NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
538620 |
2lkx   |
18015 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lkx
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 1401
_Distance_constraint_stats_list.Viol_count 667
_Distance_constraint_stats_list.Viol_total 3638.069
_Distance_constraint_stats_list.Viol_max 1.919
_Distance_constraint_stats_list.Viol_rms 0.0728
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0090
_Distance_constraint_stats_list.Viol_average_violations_only 0.3208
_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 3 GLN 0.000 0.000 . 0 "[ . 1 . ]"
1 4 ARG 5.350 1.360 17 4 "[ .* - 1 .*+]"
1 5 ARG 5.350 1.360 17 4 "[ .* - 1 .*+]"
1 6 GLN 0.594 0.594 8 1 "[ . + 1 . ]"
1 7 ARG 0.768 0.719 6 1 "[ .+ 1 . ]"
1 8 THR 0.515 0.304 1 0 "[ . 1 . ]"
1 9 HIS 0.000 0.000 . 0 "[ . 1 . ]"
1 10 PHE 7.956 1.526 1 6 "[+ *. *- * * ]"
1 11 THR 0.040 0.040 4 0 "[ . 1 . ]"
1 12 SER 0.173 0.173 3 0 "[ . 1 . ]"
1 13 GLN 0.173 0.173 3 0 "[ . 1 . ]"
1 14 GLN 9.105 0.859 14 2 "[ . 1 -+. ]"
1 15 LEU 1.803 0.408 13 0 "[ . 1 . ]"
1 16 GLN 6.470 1.041 14 2 "[ - . 1 +. ]"
1 17 GLU 3.718 0.759 3 1 "[ + . 1 . ]"
1 18 LEU 0.118 0.118 11 0 "[ . 1 . ]"
1 19 GLU 11.707 1.068 9 8 "[ - ** * +* ** ]"
1 20 ALA 2.809 1.041 14 1 "[ . 1 +. ]"
1 21 THR 0.266 0.266 12 0 "[ . 1 . ]"
1 22 PHE 1.050 0.380 17 0 "[ . 1 . ]"
1 23 GLN 11.081 1.243 6 7 "[ .+- *1* *.**]"
1 24 ARG 5.909 1.243 6 4 "[ .+- *1 *. ]"
1 25 ASN 0.044 0.044 4 0 "[ . 1 . ]"
1 26 ARG 0.309 0.118 9 0 "[ . 1 . ]"
1 27 TYR 0.000 0.000 . 0 "[ . 1 . ]"
1 28 PRO 0.070 0.070 6 0 "[ . 1 . ]"
1 29 ASP 12.372 0.844 4 7 "[* +. * - *** ]"
1 30 MET 0.010 0.010 15 0 "[ . 1 . ]"
1 31 SER 1.309 0.324 16 0 "[ . 1 . ]"
1 32 THR 5.896 0.833 1 5 "[+ *. * - *. ]"
1 33 ARG 8.980 1.007 17 7 "[* *. * 1 -** +]"
1 34 GLU 0.871 0.280 5 0 "[ . 1 . ]"
1 35 GLU 1.508 0.324 16 0 "[ . 1 . ]"
1 36 ILE 0.000 0.000 . 0 "[ . 1 . ]"
1 37 ALA 0.568 0.141 13 0 "[ . 1 . ]"
1 38 VAL 4.754 0.633 12 4 "[ - . * + .* ]"
1 39 TRP 4.864 0.633 12 4 "[ - . * + .* ]"
1 40 THR 2.179 0.331 1 0 "[ . 1 . ]"
1 41 ASN 0.520 0.125 15 0 "[ . 1 . ]"
1 42 LEU 10.955 0.859 14 5 "[ * . ** -+. ]"
1 43 THR 3.672 0.656 11 1 "[ . 1+ . ]"
1 44 GLU 1.737 1.007 17 2 "[ . 1 -. +]"
1 45 ALA 0.000 0.000 . 0 "[ . 1 . ]"
1 46 ARG 1.833 0.679 10 2 "[ - . + . ]"
1 47 VAL 1.964 0.656 11 1 "[ . 1+ . ]"
1 48 ARG 1.836 0.596 11 1 "[ . 1+ . ]"
1 49 VAL 6.643 1.054 10 5 "[* . * + * - ]"
1 50 TRP 18.676 1.320 6 8 "[ * *+- ** .**]"
1 51 PHE 0.000 0.000 . 0 "[ . 1 . ]"
1 52 LYS 20.502 1.124 13 12 "[* *******1- +** ]"
1 53 ASN 6.214 1.090 16 2 "[ . 1 - .+ ]"
1 54 ARG 14.633 1.320 6 7 "[ *.+* ** *- ]"
1 55 ARG 2.548 0.725 4 3 "[ +. 1- * ]"
1 56 ALA 0.246 0.094 10 0 "[ . 1 . ]"
1 57 LYS 0.041 0.041 7 0 "[ . 1 . ]"
1 58 TRP 24.631 1.919 12 11 "[ ** .** *1 +***-*]"
1 59 ARG 23.559 1.919 12 9 "[ ** . * 1 +***-*]"
1 60 LYS 0.890 0.590 13 1 "[ . 1 + . ]"
1 61 ARG 0.000 0.000 . 0 "[ . 1 . ]"
1 62 GLU 5.865 1.801 7 2 "[ .-+ 1 . ]"
1 63 GLU 1.637 0.975 9 2 "[ . +1 .- ]"
1 64 PHE 4.374 1.027 16 3 "[ - . 1 *+ ]"
