NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
482818 |
1snj   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1snj
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 42
_Distance_constraint_stats_list.Viol_count 283
_Distance_constraint_stats_list.Viol_total 179.283
_Distance_constraint_stats_list.Viol_max 0.186
_Distance_constraint_stats_list.Viol_rms 0.0387
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0296
_Distance_constraint_stats_list.Viol_average_violations_only 0.0528
_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 DC 0.855 0.131 5 0 "[ . 1 ]"
1 2 DG 0.566 0.079 9 0 "[ . 1 ]"
1 3 DT 1.757 0.186 5 0 "[ . 1 ]"
1 4 DG 0.723 0.092 5 0 "[ . 1 ]"
1 5 DC 0.600 0.094 9 0 "[ . 1 ]"
1 6 DA 0.526 0.057 4 0 "[ . 1 ]"
1 7 DG 1.347 0.145 9 0 "[ . 1 ]"
1 8 DC 1.286 0.141 8 0 "[ . 1 ]"
1 9 DG 1.094 0.109 11 0 "[ . 1 ]"
1 10 DG 1.378 0.142 5 0 "[ . 1 ]"
1 11 DC 1.037 0.140 2 0 "[ . 1 ]"
1 14 DG 1.037 0.140 2 0 "[ . 1 ]"
1 15 DC 1.378 0.142 5 0 "[ . 1 ]"
1 16 DC 1.094 0.109 11 0 "[ . 1 ]"
1 17 DG 1.286 0.141 8 0 "[ . 1 ]"
1 18 DG 0.618 0.072 10 0 "[ . 1 ]"
1 19 DC 1.235 0.101 11 0 "[ . 1 ]"
1 20 DA 1.025 0.185 11 0 "[ . 1 ]"
1 21 DC 0.892 0.094 5 0 "[ . 1 ]"
1 24 DG 0.892 0.094 5 0 "[ . 1 ]"
1 25 DT 1.025 0.185 11 0 "[ . 1 ]"
1 26 DG 1.235 0.101 11 0 "[ . 1 ]"
1 27 DC 0.618 0.072 10 0 "[ . 1 ]"
1 30 DC 1.347 0.145 9 0 "[ . 1 ]"
1 31 DT 0.526 0.057 4 0 "[ . 1 ]"
1 32 DG 0.600 0.094 9 0 "[ . 1 ]"
1 33 DC 0.723 0.092 5 0 "[ . 1 ]"
1 34 DA 1.757 0.186 5 0 "[ . 1 ]"
1 35 DC 0.566 0.079 9 0 "[ . 1 ]"
1 36 DG 0.855 0.131 5 0 "[ . 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 DC N4 1 36 DG O6 2.910 2.760 3.060 3.061 2.824 3.142 0.082 10 0 "[ . 1 ]" 1
2 1 1 DC N3 1 36 DG N1 2.950 2.800 3.100 3.060 2.986 3.096 . 0 0 "[ . 1 ]" 1
3 1 1 DC O2 1 36 DG N2 2.860 2.710 2.990 2.988 2.774 3.121 0.131 5 0 "[ . 1 ]" 1
4 1 2 DG O6 1 35 DC N4 2.910 2.760 3.060 2.990 2.854 3.102 0.042 7 0 "[ . 1 ]" 1
5 1 2 DG N1 1 35 DC N3 2.950 2.800 3.100 3.081 3.033 3.117 0.017 8 0 "[ . 1 ]" 1
6 1 2 DG N2 1 35 DC O2 2.860 2.710 2.990 3.029 2.993 3.069 0.079 9 0 "[ . 1 ]" 1
7 1 3 DT O4 1 34 DA N6 2.950 2.800 3.100 2.779 2.721 2.869 0.079 5 0 "[ . 1 ]" 1
8 1 3 DT N3 1 34 DA N1 2.820 2.670 2.970 3.085 3.046 3.156 0.186 5 0 "[ . 1 ]" 1
9 1 4 DG O6 1 33 DC N4 2.910 2.760 3.060 3.007 2.871 3.087 0.027 3 0 "[ . 1 ]" 1
10 1 4 DG N1 1 33 DC N3 2.950 2.800 3.100 3.091 3.045 3.122 0.022 2 0 "[ . 1 ]" 1
11 1 4 DG N2 1 33 DC O2 2.860 2.710 2.990 3.036 2.986 3.082 0.092 5 0 "[ . 1 ]" 1
12 1 5 DC N4 1 32 DG O6 2.910 2.760 3.060 3.050 2.912 3.147 0.087 10 0 "[ . 1 ]" 1
13 1 5 DC N3 1 32 DG N1 2.950 2.800 3.100 3.055 2.988 3.089 . 0 0 "[ . 1 ]" 1
14 1 5 DC O2 1 32 DG N2 2.860 2.710 2.990 2.993 2.822 3.084 0.094 9 0 "[ . 1 ]" 1
15 1 6 DA N6 1 31 DT O4 2.950 2.800 3.100 3.048 2.859 3.149 0.049 6 0 "[ . 1 ]" 1
16 1 6 DA N1 1 31 DT N3 2.820 2.670 2.970 3.006 2.981 3.027 0.057 4 0 "[ . 1 ]" 1
17 1 7 DG O6 1 30 DC N4 2.910 2.760 3.060 2.946 2.744 3.128 0.068 5 0 "[ . 1 ]" 1
18 1 7 DG N1 1 30 DC N3 2.950 2.800 3.100 3.066 2.921 3.145 0.045 7 0 "[ . 1 ]" 1
19 1 7 DG N2 1 30 DC O2 2.860 2.710 2.990 3.072 3.013 3.135 0.145 9 0 "[ . 1 ]" 1
20 1 8 DC N4 1 17 DG O6 2.910 2.760 3.060 2.859 2.735 3.080 0.025 8 0 "[ . 1 ]" 1
21 1 8 DC N3 1 17 DG N1 2.950 2.800 3.100 3.043 2.997 3.112 0.012 9 0 "[ . 1 ]" 1
22 1 8 DC O2 1 17 DG N2 2.860 2.710 2.990 3.086 2.941 3.131 0.141 8 0 "[ . 1 ]" 1
23 1 9 DG O6 1 16 DC N4 2.910 2.760 3.060 3.121 3.062 3.169 0.109 11 0 "[ . 1 ]" 1
24 1 9 DG N1 1 16 DC N3 2.950 2.800 3.100 3.106 3.034 3.156 0.056 2 0 "[ . 1 ]" 1
25 1 9 DG N2 1 16 DC O2 2.860 2.710 2.990 2.932 2.759 3.030 0.040 12 0 "[ . 1 ]" 1
26 1 10 DG O6 1 15 DC N4 2.910 2.760 3.060 3.051 2.916 3.135 0.075 2 0 "[ . 1 ]" 1
27 1 10 DG N1 1 15 DC N3 2.950 2.800 3.100 3.131 3.082 3.185 0.085 4 0 "[ . 1 ]" 1
28 1 10 DG N2 1 15 DC O2 2.860 2.710 2.990 3.028 2.862 3.132 0.142 5 0 "[ . 1 ]" 1
29 1 11 DC N4 1 14 DG O6 2.910 2.760 3.060 3.145 3.068 3.200 0.140 2 0 "[ . 1 ]" 1
30 1 11 DC N3 1 14 DG N1 2.950 2.800 3.100 3.012 2.983 3.070 . 0 0 "[ . 1 ]" 1
31 1 11 DC O2 1 14 DG N2 2.860 2.710 2.990 2.764 2.694 2.905 0.016 2 0 "[ . 1 ]" 1
32 1 18 DG O6 1 27 DC N4 2.910 2.760 3.060 3.112 3.089 3.132 0.072 10 0 "[ . 1 ]" 1
33 1 18 DG N1 1 27 DC N3 2.950 2.800 3.100 3.004 2.977 3.062 . 0 0 "[ . 1 ]" 1
34 1 18 DG N2 1 27 DC O2 2.860 2.710 2.990 2.758 2.711 2.857 . 0 0 "[ . 1 ]" 1
35 1 19 DC N4 1 26 DG O6 2.910 2.760 3.060 3.041 2.949 3.083 0.023 10 0 "[ . 1 ]" 1
36 1 19 DC N3 1 26 DG N1 2.950 2.800 3.100 3.126 3.099 3.151 0.051 9 0 "[ . 1 ]" 1
37 1 19 DC O2 1 26 DG N2 2.860 2.710 2.990 3.061 3.042 3.091 0.101 11 0 "[ . 1 ]" 1
38 1 20 DA N6 1 25 DT O4 2.950 2.800 3.100 2.921 2.741 3.062 0.059 11 0 "[ . 1 ]" 1
39 1 20 DA N1 1 25 DT N3 2.820 2.670 2.970 3.049 3.016 3.155 0.185 11 0 "[ . 1 ]" 1
40 1 21 DC N4 1 24 DG O6 2.910 2.760 3.060 3.133 3.089 3.154 0.094 5 0 "[ . 1 ]" 1
41 1 21 DC N3 1 24 DG N1 2.950 2.800 3.100 2.981 2.894 3.039 . 0 0 "[ . 1 ]" 1
42 1 21 DC O2 1 24 DG N2 2.860 2.710 2.990 2.739 2.700 2.900 0.010 8 0 "[ . 1 ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 493
_Distance_constraint_stats_list.Viol_count 1924
_Distance_constraint_stats_list.Viol_total 4721.551
_Distance_constraint_stats_list.Viol_max 2.017
_Distance_constraint_stats_list.Viol_rms 0.1767
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0665
_Distance_constraint_stats_list.Viol_average_violations_only 0.2045
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 DC 9.440 0.573 8 12 [**-****+****]
1 2 DG 51.325 1.155 9 12 [**-*****+***]
1 3 DT 28.664 1.155 9 12 [****-***+***]
1 4 DG 8.394 0.340 5 0 "[ . 1 ]"
1 5 DC 18.938 0.509 10 1 "[ . + ]"
1 6 DA 10.743 0.509 10 1 "[ . + ]"
1 7 DG 7.184 0.297 5 0 "[ . 1 ]"
1 8 DC 22.149 0.725 11 9 "[****** *1+-]"
1 9 DG 16.969 0.725 11 9 "[****** *1+-]"
1 10 DG 7.173 0.437 2 0 "[ . 1 ]"
1 11 DC 6.733 0.355 9 0 "[ . 1 ]"
1 12 DT 21.913 0.826 10 12 [********-+**]
