21 G H3' 1.800 . 6.300 3.828 3.737 3.955 . 0 0 "[ . 1]" 1
665 1 21 G H1' 1 21 G H4' 1.800 . 7.000 3.446 3.329 3.699 . 0 0 "[ . 1]" 1
666 1 21 G H1' 1 21 G H5' 1.800 . 6.300 4.691 4.610 4.842 . 0 0 "[ . 1]" 1
667 1 21 G H1' 1 21 G H5'' 1.800 . 7.500 4.783 4.002 5.017 . 0 0 "[ . 1]" 1
668 1 21 G H1' 1 21 G H8 1.800 . 6.500 3.846 3.763 3.881 . 0 0 "[ . 1]" 1
669 1 21 G H1' 1 21 G HO2' 1.800 . 5.400 2.638 2.301 3.218 . 0 0 "[ . 1]" 1
670 1 21 G H1' 1 22 A H1' 1.800 . 7.000 5.206 4.173 5.582 . 0 0 "[ . 1]" 1
671 1 21 G H1' 1 22 A H3' 1.800 . 6.900 3.323 2.889 3.833 . 0 0 "[ . 1]" 1
672 1 21 G H1' 1 22 A H4' 1.800 . 6.200 4.630 4.222 4.885 . 0 0 "[ . 1]" 1
673 1 21 G H1' 1 22 A H5' 1.800 . 5.500 3.579 3.361 3.812 . 0 0 "[ . 1]" 1
674 1 21 G H1' 1 22 A H8 1.800 . 6.600 3.839 3.230 4.131 . 0 0 "[ . 1]" 1
675 1 21 G H1' 1 23 G H8 1.800 . 7.800 5.771 5.103 6.184 . 0 0 "[ . 1]" 1
676 1 21 G H21 1 23 G H8 1.800 . 6.900 4.222 4.006 4.382 . 0 0 "[ . 1]" 1
677 1 21 G H21 1 24 G H8 1.800 . 6.300 3.070 2.803 3.270 . 0 0 "[ . 1]" 1
678 1 21 G H3' 1 21 G H4' 1.800 . 4.100 2.734 2.695 2.773 . 0 0 "[ . 1]" 1
679 1 21 G H3' 1 21 G H5' 1.800 . 4.400 3.354 2.184 3.698 . 0 0 "[ . 1]" 1
680 1 21 G H3' 1 21 G H5'' 1.800 . 5.500 2.568 2.355 2.923 . 0 0 "[ . 1]" 1
681 1 21 G H3' 1 21 G H8 1.800 . 6.300 4.472 4.190 4.728 . 0 0 "[ . 1]" 1
682 1 21 G H3' 1 21 G HO2' 1.800 . 3.500 3.016 2.718 3.322 . 0 0 "[ . 1]" 1
683 1 21 G H3' 1 22 A H2 1.800 . 6.700 6.697 6.553 6.771 0.071 1 0 "[ . 1]" 1
684 1 21 G H4' 1 21 G H5' 1.800 . 4.000 2.452 2.388 2.499 . 0 0 "[ . 1]" 1
685 1 21 G H4' 1 21 G H5'' 1.800 . 4.100 2.552 2.386 3.051 . 0 0 "[ . 1]" 1
686 1 21 G H4' 1 21 G H8 1.800 . 6.800 4.619 4.192 4.844 . 0 0 "[ . 1]" 1
687 1 21 G H4' 1 22 A H1' 1.800 . 7.900 4.764 4.244 5.578 . 0 0 "[ . 1]" 1
688 1 21 G H4' 1 22 A H2 1.800 . 6.500 4.659 3.860 5.135 . 0 0 "[ . 1]" 1
689 1 21 G H5' 1 21 G H8 1.800 . 7.600 3.793 3.311 4.059 . 0 0 "[ . 1]" 1
690 1 21 G H5' 1 21 G HO2' 1.800 . 6.300 5.550 4.679 5.806 . 0 0 "[ . 1]" 1