1 65 ILE 2.036 0.565 13 1 "[ . 1 + . ]"
1 66 VAL 0.012 0.012 12 0 "[ . 1 . ]"
1 67 THR 0.000 0.000 . 0 "[ . 1 . ]"
1 68 ASP 0.000 0.000 . 0 "[ . 1 . ]"
2 1 DG 5.602 0.699 15 3 "[ - 1 *+ ]"
2 2 DC 13.774 0.699 15 3 "[ - 1 *+ ]"
2 3 DT 0.413 0.208 15 0 "[ . 1 . ]"
2 4 DC 0.065 0.065 12 0 "[ . 1 . ]"
2 5 DT 0.655 0.590 13 1 "[ . 1 + . ]"
2 6 DA 19.300 1.526 1 8 "[+ *.*** * - * ]"
2 7 DA 0.381 0.227 2 0 "[ . 1 . ]"
2 8 DT 5.290 0.705 8 1 "[ . + 1 . ]"
2 9 DC 13.056 1.114 6 5 "[ .+*- 1 * .* ]"
2 10 DC 1.052 0.575 9 1 "[ . +1 . ]"
2 11 DC 0.000 0.000 . 0 "[ . 1 . ]"
2 12 DC 3.391 0.772 2 2 "[-+ . 1 . ]"
2 13 DG 3.391 0.772 2 2 "[-+ . 1 . ]"
3 1 DC 7.098 0.620 8 3 "[ . *+ - . ]"
3 2 DG 7.098 0.620 8 3 "[ . *+ - . ]"
3 3 DG 2.454 0.724 15 2 "[ . 1- + ]"
3 4 DG 8.214 1.114 6 5 "[ .+* 1 * *- ]"
3 5 DG 11.844 1.124 13 9 "[* * ****-1 +*. ]"
3 6 DA 5.385 0.611 16 1 "[ . 1 .+ ]"
3 7 DT 8.479 1.360 17 4 "[ .* * 1 .-+]"
3 8 DT 2.452 0.560 14 1 "[ . 1 +. ]"
3 9 DA 4.697 0.670 16 2 "[ . 1 -.+ ]"
3 10 DG 2.469 0.670 16 1 "[ . 1 .+ ]"
3 11 DA 0.006 0.006 6 0 "[ . 1 . ]"
3 12 DG 15.458 0.859 13 5 "[ -. 1 *+*.* ]"
3 13 DC 11.083 0.859 13 5 "[ -. 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 3 GLN HA 1 4 ARG H 3.080 . 3.580 2.447 2.082 3.227 . 0 0 "[ . 1 . ]" 1
2 1 3 GLN QB 1 4 ARG H 4.960 . 5.460 3.624 2.663 4.094 . 0 0 "[ . 1 . ]" 1
3 1 3 GLN HB2 1 4 ARG H 5.030 . 5.530 4.268 2.700 4.632 . 0 0 "[ . 1 . ]" 1
4 1 3 GLN HB3 1 4 ARG H 5.030 . 5.530 4.017 2.957 4.562 . 0 0 "[ . 1 . ]" 1
5 1 3 GLN QG 1 4 ARG H 5.770 . 6.270 3.836 2.366 4.980 . 0 0 "[ . 1 . ]" 1
6 1 4 ARG H 1 4 ARG QD 5.250 . 5.750 4.075 2.282 4.698 . 0 0 "[ . 1 . ]" 1
7 1 4 ARG H 1 4 ARG QG 4.160 . 4.660 2.803 2.116 3.673 . 0 0 "[ . 1 . ]" 1
8 1 4 ARG H 1 5 ARG H 5.000 . 5.500 4.396 1.997 4.686 . 0 0 "[ . 1 . ]" 1
9 1 4 ARG HA 1 5 ARG H 3.290 . 3.790 2.419 2.125 3.555 . 0 0 "[ . 1 . ]" 1
10 1 4 ARG QB 1 4 ARG HE 4.480 . 4.980 3.346 2.037 4.226 . 0 0 "[ . 1 . ]" 1
11 1 4 ARG QB 1 5 ARG H 3.390 . 3.890 2.564 1.942 3.229 . 0 0 "[ . 1 . ]" 1
12 1 4 ARG HB3 2 6 DA H2 6.730 . 7.230 5.338 4.288 7.183 . 0 0 "[ . 1 . ]" 1
13 1 4 ARG HB3 2 7 DA H1' 6.730 . 7.230 5.318 3.548 6.884 . 0 0 "[ . 1 . ]" 1
14 1 4 ARG HB3 3 9 DA H5' 6.730 . 7.230 4.879 3.203 6.276 . 0 0 "[ . 1 . ]" 1
15 1 4 ARG HB3 3 10 DG H5' 6.730 . 7.230 3.164 2.198 5.012 . 0 0 "[ . 1 . ]" 1
16 1 4 ARG QD 1 5 ARG H 5.520 . 6.020 4.248 3.222 5.328 . 0 0 "[ . 1 . ]" 1
17 1 4 ARG QD 2 6 DA H2 7.560 . 8.060 3.127 2.238 5.259 . 0 0 "[ . 1 . ]" 1
18 1 4 ARG QD 2 7 DA H1' 7.560 . 8.060 3.454 2.327 5.900 . 0 0 "[ . 1 . ]" 1
19 1 4 ARG QD 3 7 DT H1' 7.560 . 8.060 7.783 6.385 9.420 1.360 17 4 "[ .* * 1 .-+]" 1
20 1 4 ARG QD 3 9 DA H1' 7.560 . 8.060 3.176 2.176 5.496 . 0 0 "[ . 1 . ]" 1
21 1 4 ARG QD 3 10 DG H3' 7.560 . 8.060 5.595 2.127 7.333 . 0 0 "[ . 1 . ]" 1
22 1 4 ARG QD 3 10 DG H8 7.560 . 8.060 5.992 5.335 6.606 . 0 0 "[ . 1 . ]" 1
23 1 4 ARG QG 2 6 DA H2 7.210 . 7.710 4.893 3.487 7.578 . 0 0 "[ . 1 . ]" 1
24 1 4 ARG QG 2 7 DA H1' 7.210 . 7.710 4.652 3.713 5.879 . 0 0 "[ . 1 . ]" 1