1 13 DT 27.540 0.826 10 12 [*********+*-]
1 14 DG 4.414 0.200 10 0 "[ . 1 ]"
1 15 DC 5.429 0.166 9 0 "[ . 1 ]"
1 16 DC 6.908 0.378 10 0 "[ . 1 ]"
1 17 DG 18.077 0.627 5 4 "[- + * 1* ]"
1 18 DG 4.165 0.150 3 0 "[ . 1 ]"
1 19 DC 8.770 0.286 2 0 "[ . 1 ]"
1 20 DA 27.166 2.017 6 12 [*****+-*****]
1 21 DC 13.301 0.558 12 1 "[ . 1 +]"
1 22 DT 41.504 2.017 6 12 [*****+***-**]
1 23 DT 18.445 0.791 1 12 [+********-**]
1 24 DG 41.774 1.042 9 12 [********+***]
1 25 DT 19.070 1.042 9 12 [********+*-*]
1 26 DG 5.476 0.211 10 0 "[ . 1 ]"
1 27 DC 17.027 0.965 3 3 "[ + - * ]"
1 28 DT 20.493 0.965 3 12 [**+**-******]
1 29 DT 21.645 0.815 5 12 [****+-******]
1 30 DC 39.652 1.072 7 12 [-*****+*****]
1 31 DT 22.646 1.072 7 12 [*****-+*****]
1 32 DG 2.587 0.090 5 0 "[ . 1 ]"
1 33 DC 11.896 0.371 10 0 "[ . 1 ]"
1 34 DA 7.693 0.371 10 0 "[ . 1 ]"
1 35 DC 8.252 0.287 2 0 "[ . 1 ]"
1 36 DG 5.637 0.308 5 0 "[ . 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 DC H1' 1 1 DC H2'' 2.810 2.390 3.430 2.295 2.271 2.314 0.119 1 0 "[ . 1 ]" 2
2 1 1 DC H1' 1 1 DC H2' 3.390 2.470 4.140 2.957 2.938 2.970 . 0 0 "[ . 1 ]" 2
3 1 1 DC H1' 1 1 DC H3' 4.470 3.920 5.220 4.056 4.041 4.064 . 0 0 "[ . 1 ]" 2
4 1 1 DC H1' 1 1 DC H6 3.400 2.940 4.060 3.775 3.748 3.797 . 0 0 "[ . 1 ]" 2
5 1 1 DC H1' 1 2 DG H8 4.930 4.340 5.720 5.356 4.980 5.724 0.004 2 0 "[ . 1 ]" 2
6 1 2 DG H1' 1 2 DG Q2' 2.800 2.730 3.540 2.243 2.230 2.257 0.500 7 0 "[ . 1 ]" 2
7 1 2 DG H1' 1 2 DG H3' 3.970 3.460 4.750 3.967 3.947 3.997 . 0 0 "[ . 1 ]" 2
8 1 2 DG H1' 1 3 DT H6 3.950 3.440 5.160 4.471 4.354 4.591 . 0 0 "[ . 1 ]" 2
9 1 2 DG H1' 1 2 DG H8 3.990 3.480 4.710 3.923 3.906 3.934 . 0 0 "[ . 1 ]" 2
10 1 2 DG H1' 1 3 DT M7 4.720 4.150 5.490 4.531 4.480 4.578 . 0 0 "[ . 1 ]" 2
11 1 3 DT H1' 1 3 DT H2'' 2.500 . 3.310 2.303 2.285 2.312 . 0 0 "[ . 1 ]" 2
12 1 3 DT H1' 1 3 DT H2' 3.650 3.170 4.400 3.026 3.019 3.031 0.151 5 0 "[ . 1 ]" 2
13 1 3 DT H1' 1 3 DT H3' 4.370 3.420 5.130 3.958 3.943 3.974 . 0 0 "[ . 1 ]" 2
14 1 3 DT H1' 1 3 DT H6 3.910 3.400 4.620 3.777 3.773 3.782 . 0 0 "[ . 1 ]" 2
15 1 3 DT H1' 1 4 DG H8 4.040 3.520 5.180 4.740 4.469 4.959 . 0 0 "[ . 1 ]" 2
16 1 3 DT H1' 1 3 DT M7 5.070 4.460 5.880 5.180 5.177 5.187 . 0 0 "[ . 1 ]" 2
17 1 4 DG H1' 1 4 DG H2'' 2.420 . 3.120 2.334 2.314 2.352 . 0 0 "[ . 1 ]" 2
18 1 4 DG H1' 1 4 DG H2' 2.900 2.480 3.520 3.039 3.028 3.049 . 0 0 "[ . 1 ]" 2
19 1 4 DG H1' 1 4 DG H3' 3.440 2.970 4.190 3.913 3.890 3.940 . 0 0 "[ . 1 ]" 2
20 1 4 DG H1' 1 5 DC H5 4.190 3.260 4.920 4.794 4.636 4.950 0.030 10 0 "[ . 1 ]" 2
21 1 4 DG H1' 1 5 DC H6 3.220 2.700 3.940 4.023 3.848 4.127 0.187 12 0 "[ . 1 ]" 2
22 1 4 DG H1' 1 4 DG H8 4.140 3.620 5.260 3.917 3.911 3.924 . 0 0 "[ . 1 ]" 2
23 1 5 DC H1' 1 5 DC H2'' 3.100 2.660 3.740 2.347 2.326 2.376 0.334 10 0 "[ . 1 ]" 2
24 1 5 DC H1' 1 5 DC H2' 3.530 3.060 4.200 3.018 3.001 3.037 0.059 2 0 "[ . 1 ]" 2
25 1 5 DC H1' 1 5 DC H5 4.930 4.280 5.780 5.495 5.483 5.502 . 0 0 "[ . 1 ]" 2
26 1 5 DC H1' 1 5 DC H6 4.030 3.520 4.740 3.775 3.756 3.788 . 0 0 "[ . 1 ]" 2
27 1 5 DC H1' 1 6 DA H8 4.860 4.280 5.640 5.272 4.988 5.448 . 0 0 "[ . 1 ]" 2
28 1 6 DA H1' 1 6 DA H2 5.010 4.380 5.770 4.579 4.560 4.596 . 0 0 "[ . 1 ]" 2
29 1 6 DA H1' 1 6 DA H2'' 2.950 2.520 3.730 2.350 2.318 2.378 0.202 10 0 "[ . 1 ]" 2
30 1 6 DA H1' 1 6 DA H2' 3.180 2.730 3.830 3.032 3.014 3.046 . 0 0 "[ . 1 ]" 2
31 1 6 DA H1' 1 6 DA H3' 4.090 3.570 4.720 3.939 3.924 3.956 . 0 0 "[ . 1 ]" 2
32 1 6 DA H1' 1 6 DA H8 4.050 3.530 4.770 3.951 3.946 3.959 . 0 0 "[ . 1 ]" 2
33 1 6 DA H1' 1 7 DG H8 4.070 3.550 5.090 4.391 4.106 4.786 . 0 0 "[ . 1 ]" 2
34 1 7 DG H1' 1 7 DG H2'' 2.940 2.510 3.660 2.374 2.349 2.400 0.161 9 0 "[ . 1 ]" 2
35 1 7 DG H1' 1 7 DG H2' 3.470 3.000 4.140 3.052 3.041 3.061 . 0 0 "[ . 1 ]" 2
36 1 7 DG H1' 1 7 DG H3' 4.270 3.740 4.790 3.881 3.835 3.928 . 0 0 "[ . 1 ]" 2
37 1 7 DG H1' 1 8 DC H5 4.390 3.850 5.130 4.739 4.294 5.149 0.019 10 0 "[ . 1 ]" 2
38 1 7 DG H1' 1 8 DC H6 4.060 3.540 4.780 3.944 3.494 4.421 0.046 6 0 "[ . 1 ]" 2
39 1 7 DG H1' 1 7 DG H8 4.130 3.610 5.240 3.932 3.903 3.946 . 0 0 "[ . 1 ]" 2
40 1 8 DC H1' 1 8 DC H2'' 2.860 2.440 3.480 2.299 2.289 2.309 0.151 10 0 "[ . 1 ]" 2
41 1 8 DC H1' 1 8 DC H2' 3.410 2.950 4.500 2.985 2.976 2.991 . 0 0 "[ . 1 ]" 2
42 1 8 DC H1' 1 8 DC H5 4.510 3.960 5.260 5.458 5.451 5.472 0.212 10 0 "[ . 1 ]" 2
43 1 8 DC H1' 1 8 DC H6 4.050 3.530 4.770 3.767 3.746 3.804 . 0 0 "[ . 1 ]" 2
44 1 9 DG H1' 1 9 DG H2'' 3.020 2.590 3.650 2.365 2.344 2.392 0.246 5 0 "[ . 1 ]" 2
45 1 9 DG H1' 1 9 DG H2' 3.030 2.600 3.660 3.032 3.016 3.046 . 0 0 "[ . 1 ]" 2
46 1 9 DG H1' 1 9 DG H3' 4.010 3.500 4.780 3.990 3.969 4.007 . 0 0 "[ . 1 ]" 2
47 1 9 DG H1' 1 9 DG H8 3.700 3.210 4.440 3.951 3.944 3.963 . 0 0 "[ . 1 ]" 2
48 1 9 DG H1' 1 10 DG H8 3.860 3.360 4.560 4.599 4.560 4.641 0.081 12 0 "[ . 1 ]" 2
49 1 10 DG H1' 1 10 DG H2'' 2.790 2.370 3.410 2.317 2.284 2.335 0.086 11 0 "[ . 1 ]" 2
50 1 10 DG H1' 1 10 DG H3' 4.510 3.740 5.300 3.983 3.972 4.001 . 0 0 "[ . 1 ]" 2
51 1 10 DG H1' 1 11 DC H5 4.780 3.990 5.510 5.687 5.533 5.865 0.355 9 0 "[ . 1 ]" 2
52 1 10 DG H1' 1 11 DC H6 4.450 3.710 5.160 4.580 4.460 4.740 . 0 0 "[ . 1 ]" 2
53 1 10 DG H1' 1 10 DG H8 3.590 3.110 4.270 3.928 3.920 3.937 . 0 0 "[ . 1 ]" 2
54 1 11 DC H1' 1 12 DT H1' 4.490 3.950 5.230 5.260 5.137 5.434 0.204 4 0 "[ . 1 ]" 2
55 1 11 DC H1' 1 11 DC H2'' 2.210 . 3.070 2.350 2.337 2.362 . 0 0 "[ . 1 ]" 2
56 1 11 DC H1' 1 11 DC H2' 3.310 2.850 3.970 3.038 3.032 3.043 . 0 0 "[ . 1 ]" 2
57 1 11 DC H1' 1 11 DC H3' 4.630 3.850 5.390 3.940 3.906 3.969 . 0 0 "[ . 1 ]" 2
58 1 11 DC H1' 1 11 DC H5 4.880 4.260 5.700 5.446 5.416 5.486 . 0 0 "[ . 1 ]" 2
59 1 11 DC H1' 1 11 DC H6 4.210 3.260 4.920 3.723 3.686 3.767 . 0 0 "[ . 1 ]" 2
60 1 11 DC H1' 1 12 DT H6 3.470 3.000 4.260 3.556 3.379 3.666 . 0 0 "[ . 1 ]" 2
61 1 11 DC H1' 1 12 DT M7 3.530 3.060 4.200 3.308 3.093 3.435 . 0 0 "[ . 1 ]" 2
62 1 11 DC H1' 1 13 DT M7 4.440 3.830 5.460 4.215 4.039 4.366 . 0 0 "[ . 1 ]" 2
63 1 12 DT H1' 1 12 DT H2'' 2.370 . 3.130 2.311 2.308 2.318 . 0 0 "[ . 1 ]" 2