691 1 21 G H5' 1 22 A H1' 1.800 . 7.800 5.620 4.460 7.821 0.021 9 0 "[ . 1]" 1
692 1 21 G H5' 1 22 A H2 1.800 . 6.700 3.678 3.004 6.009 . 0 0 "[ . 1]" 1
693 1 21 G H5' 1 22 A H5' 1.800 . 6.600 6.694 6.527 6.976 0.376 8 0 "[ . 1]" 1
694 1 21 G H5' 1 22 A H8 1.800 . 7.900 6.334 5.661 7.916 0.016 9 0 "[ . 1]" 1
695 1 21 G H5'' 1 21 G H8 1.800 . 7.000 3.985 2.190 4.508 . 0 0 "[ . 1]" 1
696 1 21 G H5'' 1 21 G HO2' 1.800 . 6.700 5.134 4.485 5.471 . 0 0 "[ . 1]" 1
697 1 21 G H5'' 1 22 A H2 1.800 . 6.800 4.851 4.428 5.909 . 0 0 "[ . 1]" 1
698 1 21 G H8 1 21 G HO2' 1.800 . 4.300 4.994 4.756 5.463 1.163 9 9 "[**- ****+*]" 1
699 1 21 G H8 1 22 A H1' 1.800 . 6.700 6.859 6.757 6.901 0.201 5 0 "[ . 1]" 1
700 1 22 A H1' 1 22 A H2 1.800 . 6.600 4.587 4.490 4.641 . 0 0 "[ . 1]" 1
701 1 22 A H1' 1 22 A H3' 1.800 . 6.400 3.812 3.753 3.889 . 0 0 "[ . 1]" 1
702 1 22 A H1' 1 22 A H4' 1.800 . 5.300 3.389 3.243 3.539 . 0 0 "[ . 1]" 1
703 1 22 A H1' 1 22 A H5'' 1.800 . 6.500 4.660 4.371 4.782 . 0 0 "[ . 1]" 1
704 1 22 A H1' 1 22 A H8 1.800 . 6.400 3.774 3.724 3.864 . 0 0 "[ . 1]" 1
705 1 22 A H1' 1 22 A HO2' 1.800 . 5.500 3.438 3.369 3.467 . 0 0 "[ . 1]" 1
706 1 22 A H3' 1 22 A H4' 1.800 . 4.100 3.049 3.024 3.065 . 0 0 "[ . 1]" 1
707 1 22 A H3' 1 22 A H5'' 1.800 . 4.500 2.510 2.235 2.785 . 0 0 "[ . 1]" 1
708 1 22 A H3' 1 22 A H8 1.800 . 4.300 2.342 2.187 2.481 . 0 0 "[ . 1]" 1
709 1 22 A H3' 1 22 A HO2' 1.800 . 5.300 3.515 3.470 3.553 . 0 0 "[ . 1]" 1
710 1 22 A H3' 1 23 G H3' 1.800 . 5.200 5.408 5.290 5.481 0.281 6 0 "[ . 1]" 1
711 1 22 A H3' 1 23 G H4' 1.800 . 5.500 4.514 4.126 4.907 . 0 0 "[ . 1]" 1
712 1 22 A H3' 1 23 G H8 1.800 . 6.400 4.174 3.992 4.335 . 0 0 "[ . 1]" 1
713 1 22 A H4' 1 22 A H5'' 1.800 . 3.800 3.008 2.964 3.028 . 0 0 "[ . 1]" 1
714 1 22 A H4' 1 22 A H8 1.800 . 5.200 4.859 4.737 4.963 . 0 0 "[ . 1]" 1
715 1 22 A H5' 1 23 G H5'' 1.800 . 6.400 5.306 4.735 5.738 . 0 0 "[ . 1]" 1