25 1 4 ARG QG 2 8 DT H1' 7.210 . 7.710 7.195 4.913 8.222 0.512 8 1 "[ . + 1 . ]" 1
26 1 4 ARG QG 3 9 DA H5' 7.210 . 7.710 5.219 2.969 6.659 . 0 0 "[ . 1 . ]" 1
27 1 4 ARG QG 3 10 DG H3' 7.210 . 7.710 5.965 4.168 6.677 . 0 0 "[ . 1 . ]" 1
28 1 4 ARG QG 3 10 DG H5' 7.210 . 7.710 3.618 2.548 4.977 . 0 0 "[ . 1 . ]" 1
29 1 5 ARG H 1 5 ARG QG 4.620 . 5.120 3.121 2.142 4.033 . 0 0 "[ . 1 . ]" 1
30 1 5 ARG H 1 6 GLN H 4.450 . 4.950 4.474 3.799 4.706 . 0 0 "[ . 1 . ]" 1
31 1 5 ARG HA 1 6 GLN H 2.840 . 3.340 2.293 2.115 2.716 . 0 0 "[ . 1 . ]" 1
32 1 5 ARG HA 1 6 GLN QE 5.800 . 6.300 4.548 2.974 5.363 . 0 0 "[ . 1 . ]" 1
33 1 5 ARG HA 1 6 GLN QG 4.110 . 4.610 3.608 3.183 4.121 . 0 0 "[ . 1 . ]" 1
34 1 5 ARG QB 1 6 GLN H 4.200 . 4.700 2.652 1.929 3.871 . 0 0 "[ . 1 . ]" 1
35 1 5 ARG QD 1 6 GLN H 5.120 . 5.620 4.488 3.860 5.183 . 0 0 "[ . 1 . ]" 1
36 1 5 ARG QG 1 6 GLN H 4.000 . 4.570 3.453 2.114 4.081 . 0 0 "[ . 1 . ]" 1
37 1 6 GLN H 1 6 GLN QB 3.470 . 3.970 2.735 2.414 2.993 . 0 0 "[ . 1 . ]" 1
38 1 6 GLN H 1 6 GLN QG 3.940 . 4.440 2.609 1.841 3.416 . 0 0 "[ . 1 . ]" 1
39 1 6 GLN H 1 7 ARG H 4.200 . 4.700 3.760 2.606 4.631 . 0 0 "[ . 1 . ]" 1
40 1 6 GLN HA 1 7 ARG H 3.510 . 4.010 2.907 2.153 3.552 . 0 0 "[ . 1 . ]" 1
41 1 6 GLN QB 1 7 ARG H 3.760 . 4.260 2.369 2.056 2.986 . 0 0 "[ . 1 . ]" 1
42 1 6 GLN QB 2 6 DA H3' 6.730 . 7.230 6.401 5.900 7.824 0.594 8 1 "[ . + 1 . ]" 1
43 1 6 GLN QE 1 7 ARG H 5.990 . 6.490 5.010 4.079 5.799 . 0 0 "[ . 1 . ]" 1
44 1 6 GLN QG 1 7 ARG H 4.330 . 4.830 4.050 3.261 4.397 . 0 0 "[ . 1 . ]" 1
45 1 7 ARG H 1 7 ARG HB2 4.080 . 4.580 3.008 2.548 3.602 . 0 0 "[ . 1 . ]" 1
46 1 7 ARG H 1 7 ARG QB 3.700 . 4.200 2.844 2.482 3.378 . 0 0 "[ . 1 . ]" 1
47 1 7 ARG H 1 7 ARG HB3 4.080 . 4.580 3.649 3.052 4.087 . 0 0 "[ . 1 . ]" 1
48 1 7 ARG H 1 7 ARG QD 4.860 . 5.360 4.837 4.493 5.173 . 0 0 "[ . 1 . ]" 1
49 1 7 ARG H 1 7 ARG QG 4.380 . 4.880 3.717 2.575 4.449 . 0 0 "[ . 1 . ]" 1
50 1 7 ARG H 1 8 THR H 4.790 . 5.290 4.064 3.131 4.589 . 0 0 "[ . 1 . ]" 1
51 1 7 ARG HA 1 8 THR H 3.270 . 3.770 2.369 2.011 2.891 . 0 0 "[ . 1 . ]" 1
52 1 7 ARG QB 1 8 THR H 4.870 . 5.370 3.083 1.791 4.104 0.009 3 0 "[ . 1 . ]" 1
53 1 7 ARG HD2 2 6 DA H1' 6.000 . 6.500 4.693 3.080 6.515 0.015 7 0 "[ . 1 . ]" 1
54 1 7 ARG HD2 3 9 DA H2 6.000 . 6.500 3.763 2.238 6.422 . 0 0 "[ . 1 . ]" 1
55 1 7 ARG HD3 2 6 DA H1' 6.000 . 6.500 5.572 3.887 7.219 0.719 6 1 "[ .+ 1 . ]" 1
56 1 7 ARG QG 1 8 THR H 4.980 . 5.100 3.217 2.196 4.166 . 0 0 "[ . 1 . ]" 1
57 1 7 ARG QG 2 6 DA H1' 6.000 . 6.500 3.110 2.187 4.842 . 0 0 "[ . 1 . ]" 1
58 1 7 ARG QG 2 6 DA H3' 6.000 . 6.500 4.968 4.384 6.526 0.026 12 0 "[ . 1 . ]" 1
59 1 8 THR H 1 8 THR HB 3.600 . 4.100 3.000 2.200 4.044 . 0 0 "[ . 1 . ]" 1
60 1 8 THR H 2 6 DA H1' 6.000 . 6.500 4.598 3.630 5.962 . 0 0 "[ . 1 . ]" 1
61 1 8 THR HA 1 9 HIS H 3.130 . 3.630 2.339 2.071 2.957 . 0 0 "[ . 1 . ]" 1
62 1 8 THR HA 2 6 DA H3' 6.000 . 6.500 4.504 2.778 6.020 . 0 0 "[ . 1 . ]" 1
63 1 8 THR HB 2 6 DA H3' 6.000 . 6.500 5.567 4.434 6.804 0.304 1 0 "[ . 1 . ]" 1
64 1 8 THR MG 1 9 HIS H 4.380 . 4.880 3.150 2.511 4.312 . 0 0 "[ . 1 . ]" 1