64 1 12 DT H1' 1 12 DT H2' 3.660 3.180 4.340 3.006 3.002 3.014 0.178 3 0 "[ . 1 ]" 2
65 1 12 DT H1' 1 12 DT H6 3.980 3.470 4.690 3.695 3.677 3.722 . 0 0 "[ . 1 ]" 2
66 1 12 DT H1' 1 13 DT H6 5.050 4.560 5.500 6.302 6.292 6.326 0.826 10 12 [**-******+**] 2
67 1 12 DT H1' 1 12 DT M7 5.020 4.520 5.720 5.196 5.187 5.213 . 0 0 "[ . 1 ]" 2
68 1 10 DG H1' 1 12 DT M7 4.980 4.510 5.650 4.559 4.073 4.874 0.437 2 0 "[ . 1 ]" 2
69 1 13 DT H1' 1 13 DT H2'' 2.830 2.410 3.450 2.327 2.320 2.333 0.090 8 0 "[ . 1 ]" 2
70 1 13 DT H1' 1 13 DT H2' 2.970 2.540 3.600 3.012 3.003 3.021 . 0 0 "[ . 1 ]" 2
71 1 13 DT H1' 1 13 DT H3' 3.880 2.920 4.970 3.981 3.966 3.997 . 0 0 "[ . 1 ]" 2
72 1 13 DT H1' 1 13 DT H6 3.830 3.330 4.530 3.724 3.711 3.740 . 0 0 "[ . 1 ]" 2
73 1 14 DG H1' 1 14 DG H2'' 2.920 2.490 4.220 2.295 2.290 2.302 0.200 10 0 "[ . 1 ]" 2
74 1 14 DG H1' 1 14 DG H2' 3.170 2.720 3.820 2.941 2.917 2.970 . 0 0 "[ . 1 ]" 2
75 1 14 DG H1' 1 15 DC H5 4.360 3.820 5.440 4.779 4.344 5.054 . 0 0 "[ . 1 ]" 2
76 1 14 DG H1' 1 15 DC H6 3.660 3.180 4.340 3.911 3.560 4.207 . 0 0 "[ . 1 ]" 2
77 1 14 DG H1' 1 14 DG H8 3.940 3.430 4.950 3.909 3.904 3.914 . 0 0 "[ . 1 ]" 2
78 1 15 DC H1' 1 15 DC H2' 3.480 3.010 4.630 2.995 2.984 3.009 0.026 9 0 "[ . 1 ]" 2
79 1 15 DC H1' 1 15 DC H3' 3.980 3.470 4.690 3.964 3.935 3.988 . 0 0 "[ . 1 ]" 2
80 1 15 DC H1' 1 16 DC H5 4.870 3.620 6.360 5.168 5.026 5.273 . 0 0 "[ . 1 ]" 2
81 1 15 DC H1' 1 15 DC H6 3.690 3.200 4.380 3.842 3.820 3.858 . 0 0 "[ . 1 ]" 2
82 1 15 DC H1' 1 16 DC H6 3.760 3.270 4.450 4.549 4.482 4.616 0.166 9 0 "[ . 1 ]" 2
83 1 16 DC H1' 1 16 DC H3' 4.130 3.610 4.850 3.998 3.965 4.022 . 0 0 "[ . 1 ]" 2
84 1 16 DC H1' 1 16 DC H5 4.930 4.400 5.960 5.506 5.500 5.518 . 0 0 "[ . 1 ]" 2
85 1 16 DC H1' 1 16 DC H6 4.100 3.180 4.980 3.803 3.795 3.810 . 0 0 "[ . 1 ]" 2
86 1 16 DC H1' 1 17 DG H8 2.990 2.560 3.620 3.679 3.520 3.753 0.133 5 0 "[ . 1 ]" 2
87 1 17 DG H1' 1 17 DG H2'' 3.200 2.750 3.850 2.401 2.385 2.413 0.365 7 0 "[ . 1 ]" 2
88 1 17 DG H1' 1 17 DG H3' 4.050 3.530 5.650 3.971 3.936 4.013 . 0 0 "[ . 1 ]" 2
89 1 17 DG H1' 1 30 DC H5 4.530 3.980 5.280 4.778 4.399 5.121 . 0 0 "[ . 1 ]" 2
90 1 17 DG H1' 1 30 DC H6 3.680 3.190 4.370 4.447 4.178 4.575 0.205 1 0 "[ . 1 ]" 2
91 1 17 DG H1' 1 17 DG H8 4.020 3.510 5.410 3.946 3.932 3.965 . 0 0 "[ . 1 ]" 2
92 1 18 DG H1' 1 18 DG H2'' 2.800 2.380 3.830 2.292 2.284 2.307 0.096 6 0 "[ . 1 ]" 2
93 1 18 DG H1' 1 18 DG H2' 3.210 2.760 3.860 2.956 2.937 2.976 . 0 0 "[ . 1 ]" 2
94 1 18 DG H1' 1 18 DG H3' 4.080 3.560 4.800 4.000 3.979 4.043 . 0 0 "[ . 1 ]" 2
95 1 18 DG H1' 1 19 DC H5 4.030 2.880 5.300 5.229 5.083 5.308 0.008 8 0 "[ . 1 ]" 2
96 1 18 DG H1' 1 19 DC H6 4.050 3.100 5.070 4.833 4.722 5.051 . 0 0 "[ . 1 ]" 2
97 1 18 DG H1' 1 18 DG H8 4.250 3.720 5.680 3.922 3.905 3.935 . 0 0 "[ . 1 ]" 2
98 1 19 DC H1' 1 19 DC H2' 3.650 2.660 4.330 2.949 2.921 2.966 . 0 0 "[ . 1 ]" 2
99 1 19 DC H1' 1 19 DC H5 4.430 3.880 5.180 5.459 5.456 5.466 0.286 2 0 "[ . 1 ]" 2
100 1 19 DC H1' 1 19 DC H6 4.230 3.700 5.690 3.777 3.766 3.788 . 0 0 "[ . 1 ]" 2
101 1 19 DC H1' 1 20 DA H8 4.260 3.730 4.990 4.673 4.540 4.868 . 0 0 "[ . 1 ]" 2
102 1 20 DA H1' 1 20 DA H2 5.210 4.600 6.020 4.552 4.536 4.593 0.064 8 0 "[ . 1 ]" 2
103 1 20 DA H1' 1 20 DA H2'' 2.810 2.390 3.430 2.325 2.316 2.336 0.074 4 0 "[ . 1 ]" 2
104 1 20 DA H1' 1 20 DA H2' 3.700 3.210 5.190 3.032 3.025 3.039 0.185 11 0 "[ . 1 ]" 2
105 1 20 DA H1' 1 20 DA H3' 4.230 3.240 5.440 3.973 3.955 3.990 . 0 0 "[ . 1 ]" 2
106 1 20 DA H1' 1 21 DC H5 4.950 4.360 5.740 5.802 5.652 5.852 0.112 9 0 "[ . 1 ]" 2
107 1 20 DA H1' 1 21 DC H6 4.940 4.350 5.730 5.096 5.042 5.211 . 0 0 "[ . 1 ]" 2
108 1 20 DA H1' 1 20 DA H8 3.730 3.240 4.420 3.936 3.914 3.948 . 0 0 "[ . 1 ]" 2
109 1 21 DC H1' 1 22 DT H1' 4.360 3.820 5.100 5.184 5.107 5.296 0.196 7 0 "[ . 1 ]" 2
110 1 21 DC H1' 1 21 DC H2' 3.510 3.040 4.180 3.034 3.029 3.039 0.011 9 0 "[ . 1 ]" 2
111 1 21 DC H1' 1 21 DC H3' 4.510 3.960 5.260 3.943 3.934 3.955 0.026 3 0 "[ . 1 ]" 2
112 1 21 DC H1' 1 21 DC H5 4.820 4.240 5.600 5.458 5.447 5.470 . 0 0 "[ . 1 ]" 2
113 1 21 DC H1' 1 21 DC H6 4.310 3.770 5.500 3.766 3.761 3.773 0.009 10 0 "[ . 1 ]" 2
114 1 21 DC H1' 1 22 DT H6 3.440 2.970 4.110 2.875 2.817 2.908 0.153 2 0 "[ . 1 ]" 2
115 1 21 DC H1' 1 22 DT M7 3.600 3.120 4.280 2.979 2.562 3.466 0.558 12 1 "[ . 1 +]" 2
116 1 21 DC H1' 1 23 DT M7 4.430 3.090 5.850 3.954 3.856 4.171 . 0 0 "[ . 1 ]" 2
117 1 22 DT H1' 1 22 DT H2'' 2.400 . 3.150 2.328 2.316 2.359 . 0 0 "[ . 1 ]" 2
118 1 22 DT H1' 1 22 DT H2' 3.610 3.130 4.770 3.023 3.013 3.048 0.117 3 0 "[ . 1 ]" 2
119 1 22 DT H1' 1 22 DT H6 3.880 3.380 5.050 3.694 3.540 3.750 . 0 0 "[ . 1 ]" 2
120 1 22 DT H1' 1 23 DT H6 5.040 4.600 5.680 5.665 5.230 6.415 0.735 11 3 "[ * . - 1+ ]" 2
121 1 22 DT H1' 1 22 DT M7 5.000 4.470 5.730 5.198 5.052 5.250 . 0 0 "[ . 1 ]" 2
122 1 20 DA H1' 1 22 DT M7 4.010 3.540 4.680 3.546 2.577 3.974 0.963 11 3 "[ * . - 1+ ]" 2
123 1 23 DT H1' 1 23 DT H2'' 2.650 2.250 3.250 2.289 2.283 2.297 . 0 0 "[ . 1 ]" 2
124 1 23 DT H1' 1 23 DT H2' 3.130 2.690 3.770 2.938 2.933 2.944 . 0 0 "[ . 1 ]" 2
125 1 23 DT H1' 1 23 DT H3' 4.080 2.990 4.910 4.042 4.031 4.057 . 0 0 "[ . 1 ]" 2
126 1 23 DT H1' 1 23 DT H6 3.810 3.310 5.100 3.718 3.691 3.731 . 0 0 "[ . 1 ]" 2
127 1 20 DA H2 1 22 DT M7 3.090 2.590 3.790 4.738 2.529 5.807 2.017 6 9 "[* ***+ -** *]" 2
128 1 24 DG H1' 1 24 DG Q2' . 3.250 4.240 2.247 2.216 2.283 1.034 11 12 [*****-****+*] 2
129 1 24 DG H1' 1 24 DG H3' 4.210 3.680 4.940 4.013 3.984 4.086 . 0 0 "[ . 1 ]" 2
130 1 24 DG H1' 1 25 DT H6 3.490 3.020 4.720 4.158 3.365 4.417 . 0 0 "[ . 1 ]" 2
131 1 24 DG H1' 1 24 DG H8 4.090 3.570 4.810 3.880 3.722 3.936 . 0 0 "[ . 1 ]" 2
132 1 24 DG H1' 1 25 DT M7 4.290 3.750 5.030 4.018 3.722 4.132 0.028 12 0 "[ . 1 ]" 2
133 1 25 DT H1' 1 25 DT H2' 3.350 2.890 4.010 2.978 2.971 2.991 . 0 0 "[ . 1 ]" 2
134 1 25 DT H1' 1 25 DT H3' 4.260 3.730 4.990 3.972 3.962 3.983 . 0 0 "[ . 1 ]" 2