716 1 22 A H5'' 1 22 A H8 1.800 . 6.700 4.092 3.571 4.366 . 0 0 "[ . 1]" 1
717 1 22 A H5'' 1 22 A HO2' 1.800 . 5.200 5.242 5.172 5.354 0.154 4 0 "[ . 1]" 1
718 1 22 A H8 1 22 A HO2' 1.800 . 6.600 4.583 4.529 4.633 . 0 0 "[ . 1]" 1
719 1 22 A H8 1 23 G H3' 1.800 . 6.400 5.619 5.504 5.843 . 0 0 "[ . 1]" 1
720 1 22 A H8 1 23 G H4' 1.800 . 6.500 4.580 4.207 4.880 . 0 0 "[ . 1]" 1
721 1 22 A H8 1 23 G H8 1.800 . 5.600 2.277 2.049 2.488 . 0 0 "[ . 1]" 1
722 1 23 G H1 1 23 G H21 1.800 . 6.600 2.292 2.273 2.309 . 0 0 "[ . 1]" 1
723 1 23 G H1 1 23 G H22 1.800 . 5.700 3.496 3.472 3.509 . 0 0 "[ . 1]" 1
724 1 23 G H1 1 24 G H1 1.800 . 6.700 3.405 3.306 3.520 . 0 0 "[ . 1]" 1
725 1 23 G H1 1 24 G H1' 1.800 . 6.700 5.661 5.352 5.901 . 0 0 "[ . 1]" 1
726 1 23 G H1 1 24 G H21 1.800 . 6.800 4.382 4.242 4.565 . 0 0 "[ . 1]" 1
727 1 23 G H1 1 24 G H8 1.800 . 7.600 6.815 6.563 7.023 . 0 0 "[ . 1]" 1
728 1 23 G H1' 1 23 G H3' 1.800 . 5.300 4.054 4.001 4.077 . 0 0 "[ . 1]" 1
729 1 23 G H1' 1 23 G H4' 1.800 . 5.300 3.817 3.583 3.924 . 0 0 "[ . 1]" 1
730 1 23 G H1' 1 23 G H5' 1.800 . 5.400 4.250 4.076 4.599 . 0 0 "[ . 1]" 1
731 1 23 G H1' 1 23 G H5'' 1.800 . 4.500 4.490 4.440 4.527 0.027 5 0 "[ . 1]" 1
732 1 23 G H1' 1 23 G H8 1.800 . 6.400 3.471 3.394 3.532 . 0 0 "[ . 1]" 1
733 1 23 G H1' 1 23 G HO2' 1.800 . 5.300 3.205 3.174 3.256 . 0 0 "[ . 1]" 1
734 1 23 G H1' 1 24 G H1' 1.800 . 4.600 4.836 4.766 4.890 0.290 5 0 "[ . 1]" 1
735 1 23 G H1' 1 24 G H8 1.800 . 7.500 4.877 4.718 4.972 . 0 0 "[ . 1]" 1
736 1 23 G H3' 1 23 G H4' 1.800 . 3.500 2.847 2.782 2.976 . 0 0 "[ . 1]" 1
737 1 23 G H3' 1 23 G H5' 1.800 . 3.900 2.345 2.133 2.552 . 0 0 "[ . 1]" 1
738 1 23 G H3' 1 23 G H5'' 1.800 . 5.500 3.572 3.481 3.720 . 0 0 "[ . 1]" 1
739 1 23 G H3' 1 23 G H8 1.800 . 5.500 4.780 4.471 4.994 . 0 0 "[ . 1]" 1
740 1 23 G H3' 1 24 G H3' 1.800 . 3.900 4.159 4.069 4.366 0.466 10 0 "[ . 1]" 1
741 1 23 G H3' 1 24 G H8 1.800 . 6.500 1.985 1.944 2.017 . 0 0 "[ . 1]" 1
742 1 23 G H4' 1 23 G H8 1.800 . 5.500 4.130 3.936 4.295 . 0 0 "[ . 1]" 1