65 1 8 THR MG 1 10 PHE QD 5.590 . 6.090 2.984 2.250 3.648 . 0 0 "[ . 1 . ]" 1
66 1 8 THR MG 1 10 PHE QE 5.390 . 5.890 3.268 2.437 4.529 . 0 0 "[ . 1 . ]" 1
67 1 8 THR MG 2 6 DA H1' 7.210 . 7.710 5.635 4.068 6.997 . 0 0 "[ . 1 . ]" 1
68 1 8 THR MG 2 6 DA H3' 7.210 . 7.710 3.418 2.253 4.815 . 0 0 "[ . 1 . ]" 1
69 1 8 THR MG 2 6 DA H4' 7.210 . 7.710 3.222 2.116 4.055 . 0 0 "[ . 1 . ]" 1
70 1 8 THR MG 2 6 DA H5' 7.210 . 7.710 3.819 2.169 4.963 . 0 0 "[ . 1 . ]" 1
71 1 8 THR MG 2 6 DA H8 7.210 . 7.710 6.284 5.005 7.073 . 0 0 "[ . 1 . ]" 1
72 1 9 HIS H 1 9 HIS HB2 3.820 . 4.320 3.023 2.312 3.930 . 0 0 "[ . 1 . ]" 1
73 1 9 HIS H 1 9 HIS HB3 3.820 . 4.320 3.057 2.466 4.081 . 0 0 "[ . 1 . ]" 1
74 1 9 HIS HA 1 10 PHE H 3.100 . 3.600 2.627 2.194 3.427 . 0 0 "[ . 1 . ]" 1
75 1 10 PHE H 1 10 PHE HB2 3.830 . 4.330 2.711 2.381 3.662 . 0 0 "[ . 1 . ]" 1
76 1 10 PHE H 1 10 PHE HB3 3.830 . 4.330 3.686 2.964 3.890 . 0 0 "[ . 1 . ]" 1
77 1 10 PHE H 1 10 PHE QD 4.890 . 5.390 3.196 2.308 3.751 . 0 0 "[ . 1 . ]" 1
78 1 10 PHE HA 1 11 THR H 3.460 . 3.960 2.218 2.138 2.370 . 0 0 "[ . 1 . ]" 1
79 1 10 PHE QB 1 11 THR H 4.030 . 4.530 3.013 2.328 3.726 . 0 0 "[ . 1 . ]" 1
80 1 10 PHE QB 1 14 GLN H 5.850 . 6.350 5.017 4.230 5.548 . 0 0 "[ . 1 . ]" 1
81 1 10 PHE QB 1 15 LEU CG 6.140 . 6.640 3.457 2.951 4.265 . 0 0 "[ . 1 . ]" 1
82 1 10 PHE QB 1 15 LEU H 4.980 . 5.480 4.069 3.503 4.437 . 0 0 "[ . 1 . ]" 1
83 1 10 PHE HB2 1 11 THR H 4.330 . 4.830 3.981 2.358 4.478 . 0 0 "[ . 1 . ]" 1
84 1 10 PHE HB2 1 15 LEU MD1 6.090 . 6.590 3.188 2.259 4.212 . 0 0 "[ . 1 . ]" 1
85 1 10 PHE HB2 1 15 LEU MD2 6.090 . 6.590 3.024 2.267 4.280 . 0 0 "[ . 1 . ]" 1
86 1 10 PHE HB3 1 11 THR H 4.330 . 4.830 3.192 2.522 3.986 . 0 0 "[ . 1 . ]" 1
87 1 10 PHE HB3 1 15 LEU MD1 6.090 . 6.590 3.510 2.180 4.367 . 0 0 "[ . 1 . ]" 1
88 1 10 PHE HB3 1 15 LEU MD2 6.090 . 6.590 2.975 2.286 4.864 . 0 0 "[ . 1 . ]" 1
89 1 10 PHE QD 1 11 THR H 4.960 . 5.460 4.025 3.575 4.630 . 0 0 "[ . 1 . ]" 1
90 1 10 PHE QD 1 15 LEU CG 6.960 . 7.460 5.010 4.099 5.877 . 0 0 "[ . 1 . ]" 1
91 1 10 PHE QD 1 42 LEU CG 7.280 . 7.780 4.912 4.217 6.330 . 0 0 "[ . 1 . ]" 1
92 1 10 PHE QD 1 42 LEU HG 5.580 . 6.080 5.021 4.209 6.912 0.832 10 1 "[ . + . ]" 1
93 1 10 PHE QD 1 50 TRP HE1 5.350 . 5.850 4.060 3.270 5.329 . 0 0 "[ . 1 . ]" 1
94 1 10 PHE QD 2 6 DA H3' 6.730 . 7.230 4.314 3.765 5.275 . 0 0 "[ . 1 . ]" 1
95 1 10 PHE QD 2 6 DA H4' 6.730 . 7.230 5.147 3.956 5.815 . 0 0 "[ . 1 . ]" 1
96 1 10 PHE QD 2 6 DA H5' 6.730 . 7.230 4.725 3.709 6.262 . 0 0 "[ . 1 . ]" 1
97 1 10 PHE QD 2 6 DA H5'' 6.730 . 7.230 3.288 2.384 4.774 . 0 0 "[ . 1 . ]" 1
98 1 10 PHE QD 2 6 DA H8 7.000 . 7.230 6.846 6.231 7.643 0.413 7 0 "[ . 1 . ]" 1
99 1 10 PHE QE 1 50 TRP HE1 5.690 . 6.190 4.531 3.702 5.717 . 0 0 "[ . 1 . ]" 1
100 1 10 PHE QE 2 6 DA H3' 6.730 . 7.230 2.420 2.129 3.415 . 0 0 "[ . 1 . ]" 1
101 1 10 PHE QE 2 6 DA H4' 6.730 . 7.230 4.257 3.468 4.730 . 0 0 "[ . 1 . ]" 1
102 1 10 PHE QE 2 6 DA H5' 6.730 . 7.230 4.212 3.802 5.623 . 0 0 "[ . 1 . ]" 1