135 1 25 DT H1' 1 25 DT H6 3.990 3.480 5.020 3.777 3.676 3.793 . 0 0 "[ . 1 ]" 2
136 1 25 DT H1' 1 26 DG H8 4.640 3.590 5.860 4.414 4.225 4.708 . 0 0 "[ . 1 ]" 2
137 1 25 DT H1' 1 25 DT M7 5.040 4.430 5.850 5.213 5.122 5.224 . 0 0 "[ . 1 ]" 2
138 1 26 DG H1' 1 26 DG H2'' 2.620 2.220 3.220 2.264 2.234 2.294 . 0 0 "[ . 1 ]" 2
139 1 26 DG H1' 1 26 DG H2' 2.990 2.560 3.620 2.978 2.953 2.994 . 0 0 "[ . 1 ]" 2
140 1 26 DG H1' 1 26 DG H3' 4.090 2.800 6.290 3.987 3.971 4.009 . 0 0 "[ . 1 ]" 2
141 1 26 DG H1' 1 27 DC H5 4.260 3.730 4.990 5.107 5.076 5.165 0.175 9 0 "[ . 1 ]" 2
142 1 26 DG H1' 1 27 DC H6 4.240 3.710 5.540 4.530 4.371 4.679 . 0 0 "[ . 1 ]" 2
143 1 27 DC H1' 1 27 DC H2'' 2.480 . 3.420 2.307 2.301 2.329 . 0 0 "[ . 1 ]" 2
144 1 27 DC H1' 1 27 DC H2' 3.540 3.070 4.210 2.988 2.958 3.011 0.112 3 0 "[ . 1 ]" 2
145 1 27 DC H1' 1 27 DC H3' 4.920 4.330 6.160 4.072 4.049 4.086 0.281 7 0 "[ . 1 ]" 2
146 1 27 DC H1' 1 27 DC H5 5.160 4.550 5.970 5.471 5.444 5.506 . 0 0 "[ . 1 ]" 2
147 1 27 DC H1' 1 27 DC H6 4.060 3.540 4.780 3.776 3.759 3.803 . 0 0 "[ . 1 ]" 2
148 1 27 DC H1' 1 28 DT H6 3.960 3.450 4.670 3.792 3.421 4.640 0.029 7 0 "[ . 1 ]" 2
149 1 27 DC H1' 1 28 DT M7 3.530 3.060 4.200 3.452 3.406 3.503 . 0 0 "[ . 1 ]" 2
150 1 27 DC H1' 1 29 DT M7 4.990 3.700 6.510 4.195 3.863 4.387 . 0 0 "[ . 1 ]" 2
151 1 28 DT H1' 1 28 DT H2'' 2.950 2.520 3.580 2.344 2.338 2.357 0.182 3 0 "[ . 1 ]" 2
152 1 28 DT H1' 1 28 DT H2' 3.150 2.610 3.890 3.008 2.997 3.020 . 0 0 "[ . 1 ]" 2
153 1 28 DT H1' 1 28 DT H3' 4.100 3.480 4.920 4.013 3.993 4.040 . 0 0 "[ . 1 ]" 2
154 1 28 DT H1' 1 28 DT H6 4.130 3.610 4.850 3.573 3.548 3.594 0.062 11 0 "[ . 1 ]" 2
155 1 28 DT H1' 1 29 DT H6 4.980 4.490 5.570 6.128 5.264 6.385 0.815 5 9 "[* *+ ****-*]" 2
156 1 28 DT H1' 1 28 DT M7 4.970 4.040 5.680 5.105 5.088 5.127 . 0 0 "[ . 1 ]" 2
157 1 29 DT H1' 1 29 DT H2'' 2.840 2.420 3.460 2.315 2.303 2.331 0.117 3 0 "[ . 1 ]" 2
158 1 29 DT H1' 1 29 DT H2' 2.970 2.540 3.600 2.996 2.978 3.009 . 0 0 "[ . 1 ]" 2
159 1 29 DT H1' 1 29 DT H3' 4.380 3.840 5.120 4.013 3.983 4.047 . 0 0 "[ . 1 ]" 2
160 1 29 DT H1' 1 29 DT H6 4.100 3.580 5.480 3.731 3.681 3.792 . 0 0 "[ . 1 ]" 2
161 1 30 DC H1' 1 30 DC Q2' . 3.170 3.810 2.233 2.222 2.252 0.948 9 12 [***-****+***] 2
162 1 30 DC H1' 1 30 DC H3' 4.380 3.840 5.120 4.014 3.979 4.053 . 0 0 "[ . 1 ]" 2
163 1 30 DC H1' 1 30 DC H6 3.600 3.120 4.280 3.703 3.617 3.786 . 0 0 "[ . 1 ]" 2
164 1 30 DC H1' 1 31 DT M7 5.050 4.450 5.850 4.890 4.787 4.955 . 0 0 "[ . 1 ]" 2
165 1 31 DT H1' 1 31 DT H2'' 2.730 2.320 3.340 2.285 2.266 2.313 0.054 9 0 "[ . 1 ]" 2
166 1 31 DT H1' 1 31 DT H2' 3.630 3.150 5.230 2.997 2.977 3.012 0.173 9 0 "[ . 1 ]" 2
167 1 31 DT H1' 1 31 DT H3' 4.150 3.630 4.870 3.994 3.969 4.016 . 0 0 "[ . 1 ]" 2
168 1 31 DT H1' 1 31 DT H6 3.530 3.060 4.690 3.745 3.723 3.761 . 0 0 "[ . 1 ]" 2
169 1 31 DT H1' 1 32 DG H8 4.070 3.550 5.390 4.369 4.026 4.720 . 0 0 "[ . 1 ]" 2
170 1 31 DT H1' 1 31 DT M7 5.060 4.460 5.860 5.198 5.193 5.206 . 0 0 "[ . 1 ]" 2
171 1 32 DG H1' 1 32 DG H2'' 2.770 2.360 3.380 2.303 2.295 2.309 0.065 11 0 "[ . 1 ]" 2
172 1 32 DG H1' 1 32 DG H2' 3.460 2.990 4.090 3.000 2.986 3.014 0.004 11 0 "[ . 1 ]" 2
173 1 32 DG H1' 1 32 DG H3' 4.060 3.070 5.880 3.985 3.954 4.011 . 0 0 "[ . 1 ]" 2
174 1 32 DG H1' 1 33 DC H5 4.800 3.530 6.440 5.118 4.753 5.387 . 0 0 "[ . 1 ]" 2
175 1 32 DG H1' 1 33 DC H6 3.690 3.200 4.790 4.307 3.958 4.489 . 0 0 "[ . 1 ]" 2
176 1 32 DG H1' 1 32 DG H8 4.080 3.560 5.350 3.945 3.938 3.957 . 0 0 "[ . 1 ]" 2
177 1 33 DC H1' 1 33 DC H2'' 2.870 2.450 3.910 2.347 2.339 2.358 0.111 5 0 "[ . 1 ]" 2
178 1 33 DC H1' 1 33 DC H2' 3.880 3.380 4.580 3.066 3.060 3.073 0.320 12 0 "[ . 1 ]" 2
179 1 33 DC H1' 1 33 DC H3' 4.720 3.400 6.520 3.995 3.974 4.006 . 0 0 "[ . 1 ]" 2
180 1 33 DC H1' 1 33 DC H5 4.940 3.460 6.630 5.483 5.470 5.489 . 0 0 "[ . 1 ]" 2
181 1 33 DC H1' 1 33 DC H6 3.520 3.050 4.190 3.794 3.773 3.807 . 0 0 "[ . 1 ]" 2
182 1 33 DC H1' 1 34 DA H8 4.520 3.970 5.270 4.565 4.306 4.863 . 0 0 "[ . 1 ]" 2
183 1 34 DA H1' 1 34 DA H2 5.010 4.410 6.260 4.531 4.509 4.558 . 0 0 "[ . 1 ]" 2
184 1 34 DA H1' 1 34 DA H2'' 2.690 2.280 3.790 2.268 2.257 2.281 0.023 9 0 "[ . 1 ]" 2
185 1 34 DA H1' 1 34 DA H2' 3.240 2.790 3.890 2.971 2.951 2.994 . 0 0 "[ . 1 ]" 2
186 1 34 DA H1' 1 34 DA H3' 3.890 3.390 5.460 4.024 3.982 4.053 . 0 0 "[ . 1 ]" 2
187 1 34 DA H1' 1 35 DC H5 4.720 3.540 5.900 5.152 4.867 5.376 . 0 0 "[ . 1 ]" 2
188 1 34 DA H1' 1 35 DC H6 4.400 3.860 5.140 4.390 4.052 4.727 . 0 0 "[ . 1 ]" 2
189 1 34 DA H1' 1 34 DA H8 3.700 3.210 4.390 3.888 3.877 3.897 . 0 0 "[ . 1 ]" 2
190 1 35 DC H1' 1 35 DC H2'' 2.860 2.440 3.480 2.326 2.305 2.346 0.135 2 0 "[ . 1 ]" 2
191 1 35 DC H1' 1 35 DC H2' 3.820 3.320 4.520 3.043 3.033 3.058 0.287 2 0 "[ . 1 ]" 2
192 1 35 DC H1' 1 35 DC H6 4.140 3.620 4.860 3.819 3.808 3.837 . 0 0 "[ . 1 ]" 2
193 1 35 DC H1' 1 36 DG H8 4.940 4.330 5.750 4.560 4.500 4.684 . 0 0 "[ . 1 ]" 2
194 1 36 DG H1' 1 36 DG H2'' 2.410 . 4.010 2.279 2.265 2.288 . 0 0 "[ . 1 ]" 2
195 1 36 DG H1' 1 36 DG H2' 2.420 . 3.180 2.985 2.973 2.997 . 0 0 "[ . 1 ]" 2
196 1 36 DG H1' 1 36 DG H8 3.650 3.170 4.330 3.950 3.940 3.962 . 0 0 "[ . 1 ]" 2
197 1 1 DC H2'' 1 1 DC H3' 3.280 2.830 3.930 2.834 2.814 2.841 0.016 5 0 "[ . 1 ]" 2
198 1 1 DC H2'' 1 1 DC H6 3.140 2.700 4.400 4.084 4.035 4.120 . 0 0 "[ . 1 ]" 2
199 1 2 DG Q2' 1 3 DT H6 . 3.910 4.730 2.782 2.755 2.815 1.155 9 12 [********+-**] 2
200 1 2 DG Q2' 1 2 DG H8 . 3.360 3.430 2.349 2.238 2.492 1.122 10 12 [****-****+**] 2
201 1 2 DG Q2' 1 3 DT M7 3.990 3.560 4.700 2.615 2.575 2.691 0.985 12 12 [****-******+] 2
202 1 3 DT H2'' 1 3 DT H6 3.450 2.980 4.120 3.606 3.578 3.630 . 0 0 "[ . 1 ]" 2
203 1 3 DT H2'' 1 4 DG H8 3.370 2.910 4.030 2.910 2.805 3.060 0.105 5 0 "[ . 1 ]" 2
204 1 3 DT H2'' 1 3 DT M7 4.660 3.680 5.840 5.047 5.025 5.075 . 0 0 "[ . 1 ]" 2
205 1 4 DG H2'' 1 5 DC H5 3.690 3.200 4.790 3.293 3.227 3.395 . 0 0 "[ . 1 ]" 2
206 1 4 DG H2'' 1 5 DC H6 3.290 2.840 3.940 2.539 2.500 2.599 0.340 5 0 "[ . 1 ]" 2