743 1 23 G H4' 1 24 G H8 1.800 . 5.400 4.695 4.573 4.928 . 0 0 "[ . 1]" 1
744 1 23 G H5' 1 23 G H8 1.800 . 7.800 3.127 2.690 3.361 . 0 0 "[ . 1]" 1
745 1 23 G H5'' 1 23 G H8 1.800 . 7.600 2.653 2.426 2.890 . 0 0 "[ . 1]" 1
746 1 23 G H8 1 23 G HO2' 1.800 . 6.400 6.011 5.921 6.070 . 0 0 "[ . 1]" 1
747 1 23 G H8 1 24 G H8 1.800 . 7.500 5.397 5.072 5.584 . 0 0 "[ . 1]" 1
748 1 23 G HO2' 1 24 G H1' 1.800 . 6.300 3.601 3.368 3.989 . 0 0 "[ . 1]" 1
749 1 23 G HO2' 1 24 G H8 1.800 . 5.400 4.136 3.961 4.290 . 0 0 "[ . 1]" 1
750 1 24 G H1 1 24 G H21 1.800 . 5.700 2.245 2.221 2.267 . 0 0 "[ . 1]" 1
751 1 24 G H1 1 24 G H22 1.800 . 5.200 3.477 3.460 3.495 . 0 0 "[ . 1]" 1
752 1 24 G H1 1 24 G HO2' 1.800 . 7.800 7.227 6.664 8.138 0.338 9 0 "[ . 1]" 1
753 1 24 G H1 1 25 A H1' 1.800 . 6.800 5.717 4.881 6.395 . 0 0 "[ . 1]" 1
754 1 24 G H1 1 25 A H2 1.800 . 5.400 4.640 3.866 5.284 . 0 0 "[ . 1]" 1
755 1 24 G H1 1 25 A H8 1.800 . 7.700 5.919 4.605 6.997 . 0 0 "[ . 1]" 1
756 1 24 G H1' 1 24 G H3' 1.800 . 5.200 3.715 3.690 3.744 . 0 0 "[ . 1]" 1
757 1 24 G H1' 1 24 G H4' 1.800 . 5.500 3.431 3.374 3.487 . 0 0 "[ . 1]" 1
758 1 24 G H1' 1 24 G Q5' 1.800 . 6.400 4.208 4.167 4.257 . 0 0 "[ . 1]" 1
759 1 24 G H1' 1 24 G H8 1.800 . 6.800 3.627 3.579 3.685 . 0 0 "[ . 1]" 1
760 1 24 G H1' 1 24 G HO2' 1.800 . 4.200 2.934 2.537 3.513 . 0 0 "[ . 1]" 1
761 1 24 G H1' 1 25 A H8 1.800 . 6.900 5.258 4.810 6.079 . 0 0 "[ . 1]" 1
762 1 24 G H1' 1 25 A HO2' 1.800 . 7.800 8.495 6.714 9.288 1.488 3 8 "[**+ * ***-]" 1
763 1 24 G H21 1 24 G H22 1.800 . 6.200 1.766 1.763 1.768 0.037 2 0 "[ . 1]" 1
764 1 24 G H3' 1 24 G H4' 1.800 . 4.300 2.998 2.983 3.010 . 0 0 "[ . 1]" 1
765 1 24 G H3' 1 24 G Q5' 1.800 . 5.500 2.187 2.099 2.251 . 0 0 "[ . 1]" 1
766 1 24 G H3' 1 24 G H8 1.800 . 5.500 2.879 2.723 2.997 . 0 0 "[ . 1]" 1
767 1 24 G H3' 1 24 G HO2' 1.800 . 4.000 3.898 3.504 4.123 0.123 2 0 "[ . 1]" 1
768 1 24 G H3' 1 25 A H8 1.800 . 5.400 3.410 2.662 4.858 . 0 0 "[ . 1]" 1