103 1 10 PHE QE 2 6 DA H5'' 6.730 . 7.230 2.771 2.247 4.183 . 0 0 "[ . 1 . ]" 1
104 1 10 PHE HZ 2 6 DA H3' 6.000 . 6.500 3.139 2.563 4.283 . 0 0 "[ . 1 . ]" 1
105 1 10 PHE HZ 2 6 DA H8 6.000 . 6.500 6.618 4.917 8.026 1.526 1 5 "[+ *. *- 1 * ]" 1
106 1 11 THR H 1 11 THR MG 3.920 . 4.420 2.400 2.049 2.899 . 0 0 "[ . 1 . ]" 1
107 1 11 THR H 1 14 GLN H 4.000 . 4.500 3.710 3.342 4.233 . 0 0 "[ . 1 . ]" 1
108 1 11 THR H 1 14 GLN QB 4.470 . 4.970 2.722 2.053 3.655 . 0 0 "[ . 1 . ]" 1
109 1 11 THR H 1 14 GLN HG2 4.190 . 4.690 4.060 2.359 4.730 0.040 4 0 "[ . 1 . ]" 1
110 1 11 THR H 1 14 GLN QG 4.120 . 4.620 3.115 2.190 3.566 . 0 0 "[ . 1 . ]" 1
111 1 11 THR H 1 14 GLN HG3 4.190 . 4.690 3.300 2.596 3.736 . 0 0 "[ . 1 . ]" 1
112 1 11 THR H 1 15 LEU H 5.120 . 5.620 4.374 3.836 5.079 . 0 0 "[ . 1 . ]" 1
113 1 11 THR HA 1 12 SER H 3.470 . 3.970 2.378 2.290 2.503 . 0 0 "[ . 1 . ]" 1
114 1 11 THR HA 1 13 GLN H 4.080 . 4.580 4.302 3.966 4.571 . 0 0 "[ . 1 . ]" 1
115 1 11 THR HA 1 14 GLN H 5.120 . 5.620 4.612 4.455 4.751 . 0 0 "[ . 1 . ]" 1
116 1 11 THR HG1 1 13 GLN H 4.350 . 4.850 3.456 2.827 4.273 . 0 0 "[ . 1 . ]" 1
117 1 11 THR HG1 1 14 GLN H 4.140 . 4.640 3.187 2.538 4.028 . 0 0 "[ . 1 . ]" 1
118 1 11 THR MG 1 12 SER H 4.920 . 5.420 3.942 3.657 4.126 . 0 0 "[ . 1 . ]" 1
119 1 11 THR MG 1 13 GLN H 5.070 . 5.570 4.375 3.978 4.737 . 0 0 "[ . 1 . ]" 1
120 1 11 THR MG 1 13 GLN QB 6.620 . 7.120 4.138 3.497 4.923 . 0 0 "[ . 1 . ]" 1
121 1 11 THR MG 1 14 GLN H 4.880 . 5.380 4.261 3.887 4.852 . 0 0 "[ . 1 . ]" 1
122 1 11 THR MG 1 14 GLN QG 5.490 . 5.990 3.418 2.475 4.131 . 0 0 "[ . 1 . ]" 1
123 1 12 SER H 1 13 GLN H 4.050 . 4.550 2.819 2.519 2.966 . 0 0 "[ . 1 . ]" 1
124 1 12 SER H 1 15 LEU H 5.500 . 6.000 4.842 4.649 5.064 . 0 0 "[ . 1 . ]" 1
125 1 12 SER HA 1 15 LEU CG 6.600 . 7.100 3.784 3.267 4.446 . 0 0 "[ . 1 . ]" 1
126 1 12 SER HA 1 15 LEU H 3.970 . 4.470 3.300 2.890 3.592 . 0 0 "[ . 1 . ]" 1
127 1 12 SER HA 1 15 LEU HB2 4.070 . 4.570 2.411 2.100 2.811 . 0 0 "[ . 1 . ]" 1
128 1 12 SER HA 1 15 LEU HB3 4.490 . 4.990 4.001 3.622 4.438 . 0 0 "[ . 1 . ]" 1
129 1 12 SER HA 1 16 GLN H 3.960 . 4.460 3.965 3.582 4.349 . 0 0 "[ . 1 . ]" 1
130 1 12 SER QB 1 13 GLN H 4.690 . 5.190 2.880 2.566 3.746 . 0 0 "[ . 1 . ]" 1
131 1 12 SER QB 1 13 GLN QB 5.800 . 6.300 4.146 3.865 4.900 . 0 0 "[ . 1 . ]" 1
132 1 12 SER QB 1 13 GLN HE21 6.160 . 6.660 6.272 5.982 6.833 0.173 3 0 "[ . 1 . ]" 1
133 1 12 SER QB 1 15 LEU CG 7.060 . 7.560 5.599 5.166 6.130 . 0 0 "[ . 1 . ]" 1
134 1 12 SER QB 1 15 LEU H 6.110 . 6.610 4.887 4.598 5.206 . 0 0 "[ . 1 . ]" 1
135 1 12 SER QB 1 15 LEU HB2 5.250 . 5.750 4.097 3.681 4.513 . 0 0 "[ . 1 . ]" 1
136 1 12 SER QB 1 15 LEU MD1 7.410 . 7.910 4.307 3.794 6.155 . 0 0 "[ . 1 . ]" 1
137 1 12 SER QB 1 15 LEU MD2 7.410 . 7.910 5.816 4.697 6.291 . 0 0 "[ . 1 . ]" 1
138 1 13 GLN H 1 13 GLN HB2 3.330 . 3.830 2.521 2.365 2.683 . 0 0 "[ . 1 . ]" 1
139 1 13 GLN H 1 13 GLN HB3 3.330 . 3.830 2.449 2.312 2.581 . 0 0 "[ . 1 . ]" 1
140 1 13 GLN H 1 13 GLN QG 4.490 . 4.990 4.030 3.963 4.088 . 0 0 "[ . 1 . ]" 1