207 1 4 DG H2'' 1 4 DG H8 2.920 2.490 3.550 3.745 3.722 3.760 0.210 3 0 "[ . 1 ]" 2
208 1 5 DC H2'' 1 5 DC H5 5.000 4.470 5.730 5.897 5.840 5.952 0.222 2 0 "[ . 1 ]" 2
209 1 5 DC H2'' 1 5 DC H6 3.530 3.060 4.750 4.074 4.021 4.143 . 0 0 "[ . 1 ]" 2
210 1 5 DC H2'' 1 6 DA H8 4.070 3.550 4.790 3.386 3.318 3.457 0.232 10 0 "[ . 1 ]" 2
211 1 6 DA H2'' 1 6 DA H3' 2.980 2.550 3.610 2.795 2.781 2.807 . 0 0 "[ . 1 ]" 2
212 1 6 DA H2'' 1 6 DA H8 3.410 2.950 4.520 3.938 3.869 4.003 . 0 0 "[ . 1 ]" 2
213 1 6 DA H2'' 1 7 DG H8 3.200 2.750 4.360 2.705 2.622 3.035 0.128 10 0 "[ . 1 ]" 2
214 1 7 DG H2'' 1 8 DC H5 3.950 3.440 5.140 3.444 3.378 3.615 0.062 8 0 "[ . 1 ]" 2
215 1 7 DG H2'' 1 8 DC H6 3.630 3.150 4.960 2.908 2.853 2.965 0.297 5 0 "[ . 1 ]" 2
216 1 7 DG H2'' 1 7 DG H8 3.670 3.180 4.360 3.709 3.595 3.870 . 0 0 "[ . 1 ]" 2
217 1 8 DC H2'' 1 8 DC H5 5.040 4.440 5.840 5.891 5.879 5.905 0.065 2 0 "[ . 1 ]" 2
218 1 8 DC H2'' 1 8 DC H6 3.970 3.460 5.290 3.989 3.930 4.035 . 0 0 "[ . 1 ]" 2
219 1 8 DC H2'' 1 9 DG H8 4.450 3.900 5.200 3.792 3.758 3.824 0.142 1 0 "[ . 1 ]" 2
220 1 9 DG H2'' 1 9 DG H8 3.820 3.400 4.440 3.929 3.859 3.968 . 0 0 "[ . 1 ]" 2
221 1 10 DG H2'' 1 11 DC H5 3.690 3.200 4.380 4.497 4.429 4.562 0.182 2 0 "[ . 1 ]" 2
222 1 10 DG H2'' 1 11 DC H6 3.300 2.840 3.960 2.783 2.741 2.827 0.099 9 0 "[ . 1 ]" 2
223 1 10 DG H2'' 1 10 DG H8 3.830 3.410 4.450 3.962 3.935 3.993 . 0 0 "[ . 1 ]" 2
224 1 11 DC H2'' 1 11 DC H5 4.740 3.520 6.550 5.913 5.885 5.931 . 0 0 "[ . 1 ]" 2
225 1 11 DC H2'' 1 11 DC H6 2.550 . 4.040 4.161 4.081 4.237 0.197 9 0 "[ . 1 ]" 2
226 1 11 DC H2'' 1 12 DT H6 3.430 3.020 4.710 3.672 3.533 3.883 . 0 0 "[ . 1 ]" 2
227 1 12 DT H2'' 1 12 DT H6 3.090 2.060 4.370 4.375 4.303 4.414 0.044 3 0 "[ . 1 ]" 2
228 1 13 DT H2'' 1 13 DT H3' 2.890 2.470 3.510 2.752 2.736 2.772 . 0 0 "[ . 1 ]" 2
229 1 13 DT H2'' 1 13 DT H6 3.370 2.910 4.030 4.193 4.163 4.220 0.190 5 0 "[ . 1 ]" 2
230 1 14 DG H2'' 1 15 DC H5 2.920 . 5.280 4.001 3.661 4.203 . 0 0 "[ . 1 ]" 2
231 1 14 DG H2'' 1 14 DG H8 3.210 2.760 3.860 3.965 3.889 4.003 0.143 6 0 "[ . 1 ]" 2
232 1 15 DC H2'' 1 15 DC H5 4.980 4.460 5.700 5.770 5.586 5.864 0.164 8 0 "[ . 1 ]" 2
233 1 15 DC H2'' 1 16 DC H5 4.300 3.760 5.040 3.693 3.600 3.736 0.160 2 0 "[ . 1 ]" 2
234 1 16 DC H2'' 1 16 DC H5 5.010 3.950 6.070 5.884 5.847 5.952 . 0 0 "[ . 1 ]" 2
235 1 17 DG H2'' 1 30 DC H5 3.760 3.270 4.450 3.834 3.565 4.187 . 0 0 "[ . 1 ]" 2
236 1 17 DG H2'' 1 17 DG H8 4.200 3.580 5.270 4.047 4.003 4.104 . 0 0 "[ . 1 ]" 2
237 1 18 DG H2'' 1 19 DC H5 4.090 3.570 5.460 3.835 3.741 3.902 . 0 0 "[ . 1 ]" 2
238 1 18 DG H2'' 1 19 DC H6 3.390 2.930 4.510 2.854 2.811 2.921 0.119 3 0 "[ . 1 ]" 2
239 1 18 DG H2'' 1 18 DG H8 3.590 3.110 4.890 4.222 4.148 4.304 . 0 0 "[ . 1 ]" 2
240 1 19 DC H2'' 1 19 DC H5 5.050 4.520 5.780 5.861 5.758 5.895 0.115 7 0 "[ . 1 ]" 2
241 1 19 DC H2'' 1 19 DC H6 3.600 3.160 4.240 3.878 3.726 3.931 . 0 0 "[ . 1 ]" 2
242 1 19 DC H2'' 1 20 DA H8 3.400 2.940 4.060 2.880 2.840 3.030 0.100 3 0 "[ . 1 ]" 2
243 1 20 DA H2'' 1 21 DC H5 4.120 3.600 5.460 4.275 4.196 4.389 . 0 0 "[ . 1 ]" 2
244 1 20 DA H2'' 1 21 DC H6 3.570 3.090 4.250 3.026 2.977 3.087 0.113 8 0 "[ . 1 ]" 2
245 1 20 DA H2'' 1 20 DA H8 3.080 2.640 3.720 3.856 3.721 3.941 0.221 8 0 "[ . 1 ]" 2
246 1 21 DC H2'' 1 21 DC H5 4.990 4.530 5.650 5.911 5.859 5.948 0.298 12 0 "[ . 1 ]" 2
247 1 21 DC H2'' 1 21 DC H6 2.680 2.270 3.890 4.014 3.996 4.033 0.143 8 0 "[ . 1 ]" 2
248 1 22 DT H2'' 1 22 DT H6 2.780 . 4.350 3.787 2.845 4.122 . 0 0 "[ . 1 ]" 2
249 1 23 DT H2'' 1 23 DT H3' 2.890 2.470 3.510 2.871 2.868 2.877 . 0 0 "[ . 1 ]" 2
250 1 23 DT H2'' 1 23 DT H6 4.300 3.860 4.940 4.326 4.280 4.349 . 0 0 "[ . 1 ]" 2
251 1 24 DG Q2' 1 24 DG H3' 3.030 2.600 3.380 2.194 2.190 2.201 0.410 4 0 "[ . 1 ]" 2
252 1 24 DG Q2' 1 25 DT H6 3.870 3.370 4.130 2.949 2.890 3.161 0.480 9 0 "[ . 1 ]" 2
253 1 24 DG Q2' 1 24 DG H8 3.240 2.790 3.620 2.235 2.150 2.306 0.640 11 10 "[** **** -*+*]" 2
254 1 24 DG Q2' 1 25 DT M7 3.910 3.360 4.560 2.475 2.318 2.821 1.042 9 12 [********+*-*] 2
255 1 25 DT H2'' 1 25 DT H6 3.360 2.900 4.510 3.781 3.310 3.870 . 0 0 "[ . 1 ]" 2
256 1 25 DT H2'' 1 25 DT M7 5.040 4.470 5.810 5.303 5.000 5.358 . 0 0 "[ . 1 ]" 2
257 1 26 DG H2'' 1 27 DC H5 4.000 3.490 4.710 3.766 3.600 4.000 . 0 0 "[ . 1 ]" 2
258 1 26 DG H2'' 1 27 DC H6 3.400 2.940 4.470 2.792 2.729 2.859 0.211 10 0 "[ . 1 ]" 2
259 1 26 DG H2'' 1 26 DG H8 3.140 2.700 3.780 3.887 3.855 3.919 0.139 12 0 "[ . 1 ]" 2
260 1 27 DC H2'' 1 27 DC H5 4.990 4.540 5.640 6.105 6.052 6.168 0.528 10 2 "[ - + ]" 2
261 1 27 DC H2'' 1 27 DC H6 3.800 3.250 4.890 4.192 4.089 4.251 . 0 0 "[ . 1 ]" 2
262 1 28 DT H2'' 1 28 DT H6 4.000 3.580 4.620 4.658 4.617 4.682 0.062 6 0 "[ . 1 ]" 2
263 1 28 DT H2'' 1 29 DT M7 4.070 3.620 4.630 3.641 3.118 3.811 0.502 6 1 "[ .+ 1 ]" 2
264 1 29 DT H2'' 1 29 DT H6 3.220 2.770 3.870 4.102 3.957 4.201 0.331 7 0 "[ . 1 ]" 2
265 1 30 DC Q2' 1 30 DC H5 . 4.560 4.790 4.513 4.435 4.634 0.125 3 0 "[ . 1 ]" 2
266 1 30 DC Q2' 1 30 DC H6 3.500 3.080 4.120 2.965 2.757 3.166 0.323 4 0 "[ . 1 ]" 2
267 1 30 DC Q2' 1 31 DT M7 . 3.480 4.500 2.444 2.408 2.485 1.072 7 12 [******+-****] 2
268 1 31 DT H2'' 1 31 DT H6 2.920 2.490 3.550 3.741 3.723 3.785 0.235 2 0 "[ . 1 ]" 2
269 1 31 DT H2'' 1 32 DG H8 3.010 2.580 3.640 2.608 2.496 2.899 0.084 5 0 "[ . 1 ]" 2
270 1 32 DG H2'' 1 33 DC H5 3.730 3.240 4.830 3.553 3.216 3.916 0.024 10 0 "[ . 1 ]" 2
271 1 32 DG H2'' 1 32 DG H8 3.800 3.380 4.420 3.979 3.929 4.011 . 0 0 "[ . 1 ]" 2
272 1 33 DC H2'' 1 33 DC H5 4.310 3.360 5.460 5.742 5.695 5.791 0.331 10 0 "[ . 1 ]" 2
273 1 33 DC H2'' 1 33 DC H6 3.150 2.710 4.480 3.883 3.861 3.921 . 0 0 "[ . 1 ]" 2
274 1 33 DC H2'' 1 34 DA H8 3.470 2.120 4.780 2.651 2.538 2.863 . 0 0 "[ . 1 ]" 2
275 1 34 DA H2'' 1 35 DC H5 4.090 3.570 4.810 3.677 3.501 3.906 0.069 2 0 "[ . 1 ]" 2
276 1 34 DA H2'' 1 35 DC H6 3.080 2.640 4.170 2.587 2.513 2.754 0.127 11 0 "[ . 1 ]" 2
277 1 34 DA H2'' 1 34 DA H8 2.990 . 3.620 3.933 3.876 3.959 0.339 1 0 "[ . 1 ]" 2