769 1 24 G H4' 1 24 G H8 1.800 . 6.400 4.290 4.211 4.334 . 0 0 "[ . 1]" 1
770 1 24 G H4' 1 24 G HO2' 1.800 . 4.400 3.536 2.825 3.820 . 0 0 "[ . 1]" 1
771 1 24 G Q5' 1 24 G H8 1.800 . 7.600 2.341 2.191 2.494 . 0 0 "[ . 1]" 1
772 1 24 G Q5' 1 24 G HO2' 1.800 . 4.500 4.855 4.307 5.106 0.606 8 6 "[**- . *+ *]" 1
773 1 24 G H8 1 24 G HO2' 1.800 . 6.300 5.569 5.467 5.701 . 0 0 "[ . 1]" 1
774 1 24 G HO2' 1 25 A H3' 1.800 . 5.200 5.931 5.222 6.243 1.043 8 8 "[*** **-+ *]" 1
775 1 24 G HO2' 1 25 A H8 1.800 . 5.200 4.682 3.654 6.245 1.045 5 1 "[ + 1]" 1
776 1 25 A H1' 1 25 A H2 1.800 . 6.700 4.418 4.323 4.547 . 0 0 "[ . 1]" 1
777 1 25 A H1' 1 25 A H3' 1.800 . 4.300 3.853 3.766 3.915 . 0 0 "[ . 1]" 1
778 1 25 A H1' 1 25 A H4' 1.800 . 5.300 3.340 3.097 3.507 . 0 0 "[ . 1]" 1
779 1 25 A H1' 1 25 A H5'' 1.800 . 6.700 4.937 4.457 5.079 . 0 0 "[ . 1]" 1
780 1 25 A H1' 1 25 A H8 1.800 . 5.600 3.901 3.838 3.929 . 0 0 "[ . 1]" 1
781 1 25 A H1' 1 25 A HO2' 1.800 . 4.200 2.893 2.406 3.512 . 0 0 "[ . 1]" 1
782 1 25 A H2 1 25 A H3' 1.800 . 7.700 7.823 7.745 7.894 0.194 2 0 "[ . 1]" 1
783 1 25 A H2 1 25 A HO2' 1.800 . 6.600 5.391 4.310 6.252 . 0 0 "[ . 1]" 1
784 1 25 A H3' 1 25 A H4' 1.800 . 3.600 2.801 2.767 2.844 . 0 0 "[ . 1]" 1
785 1 25 A H3' 1 25 A H5' 1.800 . 3.800 3.489 2.343 3.644 . 0 0 "[ . 1]" 1
786 1 25 A H3' 1 25 A H8 1.800 . 4.300 4.354 4.320 4.425 0.125 6 0 "[ . 1]" 1
787 1 25 A H3' 1 25 A HO2' 1.800 . 3.900 3.239 2.880 3.818 . 0 0 "[ . 1]" 1
788 1 25 A H4' 1 25 A H5' 1.800 . 3.600 2.497 2.390 3.014 . 0 0 "[ . 1]" 1
789 1 25 A H4' 1 25 A H8 1.800 . 5.700 4.676 4.376 4.919 . 0 0 "[ . 1]" 1
790 1 25 A H4' 1 25 A HO2' 1.800 . 5.400 4.627 4.049 5.127 . 0 0 "[ . 1]" 1
791 1 25 A H5' 1 25 A H8 1.800 . 6.300 3.748 2.977 4.356 . 0 0 "[ . 1]" 1
792 1 25 A H5'' 1 25 A HO2' 1.800 . 5.300 5.441 5.198 5.796 0.496 7 0 "[ . 1]" 1
793 1 25 A H8 1 25 A HO2' 1.800 . 5.600 4.756 4.197 5.325 . 0 0 "[ . 1]" 1
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