141 1 13 GLN H 1 14 GLN H 3.630 . 4.130 2.760 2.441 2.876 . 0 0 "[ . 1 . ]" 1
142 1 13 GLN H 1 14 GLN QG 4.650 . 5.150 4.468 3.876 4.892 . 0 0 "[ . 1 . ]" 1
143 1 13 GLN HA 1 13 GLN QG 3.790 . 4.290 3.045 2.691 3.172 . 0 0 "[ . 1 . ]" 1
144 1 13 GLN HA 1 16 GLN H 4.360 . 4.860 3.722 3.056 4.334 . 0 0 "[ . 1 . ]" 1
145 1 13 GLN QB 1 14 GLN H 3.850 . 4.350 2.842 2.661 2.989 . 0 0 "[ . 1 . ]" 1
146 1 13 GLN HB2 1 14 GLN H 3.990 . 4.490 4.106 3.880 4.246 . 0 0 "[ . 1 . ]" 1
147 1 13 GLN HB3 1 14 GLN H 3.990 . 4.490 2.899 2.710 3.064 . 0 0 "[ . 1 . ]" 1
148 1 13 GLN HE21 1 40 THR MG 6.610 . 7.110 4.985 4.208 5.815 . 0 0 "[ . 1 . ]" 1
149 1 13 GLN QG 1 14 GLN H 4.850 . 5.350 3.833 3.583 4.072 . 0 0 "[ . 1 . ]" 1
150 1 13 GLN QG 1 14 GLN HA 4.470 . 4.970 3.948 3.629 4.252 . 0 0 "[ . 1 . ]" 1
151 1 14 GLN H 1 14 GLN HG2 3.740 . 4.240 3.372 2.088 3.862 . 0 0 "[ . 1 . ]" 1
152 1 14 GLN H 1 14 GLN QG 3.360 . 3.860 2.397 2.075 2.571 . 0 0 "[ . 1 . ]" 1
153 1 14 GLN H 1 14 GLN HG3 3.740 . 4.240 2.777 2.409 3.820 . 0 0 "[ . 1 . ]" 1
154 1 14 GLN H 1 15 LEU CG 7.640 . 8.140 5.265 4.942 5.839 . 0 0 "[ . 1 . ]" 1
155 1 14 GLN H 1 15 LEU H 3.790 . 4.290 2.532 2.335 2.708 . 0 0 "[ . 1 . ]" 1
156 1 14 GLN H 1 15 LEU HB2 5.480 . 5.980 4.556 4.237 4.886 . 0 0 "[ . 1 . ]" 1
157 1 14 GLN H 1 16 GLN H 4.420 . 4.920 4.129 4.006 4.366 . 0 0 "[ . 1 . ]" 1
158 1 14 GLN H 1 40 THR HB 4.910 . 5.410 5.461 5.080 5.707 0.297 17 0 "[ . 1 . ]" 1
159 1 14 GLN H 1 40 THR MG 6.140 . 6.640 4.817 4.565 5.140 . 0 0 "[ . 1 . ]" 1
160 1 14 GLN HA 1 16 GLN H 5.010 . 5.510 4.447 4.253 4.661 . 0 0 "[ . 1 . ]" 1
161 1 14 GLN HA 1 17 GLU H 4.670 . 5.170 3.998 3.642 4.562 . 0 0 "[ . 1 . ]" 1
162 1 14 GLN HA 1 17 GLU QB 4.470 . 4.970 4.004 3.429 4.737 . 0 0 "[ . 1 . ]" 1
163 1 14 GLN HA 1 40 THR H 5.500 . 6.000 5.788 5.397 6.331 0.331 1 0 "[ . 1 . ]" 1
164 1 14 GLN HA 1 40 THR MG 4.360 . 4.860 2.297 2.109 2.583 . 0 0 "[ . 1 . ]" 1
165 1 14 GLN QB 1 15 LEU H 4.980 . 5.480 2.504 2.284 2.629 . 0 0 "[ . 1 . ]" 1
166 1 14 GLN QB 1 18 LEU CG 7.600 . 8.100 4.731 3.593 5.528 . 0 0 "[ . 1 . ]" 1
167 1 14 GLN QB 1 40 THR HB 5.140 . 5.640 2.833 2.406 3.468 . 0 0 "[ . 1 . ]" 1
168 1 14 GLN QB 1 40 THR MG 5.700 . 6.200 3.112 2.695 3.528 . 0 0 "[ . 1 . ]" 1
169 1 14 GLN QB 1 42 LEU H 6.010 . 6.510 6.262 5.622 6.822 0.312 7 0 "[ . 1 . ]" 1
170 1 14 GLN QE 1 40 THR HB 5.600 . 6.100 3.191 2.782 4.741 . 0 0 "[ . 1 . ]" 1
171 1 14 GLN QE 1 41 ASN HB2 5.830 . 6.330 4.825 4.193 5.801 . 0 0 "[ . 1 . ]" 1
172 1 14 GLN QE 1 42 LEU CG 5.980 . 6.480 3.982 3.304 4.939 . 0 0 "[ . 1 . ]" 1
173 1 14 GLN QE 1 42 LEU HG 4.200 . 4.700 4.134 2.692 4.974 0.274 14 0 "[ . 1 . ]" 1
174 1 14 GLN HE21 1 42 LEU HG 4.290 . 4.790 4.714 3.074 5.649 0.859 14 1 "[ . 1 +. ]" 1
175 1 14 GLN HE22 1 42 LEU HG 4.290 . 4.790 4.603 2.827 5.522 0.732 14 2 "[ . 1 -+. ]" 1
176 1 14 GLN QG 1 15 LEU H 5.120 . 5.620 4.055 3.636 4.308 . 0 0 "[ . 1 . ]" 1
177 1 14 GLN QG 1 40 THR HB 5.610 . 6.110 2.798 2.108 4.036 . 0 0 "[ . 1 . ]" 1
178 1 14 GLN QG 1 40 THR MG 6.280 . 6.780 3.546 2.844 4.491 . 0 0 "[ . 1 . ]" 1