278 1 35 DC H2'' 1 35 DC H5 4.580 3.620 5.750 5.864 5.836 5.905 0.155 10 0 "[ . 1 ]" 2
279 1 35 DC H2'' 1 35 DC H6 3.710 3.220 4.400 3.894 3.811 3.960 . 0 0 "[ . 1 ]" 2
280 1 36 DG H2'' 1 36 DG H3' 2.970 2.540 3.600 2.834 2.822 2.846 . 0 0 "[ . 1 ]" 2
281 1 36 DG H2'' 1 36 DG H8 3.800 3.260 4.710 4.187 4.139 4.225 . 0 0 "[ . 1 ]" 2
282 1 1 DC H2' 1 1 DC H3' 2.730 2.320 3.960 2.283 2.276 2.288 0.044 8 0 "[ . 1 ]" 2
283 1 1 DC H2' 1 1 DC H6 2.760 2.350 3.900 2.645 2.575 2.712 . 0 0 "[ . 1 ]" 2
284 1 1 DC H2' 1 2 DG H8 4.410 3.870 6.220 3.822 3.780 3.920 0.090 8 0 "[ . 1 ]" 2
285 1 3 DT H2' 1 3 DT H6 2.830 2.010 4.440 2.084 2.055 2.114 . 0 0 "[ . 1 ]" 2
286 1 4 DG H2' 1 5 DC H5 4.120 3.600 5.520 3.711 3.579 3.898 0.021 12 0 "[ . 1 ]" 2
287 1 4 DG H2' 1 5 DC H6 4.210 3.680 4.940 3.988 3.825 4.172 . 0 0 "[ . 1 ]" 2
288 1 4 DG H2' 1 4 DG H8 2.690 2.280 3.920 2.324 2.293 2.346 . 0 0 "[ . 1 ]" 2
289 1 5 DC H2' 1 5 DC H5 3.870 3.370 4.570 4.435 4.358 4.489 . 0 0 "[ . 1 ]" 2
290 1 5 DC H2' 1 5 DC H6 2.600 . 3.840 2.621 2.553 2.719 . 0 0 "[ . 1 ]" 2
291 1 5 DC H2' 1 6 DA H8 5.050 3.970 6.530 3.936 3.826 4.153 0.144 9 0 "[ . 1 ]" 2
292 1 6 DA H2' 1 6 DA H8 2.710 2.300 3.880 2.451 2.394 2.533 . 0 0 "[ . 1 ]" 2
293 1 6 DA H2' 1 7 DG H8 3.490 3.020 4.620 2.987 2.906 3.092 0.114 2 0 "[ . 1 ]" 2
294 1 7 DG H2' 1 8 DC H5 4.630 4.070 6.040 4.181 4.022 4.382 0.048 10 0 "[ . 1 ]" 2
295 1 7 DG H2' 1 8 DC H6 4.730 3.740 6.460 4.475 4.301 4.639 . 0 0 "[ . 1 ]" 2
296 1 7 DG H2' 1 7 DG H8 2.690 2.280 3.300 2.356 2.228 2.460 0.052 9 0 "[ . 1 ]" 2
297 1 8 DC H2' 1 8 DC H5 4.240 2.970 5.050 4.428 4.396 4.450 . 0 0 "[ . 1 ]" 2
298 1 8 DC H2' 1 8 DC H6 3.080 2.640 4.640 2.518 2.420 2.594 0.220 10 0 "[ . 1 ]" 2
299 1 8 DC H2' 1 9 DG H8 4.740 4.170 5.960 4.125 4.032 4.267 0.138 7 0 "[ . 1 ]" 2
300 1 9 DG H2' 1 9 DG H8 2.890 2.470 4.180 2.401 2.360 2.428 0.110 8 0 "[ . 1 ]" 2
301 1 10 DG H2' 1 11 DC H5 4.130 3.610 4.850 3.753 3.615 4.016 . 0 0 "[ . 1 ]" 2
302 1 10 DG H2' 1 11 DC H6 3.230 2.780 4.450 2.988 2.866 3.181 . 0 0 "[ . 1 ]" 2
303 1 10 DG H2' 1 10 DG H8 2.740 2.330 3.830 2.438 2.397 2.481 . 0 0 "[ . 1 ]" 2
304 1 11 DC H2' 1 11 DC H5 3.890 3.390 4.590 4.624 4.590 4.657 0.067 2 0 "[ . 1 ]" 2
305 1 11 DC H2' 1 11 DC H6 2.530 . 3.480 2.795 2.665 2.923 . 0 0 "[ . 1 ]" 2
306 1 12 DT H2' 1 12 DT H6 3.200 2.750 4.360 3.118 2.990 3.192 . 0 0 "[ . 1 ]" 2
307 1 13 DT H2' 1 13 DT H3' 2.740 2.330 3.800 2.307 2.297 2.317 0.033 8 0 "[ . 1 ]" 2
308 1 13 DT H2' 1 13 DT H6 2.690 2.280 3.300 2.825 2.773 2.874 . 0 0 "[ . 1 ]" 2
309 1 14 DG H2' 1 15 DC H5 2.900 2.480 3.520 3.446 3.257 3.552 0.032 9 0 "[ . 1 ]" 2
310 1 14 DG H2' 1 14 DG H8 2.680 2.270 3.760 2.396 2.316 2.446 . 0 0 "[ . 1 ]" 2
311 1 15 DC H2' 1 15 DC H5 3.940 3.430 4.650 4.453 4.327 4.525 . 0 0 "[ . 1 ]" 2
312 1 15 DC H2' 1 16 DC H5 3.730 3.240 4.420 3.205 3.138 3.400 0.102 8 0 "[ . 1 ]" 2
313 1 16 DC H2' 1 16 DC H5 3.940 3.430 4.650 4.456 4.414 4.547 . 0 0 "[ . 1 ]" 2
314 1 17 DG H2' 1 17 DG H3' 2.990 . 3.620 2.277 2.228 2.330 . 0 0 "[ . 1 ]" 2
315 1 17 DG H2' 1 30 DC H5 4.160 3.560 4.960 4.284 4.165 4.382 . 0 0 "[ . 1 ]" 2
316 1 17 DG H2' 1 17 DG H8 3.080 2.640 4.140 2.561 2.518 2.639 0.122 10 0 "[ . 1 ]" 2
317 1 18 DG H2' 1 19 DC H5 4.040 2.970 5.440 3.008 2.854 3.095 0.116 9 0 "[ . 1 ]" 2
318 1 18 DG H2' 1 19 DC H6 3.820 3.320 4.520 3.234 3.170 3.301 0.150 3 0 "[ . 1 ]" 2
319 1 18 DG H2' 1 18 DG H8 2.770 2.360 3.380 2.737 2.629 2.864 . 0 0 "[ . 1 ]" 2
320 1 19 DC H2' 1 19 DC H6 2.590 . 3.740 2.353 2.142 2.433 . 0 0 "[ . 1 ]" 2
321 1 19 DC H2' 1 20 DA H8 3.430 2.960 4.100 3.355 2.886 3.489 0.074 11 0 "[ . 1 ]" 2
322 1 20 DA H2' 1 21 DC H5 3.640 3.160 4.320 3.353 3.297 3.389 . 0 0 "[ . 1 ]" 2
323 1 20 DA H2' 1 21 DC H6 3.750 3.260 4.440 3.198 3.119 3.234 0.141 11 0 "[ . 1 ]" 2
324 1 20 DA H2' 1 20 DA H8 2.620 2.220 3.630 2.353 2.221 2.445 . 0 0 "[ . 1 ]" 2
325 1 21 DC H2' 1 21 DC H5 4.500 4.090 5.110 4.614 4.549 4.640 . 0 0 "[ . 1 ]" 2
326 1 21 DC H2' 1 21 DC H6 2.810 2.390 4.080 2.575 2.551 2.604 . 0 0 "[ . 1 ]" 2
327 1 22 DT H2' 1 22 DT H6 2.870 2.450 3.490 2.546 2.186 2.718 0.264 7 0 "[ . 1 ]" 2
328 1 23 DT H2' 1 23 DT H3' 2.750 2.340 3.810 2.260 2.250 2.266 0.090 12 0 "[ . 1 ]" 2
329 1 23 DT H2' 1 23 DT H6 2.830 2.410 3.930 3.095 3.044 3.137 . 0 0 "[ . 1 ]" 2
330 1 25 DT H2' 1 25 DT H6 2.710 2.300 4.040 2.268 2.042 2.347 0.258 11 0 "[ . 1 ]" 2
331 1 26 DG H2' 1 27 DC H5 3.740 3.250 4.430 3.286 3.179 3.433 0.071 1 0 "[ . 1 ]" 2
332 1 26 DG H2' 1 27 DC H6 3.740 3.250 4.430 3.519 3.227 3.685 0.023 1 0 "[ . 1 ]" 2
333 1 26 DG H2' 1 26 DG H8 2.470 . 3.340 2.350 2.300 2.398 . 0 0 "[ . 1 ]" 2
334 1 27 DC H2' 1 27 DC H5 5.280 4.170 6.590 4.669 4.534 4.770 . 0 0 "[ . 1 ]" 2
335 1 27 DC H2' 1 27 DC H6 3.820 . 5.790 2.822 2.689 2.917 . 0 0 "[ . 1 ]" 2
336 1 28 DT H2' 1 28 DT H6 3.390 2.430 5.290 3.598 3.511 3.649 . 0 0 "[ . 1 ]" 2
337 1 29 DT H2' 1 29 DT H6 2.930 2.500 3.970 2.698 2.458 2.874 0.042 3 0 "[ . 1 ]" 2
338 1 31 DT H2' 1 31 DT H6 2.610 2.210 3.900 2.201 2.179 2.267 0.031 12 0 "[ . 1 ]" 2
339 1 31 DT H2' 1 31 DT M7 4.010 3.500 4.720 3.891 3.843 3.921 . 0 0 "[ . 1 ]" 2
340 1 32 DG H2' 1 33 DC H5 4.120 3.600 5.520 3.583 3.540 3.698 0.060 12 0 "[ . 1 ]" 2
341 1 32 DG H2' 1 32 DG H8 2.690 2.280 3.920 2.454 2.372 2.497 . 0 0 "[ . 1 ]" 2
342 1 33 DC H2' 1 33 DC H5 3.970 3.460 4.680 4.359 4.317 4.414 . 0 0 "[ . 1 ]" 2
343 1 33 DC H2' 1 33 DC H6 2.670 2.260 4.060 2.393 2.357 2.449 . 0 0 "[ . 1 ]" 2
344 1 33 DC H2' 1 34 DA H8 3.250 . 3.900 3.836 3.480 3.959 0.059 9 0 "[ . 1 ]" 2
345 1 34 DA H2' 1 35 DC H5 3.400 2.490 4.060 3.182 2.960 3.524 . 0 0 "[ . 1 ]" 2
346 1 34 DA H2' 1 35 DC H6 3.930 2.860 6.240 3.362 2.989 3.709 . 0 0 "[ . 1 ]" 2
347 1 34 DA H2' 1 34 DA H8 2.270 . 3.390 2.401 2.360 2.432 . 0 0 "[ . 1 ]" 2
348 1 35 DC H2' 1 35 DC H5 4.190 3.660 4.920 4.451 4.427 4.491 . 0 0 "[ . 1 ]" 2
349 1 35 DC H2' 1 35 DC H6 2.860 2.440 4.220 2.379 2.283 2.475 0.157 8 0 "[ . 1 ]" 2
350 1 36 DG H2' 1 36 DG H3' 3.090 2.650 3.730 2.346 2.342 2.350 0.308 5 0 "[ . 1 ]" 2
351 1 36 DG H2' 1 36 DG H8 3.290 2.830 3.950 2.698 2.633 2.747 0.197 8 0 "[ . 1 ]" 2
352 1 1 DC H3' 1 1 DC H6 4.030 3.520 5.290 3.470 3.400 3.620 0.120 10 0 "[ . 1 ]" 2
353 1 1 DC H3' 1 2 DG H8 4.560 4.000 5.320 4.951 4.846 5.041 . 0 0 "[ . 1 ]" 2
354 1 2 DG H3' 1 3 DT H6 4.950 4.360 5.740 5.271 5.197 5.378 . 0 0 "[ . 1 ]" 2
355 1 2 DG H3' 1 2 DG H8 3.810 3.310 5.160 4.010 3.905 4.156 . 0 0 "[ . 1 ]" 2
356 1 2 DG H3' 1 3 DT M7 4.940 3.760 6.290 4.528 4.396 4.712 . 0 0 "[ . 1 ]" 2
357 1 3 DT H3' 1 3 DT H6 4.120 3.600 4.840 3.755 3.700 3.840 . 0 0 "[ . 1 ]" 2
358 1 3 DT H3' 1 4 DG H8 4.890 4.310 5.670 5.051 4.751 5.255 . 0 0 "[ . 1 ]" 2
359 1 4 DG H3' 1 5 DC H5 4.820 3.740 5.600 5.522 5.360 5.638 0.038 3 0 "[ . 1 ]" 2
360 1 4 DG H3' 1 5 DC H6 4.810 4.230 5.590 5.014 4.918 5.115 . 0 0 "[ . 1 ]" 2
361 1 34 DA H3' 1 35 DC H6 4.920 3.850 5.710 4.722 4.422 5.114 . 0 0 "[ . 1 ]" 2
362 1 4 DG H3' 1 4 DG H8 3.820 3.320 5.060 4.224 4.112 4.330 . 0 0 "[ . 1 ]" 2
363 1 6 DA H3' 1 6 DA H8 3.900 3.400 5.770 4.158 4.056 4.213 . 0 0 "[ . 1 ]" 2
364 1 6 DA H3' 1 7 DG H8 4.390 3.850 6.010 4.786 4.659 5.035 . 0 0 "[ . 1 ]" 2
365 1 7 DG H3' 1 8 DC H6 4.830 3.760 5.610 5.416 5.289 5.501 . 0 0 "[ . 1 ]" 2
366 1 7 DG H3' 1 7 DG H8 4.750 3.770 4.820 4.415 4.263 4.556 . 0 0 "[ . 1 ]" 2
367 1 9 DG H3' 1 9 DG H8 3.870 3.370 5.000 3.988 3.886 4.089 . 0 0 "[ . 1 ]" 2
368 1 9 DG H3' 1 10 DG H8 4.640 4.080 5.400 4.530 4.368 4.808 . 0 0 "[ . 1 ]" 2
369 1 10 DG H3' 1 11 DC H5 4.920 3.860 6.180 5.791 5.581 6.020 . 0 0 "[ . 1 ]" 2
370 1 10 DG H3' 1 11 DC H6 4.640 4.080 5.400 4.667 4.472 4.866 . 0 0 "[ . 1 ]" 2
371 1 10 DG H3' 1 10 DG H8 3.720 3.230 4.410 4.003 3.914 4.068 . 0 0 "[ . 1 ]" 2
372 1 22 DT H1' 1 22 DT H3' 4.660 3.680 5.430 3.969 3.894 4.003 . 0 0 "[ . 1 ]" 2
373 1 11 DC H3' 1 11 DC H6 4.500 3.950 5.250 4.228 4.179 4.313 . 0 0 "[ . 1 ]" 2
374 1 12 DT H3' 1 12 DT H6 4.150 3.130 5.980 4.102 4.021 4.169 . 0 0 "[ . 1 ]" 2
375 1 12 DT H3' 1 13 DT M7 4.070 3.610 4.610 2.892 2.825 2.915 0.785 11 12 [********-*+*] 2
376 1 13 DT H3' 1 13 DT H6 4.160 3.630 5.460 4.057 3.928 4.154 . 0 0 "[ . 1 ]" 2
377 1 13 DT H3' 1 13 DT M7 4.300 3.760 5.040 5.546 5.445 5.638 0.598 9 6 "[ * ** +* -]" 2
378 1 15 DC H3' 1 16 DC H5 4.970 4.370 5.770 5.137 5.069 5.277 . 0 0 "[ . 1 ]" 2
379 1 15 DC H3' 1 15 DC H6 3.550 3.070 4.230 3.792 3.676 3.950 . 0 0 "[ . 1 ]" 2
380 1 15 DC H3' 1 16 DC H6 3.940 3.430 4.650 4.697 4.653 4.782 0.132 9 0 "[ . 1 ]" 2
381 1 16 DC H3' 1 16 DC H6 4.250 3.150 5.630 3.587 3.439 3.813 . 0 0 "[ . 1 ]" 2
382 1 17 DG H3' 1 30 DC H5 4.980 4.360 5.800 6.249 6.037 6.427 0.627 5 4 "[- + * 1* ]" 2
383 1 17 DG H3' 1 17 DG H8 3.700 3.210 4.390 4.220 3.923 4.402 0.012 11 0 "[ . 1 ]" 2
384 1 18 DG H3' 1 19 DC H5 4.180 3.650 4.910 4.877 4.599 4.945 0.035 12 0 "[ . 1 ]" 2
385 1 18 DG H3' 1 19 DC H6 5.040 4.010 5.830 4.666 4.435 4.765 . 0 0 "[ . 1 ]" 2
386 1 18 DG H3' 1 18 DG H8 4.040 3.520 5.390 3.556 3.457 3.790 0.063 7 0 "[ . 1 ]" 2
387 1 19 DC H3' 1 19 DC H6 4.040 3.520 5.320 3.495 3.457 3.517 0.063 9 0 "[ . 1 ]" 2
388 1 19 DC H3' 1 20 DA H8 4.850 4.270 5.630 4.853 4.398 5.011 . 0 0 "[ . 1 ]" 2
389 1 20 DA H3' 1 21 DC H5 4.300 3.760 5.040 5.118 5.001 5.157 0.117 3 0 "[ . 1 ]" 2
390 1 20 DA H3' 1 21 DC H6 4.610 4.050 5.370 4.527 4.403 4.599 . 0 0 "[ . 1 ]" 2
391 1 20 DA H3' 1 20 DA H8 3.440 2.970 4.110 4.071 3.991 4.145 0.035 2 0 "[ . 1 ]" 2
392 1 21 DC H3' 1 21 DC H6 4.490 3.150 6.030 4.122 4.072 4.167 . 0 0 "[ . 1 ]" 2
393 1 22 DT H3' 1 22 DT H6 4.560 4.000 5.320 4.053 3.901 4.484 0.099 1 0 "[ . 1 ]" 2
394 1 22 DT H3' 1 23 DT M7 4.090 3.610 4.940 2.842 2.819 2.916 0.791 1 12 [+*********-*] 2
395 1 23 DT H3' 1 23 DT H6 4.080 3.560 5.310 3.477 3.401 3.507 0.159 11 0 "[ . 1 ]" 2
396 1 23 DT H3' 1 23 DT M7 4.360 3.820 5.100 4.501 4.465 4.516 . 0 0 "[ . 1 ]" 2
397 1 24 DG H3' 1 25 DT H6 4.960 4.350 5.770 5.561 5.423 5.835 0.065 11 0 "[ . 1 ]" 2
398 1 24 DG H3' 1 24 DG H8 3.870 3.370 4.980 4.156 3.838 4.466 . 0 0 "[ . 1 ]" 2
399 1 24 DG H3' 1 25 DT M7 4.960 3.790 5.770 4.559 4.344 4.943 . 0 0 "[ . 1 ]" 2
400 1 25 DT H3' 1 25 DT H6 3.680 3.190 4.370 3.667 3.554 4.140 . 0 0 "[ . 1 ]" 2
401 1 25 DT H3' 1 26 DG H8 5.080 4.480 5.880 4.817 4.602 4.947 . 0 0 "[ . 1 ]" 2
402 1 26 DG H3' 1 27 DC H5 4.500 3.490 5.250 5.259 5.133 5.351 0.101 10 0 "[ . 1 ]" 2
403 1 26 DG H3' 1 26 DG H8 3.670 3.180 5.340 3.886 3.685 3.987 . 0 0 "[ . 1 ]" 2
404 1 27 DC H3' 1 27 DC H6 4.800 3.750 6.260 3.572 3.134 3.756 0.616 3 1 "[ + . 1 ]" 2
405 1 28 DT H3' 1 28 DT H6 4.920 4.310 5.730 4.543 4.468 4.589 . 0 0 "[ . 1 ]" 2
406 1 28 DT H3' 1 29 DT M7 4.070 3.610 4.610 2.918 2.850 3.051 0.760 3 12 [*-+*********] 2
407 1 29 DT H3' 1 29 DT H6 3.820 3.320 4.520 3.779 3.526 4.021 . 0 0 "[ . 1 ]" 2
408 1 30 DC H3' 1 30 DC H6 3.540 3.070 4.710 3.908 3.758 4.175 . 0 0 "[ . 1 ]" 2
409 1 30 DC H3' 1 31 DT M7 3.820 3.320 4.520 3.216 2.602 3.706 0.718 9 1 "[ . +1 ]" 2
410 1 31 DT H3' 1 31 DT H6 3.930 3.420 5.430 3.501 3.409 3.593 0.011 9 0 "[ . 1 ]" 2
411 1 31 DT H3' 1 32 DG H8 4.940 4.350 5.730 4.774 4.587 4.947 . 0 0 "[ . 1 ]" 2
412 1 31 DT H3' 1 31 DT M7 4.920 4.300 5.740 5.074 4.999 5.154 . 0 0 "[ . 1 ]" 2
413 1 32 DG H3' 1 33 DC H5 4.820 3.730 5.600 5.413 5.310 5.598 . 0 0 "[ . 1 ]" 2
414 1 32 DG H3' 1 33 DC H6 4.770 4.200 5.540 4.897 4.794 4.986 . 0 0 "[ . 1 ]" 2
415 1 32 DG H3' 1 32 DG H8 3.820 3.320 5.060 3.988 3.848 4.139 . 0 0 "[ . 1 ]" 2
416 1 33 DC H3' 1 33 DC H6 4.100 3.580 5.380 3.712 3.616 3.817 . 0 0 "[ . 1 ]" 2
417 1 33 DC H3' 1 34 DA H8 4.740 4.170 5.510 4.826 4.738 4.942 . 0 0 "[ . 1 ]" 2
418 1 34 DA H3' 1 35 DC H5 5.010 3.720 6.500 5.019 4.628 5.532 . 0 0 "[ . 1 ]" 2
419 1 34 DA H3' 1 34 DA H8 3.400 2.940 4.060 3.649 3.433 3.923 . 0 0 "[ . 1 ]" 2
420 1 36 DG H3' 1 36 DG H8 3.470 3.000 4.140 4.081 3.964 4.171 0.031 5 0 "[ . 1 ]" 2
421 1 11 DC H5 1 13 DT M7 4.380 3.210 5.540 4.517 4.312 4.568 . 0 0 "[ . 1 ]" 2