179 1 14 GLN HG2 1 15 LEU H 5.220 . 5.720 4.786 3.802 5.147 . 0 0 "[ . 1 . ]" 1
180 1 14 GLN HG3 1 15 LEU H 5.220 . 5.720 4.486 4.267 4.824 . 0 0 "[ . 1 . ]" 1
181 1 15 LEU CG 1 16 GLN H 6.180 . 6.680 4.596 4.422 4.922 . 0 0 "[ . 1 . ]" 1
182 1 15 LEU CG 1 18 LEU CG 8.070 . 8.570 6.124 5.187 6.901 . 0 0 "[ . 1 . ]" 1
183 1 15 LEU CG 1 18 LEU H 6.880 . 7.380 5.940 5.297 6.182 . 0 0 "[ . 1 . ]" 1
184 1 15 LEU CG 1 19 GLU H 7.640 . 8.140 5.782 4.973 6.336 . 0 0 "[ . 1 . ]" 1
185 1 15 LEU CG 1 50 TRP HD1 6.990 . 7.490 5.877 4.228 6.611 . 0 0 "[ . 1 . ]" 1
186 1 15 LEU CG 1 50 TRP HE1 5.360 . 5.860 4.178 3.431 4.682 . 0 0 "[ . 1 . ]" 1
187 1 15 LEU CG 1 50 TRP HZ2 7.200 . 7.700 4.616 3.813 5.513 . 0 0 "[ . 1 . ]" 1
188 1 15 LEU H 1 15 LEU HB2 3.500 . 4.000 2.394 2.121 2.569 . 0 0 "[ . 1 . ]" 1
189 1 15 LEU H 1 15 LEU HB3 3.590 . 4.090 3.566 3.446 3.634 . 0 0 "[ . 1 . ]" 1
190 1 15 LEU H 1 15 LEU MD1 4.710 . 5.210 3.431 2.450 4.029 . 0 0 "[ . 1 . ]" 1
191 1 15 LEU H 1 15 LEU MD2 4.710 . 5.210 3.454 2.478 3.939 . 0 0 "[ . 1 . ]" 1
192 1 15 LEU H 1 15 LEU HG 4.050 . 4.550 2.613 2.146 4.081 . 0 0 "[ . 1 . ]" 1
193 1 15 LEU H 1 16 GLN H 3.540 . 4.040 2.861 2.795 2.932 . 0 0 "[ . 1 . ]" 1
194 1 15 LEU H 1 16 GLN HA 5.480 . 5.980 5.440 5.380 5.526 . 0 0 "[ . 1 . ]" 1
195 1 15 LEU H 1 16 GLN QG 5.920 . 6.420 4.879 4.430 6.290 . 0 0 "[ . 1 . ]" 1
196 1 15 LEU H 1 18 LEU CG 7.090 . 7.590 5.896 5.349 6.783 . 0 0 "[ . 1 . ]" 1
197 1 15 LEU HA 1 18 LEU CG 5.930 . 6.430 3.804 3.544 4.454 . 0 0 "[ . 1 . ]" 1
198 1 15 LEU HA 1 18 LEU H 3.920 . 4.420 3.257 2.856 3.484 . 0 0 "[ . 1 . ]" 1
199 1 15 LEU HA 1 18 LEU QB 3.850 . 4.350 2.398 2.066 2.819 . 0 0 "[ . 1 . ]" 1
200 1 15 LEU HA 1 18 LEU HG 4.860 . 5.360 4.027 3.337 5.478 0.118 11 0 "[ . 1 . ]" 1
201 1 15 LEU HA 1 19 GLU H 4.110 . 4.610 3.665 2.724 4.172 . 0 0 "[ . 1 . ]" 1
202 1 15 LEU HA 1 50 TRP HE1 4.470 . 4.970 4.752 4.119 5.378 0.408 13 0 "[ . 1 . ]" 1
203 1 15 LEU HB2 1 16 GLN H 3.670 . 4.170 2.878 2.653 3.398 . 0 0 "[ . 1 . ]" 1
204 1 15 LEU HB3 1 16 GLN H 4.110 . 4.610 3.667 3.333 3.806 . 0 0 "[ . 1 . ]" 1
205 1 15 LEU HB3 1 16 GLN HA 4.730 . 5.230 4.416 4.133 4.676 . 0 0 "[ . 1 . ]" 1
206 1 15 LEU HB3 1 18 LEU CG 7.190 . 7.690 6.158 5.841 6.636 . 0 0 "[ . 1 . ]" 1
207 1 15 LEU HB3 1 19 GLU H 5.280 . 5.780 4.311 3.664 4.701 . 0 0 "[ . 1 . ]" 1
208 1 15 LEU MD1 1 16 GLN H 5.620 . 6.120 4.662 4.480 4.798 . 0 0 "[ . 1 . ]" 1
209 1 15 LEU MD1 1 50 TRP HE1 5.020 . 5.520 3.890 2.658 4.382 . 0 0 "[ . 1 . ]" 1
210 1 15 LEU MD2 1 16 GLN H 5.620 . 6.120 4.840 4.501 5.093 . 0 0 "[ . 1 . ]" 1
211 1 15 LEU MD2 1 50 TRP HE1 5.020 . 5.520 2.260 1.859 3.311 . 0 0 "[ . 1 . ]" 1
212 1 15 LEU MD2 2 6 DA H3' 7.210 . 7.710 6.850 5.676 8.059 0.349 13 0 "[ . 1 . ]" 1
213 1 15 LEU HG 1 16 GLN H 5.260 . 5.760 4.714 4.358 5.360 . 0 0 "[ . 1 . ]" 1
214 1 15 LEU HG 1 18 LEU CG 7.460 . 7.960 6.122 4.533 6.917 . 0 0 "[ . 1 . ]" 1
215 1 15 LEU HG 1 50 TRP HE1 5.200 . 5.700 4.496 2.778 5.227 . 0 0 "[ . 1 . ]" 1
216 1 16 GLN H 1 16 GLN HB2 3.670 . 4.170 2.357 2.144 3.527 . 0 0 "[ . 1 . ]" 1