422 1 15 DC H5 1 16 DC H5 4.920 4.330 5.710 4.719 4.612 4.824 . 0 0 "[ . 1 ]" 2
423 1 21 DC H5 1 23 DT M7 4.490 3.160 5.830 4.817 4.675 4.874 . 0 0 "[ . 1 ]" 2
424 1 27 DC H5 1 29 DT M7 4.380 3.210 5.540 4.271 3.890 4.559 . 0 0 "[ . 1 ]" 2
425 1 30 DC H5 1 31 DT M7 4.560 4.000 5.320 3.967 3.439 4.284 0.561 6 1 "[ .+ 1 ]" 2
426 1 1 DC H6 1 2 DG H8 5.000 4.370 5.830 6.373 6.353 6.403 0.573 8 12 [**-****+****] 2
427 1 3 DT H6 1 4 DG H8 4.800 4.220 5.580 5.058 4.347 5.486 . 0 0 "[ . 1 ]" 2
428 1 5 DC H6 1 6 DA H8 5.050 4.420 5.880 6.279 6.157 6.389 0.509 10 1 "[ . + ]" 2
429 1 8 DC H6 1 9 DG H8 5.010 4.360 5.860 6.412 6.157 6.585 0.725 11 9 "[****** *1+-]" 2
430 1 11 DC H6 1 13 DT M7 4.020 3.080 5.250 4.076 3.885 4.285 . 0 0 "[ . 1 ]" 2
431 1 15 DC H6 1 16 DC H5 3.430 2.960 4.100 4.121 4.049 4.188 0.088 10 0 "[ . 1 ]" 2
432 1 16 DC H6 1 17 DG H8 4.550 3.990 5.310 5.524 5.403 5.688 0.378 10 0 "[ . 1 ]" 2
433 1 19 DC H6 1 20 DA H8 4.700 4.130 5.470 5.400 4.434 5.533 0.063 2 0 "[ . 1 ]" 2
434 1 21 DC H6 1 23 DT M7 4.300 3.220 5.650 4.125 4.067 4.296 . 0 0 "[ . 1 ]" 2
435 1 22 DT H6 1 23 DT H6 5.020 4.410 5.830 6.255 6.064 6.334 0.504 10 1 "[ . + ]" 2
436 1 25 DT H6 1 26 DG H8 4.750 4.180 6.270 5.083 4.196 5.303 . 0 0 "[ . 1 ]" 2
437 1 27 DC H6 1 29 DT M7 4.260 3.650 5.070 4.152 3.954 4.260 . 0 0 "[ . 1 ]" 2
438 1 30 DC H6 1 31 DT M7 3.820 3.320 4.520 3.613 3.094 3.784 0.226 6 0 "[ . 1 ]" 2
439 1 31 DT H6 1 32 DG H8 4.230 3.700 4.960 5.027 4.967 5.050 0.090 5 0 "[ . 1 ]" 2
440 1 33 DC H6 1 34 DA H8 5.060 3.890 5.880 6.044 5.599 6.251 0.371 10 0 "[ . 1 ]" 2
441 1 35 DC H6 1 36 DG H8 4.450 3.900 5.200 5.217 5.103 5.289 0.089 2 0 "[ . 1 ]" 2
442 1 2 DG H8 1 3 DT H6 4.570 4.010 5.330 5.441 5.373 5.494 0.164 1 0 "[ . 1 ]" 2
443 1 2 DG H8 1 3 DT M7 3.750 3.260 4.440 3.444 3.346 3.494 . 0 0 "[ . 1 ]" 2
444 1 4 DG H8 1 5 DC H5 4.110 3.590 4.830 4.520 4.212 4.764 . 0 0 "[ . 1 ]" 2
445 1 4 DG H8 1 5 DC H6 4.800 3.730 5.580 5.605 5.389 5.682 0.102 2 0 "[ . 1 ]" 2
446 1 6 DA H8 1 7 DG H8 4.580 4.020 5.930 4.335 4.086 4.659 . 0 0 "[ . 1 ]" 2
447 1 7 DG H8 1 8 DC H5 4.560 4.000 5.320 4.750 4.195 5.168 . 0 0 "[ . 1 ]" 2
448 1 7 DG H8 1 8 DC H6 5.060 4.460 5.860 5.808 5.449 6.048 0.188 11 0 "[ . 1 ]" 2
449 1 9 DG H8 1 10 DG H8 5.000 4.000 5.800 4.796 4.341 5.446 . 0 0 "[ . 1 ]" 2
450 1 10 DG H8 1 11 DC H5 4.260 3.730 5.440 4.017 3.771 4.581 . 0 0 "[ . 1 ]" 2
451 1 10 DG H8 1 11 DC H6 4.910 4.330 6.250 4.620 4.421 4.906 . 0 0 "[ . 1 ]" 2
452 1 14 DG H8 1 15 DC H5 4.420 3.870 5.170 4.317 4.115 4.585 . 0 0 "[ . 1 ]" 2
453 1 14 DG H8 1 15 DC H6 4.320 3.780 5.060 5.118 5.072 5.156 0.096 2 0 "[ . 1 ]" 2
454 1 17 DG H8 1 30 DC H5 4.270 3.740 5.000 5.171 5.049 5.234 0.234 6 0 "[ . 1 ]" 2
455 1 18 DG H8 1 19 DC H5 4.570 4.010 6.080 4.582 4.416 4.705 . 0 0 "[ . 1 ]" 2
456 1 18 DG H8 1 19 DC H6 4.930 3.860 5.720 5.771 5.684 5.832 0.112 3 0 "[ . 1 ]" 2
457 1 20 DA H8 1 21 DC H5 3.830 3.330 4.530 3.662 3.249 3.948 0.081 11 0 "[ . 1 ]" 2
458 1 20 DA H8 1 21 DC H6 4.750 4.180 6.150 4.787 4.361 5.029 . 0 0 "[ . 1 ]" 2
459 1 24 DG H8 1 25 DT H6 5.040 3.980 5.840 5.632 4.807 5.907 0.067 2 0 "[ . 1 ]" 2
460 1 24 DG H8 1 25 DT M7 3.950 3.440 4.660 3.321 2.702 3.560 0.738 12 3 "[ .- 1*+]" 2
461 1 26 DG H8 1 27 DC H5 4.000 3.490 5.170 4.028 3.474 4.458 0.016 1 0 "[ . 1 ]" 2
462 1 26 DG H8 1 27 DC H6 4.740 4.170 5.510 5.295 4.828 5.532 0.022 6 0 "[ . 1 ]" 2
463 1 32 DG H8 1 33 DC H5 4.110 3.590 4.830 4.852 4.724 4.911 0.081 3 0 "[ . 1 ]" 2
464 1 32 DG H8 1 33 DC H6 4.600 4.040 6.070 5.762 5.454 5.890 . 0 0 "[ . 1 ]" 2
465 1 34 DA H8 1 35 DC H5 3.780 2.850 4.470 4.438 4.263 4.520 0.050 2 0 "[ . 1 ]" 2
466 1 34 DA H8 1 35 DC H6 4.590 3.510 6.580 5.466 5.197 5.740 . 0 0 "[ . 1 ]" 2
467 1 35 DC H1' 1 35 DC H5 4.980 4.300 5.660 5.508 5.499 5.517 . 0 0 "[ . 1 ]" 2
468 1 21 DC H2'' 1 22 DT H6 3.430 3.020 4.710 3.658 3.207 4.772 0.062 2 0 "[ . 1 ]" 2
469 1 27 DC H1' 1 28 DT H1' 4.590 4.050 5.330 5.313 4.949 6.295 0.965 3 1 "[ + . 1 ]" 2
470 1 29 DT H2'' 1 29 DT H3' 2.890 2.470 3.510 2.788 2.750 2.842 . 0 0 "[ . 1 ]" 2
471 1 29 DT H2' 1 29 DT H3' 2.740 2.330 3.800 2.294 2.278 2.314 0.052 7 0 "[ . 1 ]" 2
472 1 29 DT H3' 1 29 DT M7 4.560 4.020 5.300 5.344 5.091 5.574 0.274 11 0 "[ . 1 ]" 2
473 1 8 DC H1' 1 9 DG H8 4.990 4.640 5.540 5.811 5.738 5.921 0.381 5 0 "[ . 1 ]" 2
474 1 1 DC H2'' 1 2 DG H8 3.610 2.960 4.160 3.332 3.043 3.598 . 0 0 "[ . 1 ]" 2
475 1 9 DG H2'' 1 10 DG H8 2.540 . 3.190 2.605 2.569 2.634 . 0 0 "[ . 1 ]" 2
476 1 14 DG H2'' 1 15 DC H6 2.480 . 3.010 2.516 2.391 2.694 . 0 0 "[ . 1 ]" 2
477 1 15 DC H2'' 1 16 DC H6 2.550 2.010 3.060 2.620 2.551 2.703 . 0 0 "[ . 1 ]" 2
478 1 16 DC H2'' 1 17 DG H8 2.440 . 3.000 2.414 2.332 2.478 . 0 0 "[ . 1 ]" 2
479 1 17 DG H2'' 1 30 DC H6 3.220 2.690 3.670 3.551 3.401 3.800 0.130 7 0 "[ . 1 ]" 2
480 1 25 DT H2'' 1 26 DG H8 2.770 2.230 3.340 2.645 2.546 2.801 . 0 0 "[ . 1 ]" 2
481 1 30 DC Q2' 1 31 DT H6 3.420 2.870 3.530 2.849 2.656 2.989 0.214 6 0 "[ . 1 ]" 2
482 1 32 DG H2'' 1 33 DC H6 2.520 . 3.060 2.550 2.428 2.637 . 0 0 "[ . 1 ]" 2
483 1 35 DC H2'' 1 36 DG H8 2.560 . 3.090 2.598 2.542 2.674 . 0 0 "[ . 1 ]" 2
484 1 3 DT H2' 1 4 DG H8 3.330 2.740 3.850 3.611 3.151 3.920 0.070 11 0 "[ . 1 ]" 2
485 1 9 DG H2' 1 10 DG H8 3.600 3.080 4.110 3.054 2.842 3.585 0.238 2 0 "[ . 1 ]" 2
486 1 14 DG H2' 1 15 DC H6 2.940 2.410 3.530 3.143 2.947 3.472 . 0 0 "[ . 1 ]" 2
487 1 15 DC H2' 1 16 DC H6 3.260 2.760 3.840 3.365 3.272 3.565 . 0 0 "[ . 1 ]" 2
488 1 16 DC H2' 1 17 DG H8 3.480 2.960 4.050 3.577 3.403 3.779 . 0 0 "[ . 1 ]" 2
489 1 17 DG H2' 1 30 DC H6 4.290 3.770 4.850 4.893 4.612 5.058 0.208 3 0 "[ . 1 ]" 2
490 1 25 DT H2' 1 26 DG H8 2.810 2.230 3.340 3.297 2.935 3.424 0.084 6 0 "[ . 1 ]" 2
491 1 31 DT H2' 1 32 DG H8 3.100 2.560 3.630 3.213 3.058 3.354 . 0 0 "[ . 1 ]" 2
492 1 32 DG H2' 1 33 DC H6 3.770 3.220 4.290 3.715 3.388 3.953 . 0 0 "[ . 1 ]" 2
493 1 35 DC H2' 1 36 DG H8 3.020 2.370 3.550 3.145 2.917 3.446 . 0 0 "[ . 1 ]" 2
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