217 1 16 GLN H 1 16 GLN QB 3.310 . 3.810 2.239 2.124 2.369 . 0 0 "[ . 1 . ]" 1
218 1 16 GLN H 1 16 GLN HB3 3.670 . 4.170 3.395 2.240 3.600 . 0 0 "[ . 1 . ]" 1
219 1 16 GLN H 1 16 GLN HG2 4.070 . 4.570 2.800 2.385 4.517 . 0 0 "[ . 1 . ]" 1
220 1 16 GLN H 1 16 GLN QG 3.890 . 4.390 2.674 2.354 3.999 . 0 0 "[ . 1 . ]" 1
221 1 16 GLN H 1 16 GLN HG3 4.070 . 4.570 3.605 3.072 4.462 . 0 0 "[ . 1 . ]" 1
222 1 16 GLN H 1 17 GLU H 3.580 . 4.080 2.979 2.844 3.092 . 0 0 "[ . 1 . ]" 1
223 1 16 GLN H 1 17 GLU QB 5.220 . 5.720 5.045 4.605 5.210 . 0 0 "[ . 1 . ]" 1
224 1 16 GLN H 1 40 THR MG 6.610 . 7.110 5.260 4.689 5.732 . 0 0 "[ . 1 . ]" 1
225 1 16 GLN HA 1 16 GLN QE 4.610 . 5.110 2.556 2.128 3.737 . 0 0 "[ . 1 . ]" 1
226 1 16 GLN HA 1 19 GLU H 4.360 . 4.860 3.889 3.654 4.418 . 0 0 "[ . 1 . ]" 1
227 1 16 GLN HA 1 19 GLU QG 4.320 . 4.820 2.406 2.168 3.329 . 0 0 "[ . 1 . ]" 1
228 1 16 GLN HA 1 20 ALA H 4.710 . 5.210 3.897 3.546 4.163 . 0 0 "[ . 1 . ]" 1
229 1 16 GLN HA 1 20 ALA MB 5.940 . 6.440 4.074 3.263 4.491 . 0 0 "[ . 1 . ]" 1
230 1 16 GLN QB 1 17 GLU H 3.940 . 4.440 3.137 2.720 3.736 . 0 0 "[ . 1 . ]" 1
231 1 16 GLN QB 1 18 LEU H 6.010 . 6.510 4.913 4.596 5.192 . 0 0 "[ . 1 . ]" 1
232 1 16 GLN HB2 1 17 GLU H 4.040 . 4.540 3.413 2.831 4.330 . 0 0 "[ . 1 . ]" 1
233 1 16 GLN HB3 1 17 GLU H 4.040 . 4.540 3.805 2.799 4.105 . 0 0 "[ . 1 . ]" 1
234 1 16 GLN QE 1 17 GLU HA 5.500 . 6.000 5.870 2.710 6.759 0.759 3 1 "[ + . 1 . ]" 1
235 1 16 GLN QE 1 19 GLU QB 5.500 . 6.000 4.754 4.149 6.436 0.436 14 0 "[ . 1 . ]" 1
236 1 16 GLN QE 1 19 GLU QG 5.540 . 5.930 3.174 2.587 4.654 . 0 0 "[ . 1 . ]" 1
237 1 16 GLN QE 1 20 ALA HA 5.500 . 6.000 5.802 4.448 7.041 1.041 14 1 "[ . 1 +. ]" 1
238 1 16 GLN QE 1 20 ALA MB 6.490 . 6.990 4.200 2.588 5.059 . 0 0 "[ . 1 . ]" 1
239 1 16 GLN QG 1 17 GLU H 5.600 . 6.100 4.426 2.522 4.787 . 0 0 "[ . 1 . ]" 1
240 1 17 GLU H 1 17 GLU HG2 4.090 . 4.590 3.011 2.417 4.634 0.044 3 0 "[ . 1 . ]" 1
241 1 17 GLU H 1 17 GLU QG 3.760 . 4.260 2.915 2.391 4.037 . 0 0 "[ . 1 . ]" 1
242 1 17 GLU H 1 17 GLU HG3 4.090 . 4.590 4.094 3.799 4.448 . 0 0 "[ . 1 . ]" 1
243 1 17 GLU H 1 18 LEU H 3.630 . 4.130 2.284 1.995 2.523 . 0 0 "[ . 1 . ]" 1
244 1 17 GLU H 1 18 LEU HA 5.300 . 5.800 5.008 4.769 5.210 . 0 0 "[ . 1 . ]" 1
245 1 17 GLU H 1 18 LEU QB 6.010 . 6.510 4.238 3.893 4.504 . 0 0 "[ . 1 . ]" 1
246 1 17 GLU H 1 19 GLU H 4.350 . 4.850 4.161 3.825 4.536 . 0 0 "[ . 1 . ]" 1
247 1 17 GLU H 1 19 GLU QG 6.010 . 6.510 4.571 4.393 5.061 . 0 0 "[ . 1 . ]" 1
248 1 17 GLU H 1 20 ALA MB 5.360 . 5.860 4.617 4.167 4.962 . 0 0 "[ . 1 . ]" 1
249 1 17 GLU H 1 40 THR MG 4.660 . 5.160 3.679 3.365 4.209 . 0 0 "[ . 1 . ]" 1
250 1 17 GLU HA 1 17 GLU HG2 3.810 . 4.310 3.062 2.638 3.824 . 0 0 "[ . 1 . ]" 1
251 1 17 GLU HA 1 17 GLU HG3 3.810 . 4.310 3.710 3.202 3.823 . 0 0 "[ . 1 . ]" 1
252 1 17 GLU HA 1 19 GLU H 4.830 . 5.330 4.762 4.583 4.997 . 0 0 "[ . 1 . ]" 1
253 1 17 GLU HA 1 20 ALA H 4.030 . 4.530 3.698 3.402 4.225 . 0 0 "[ . 1 . ]" 1
254 1 17 GLU HA 1 20 ALA MB 4.020 . 4.520 2.560 2.196 3.215 . 0 0 "[ . 1 . ]" 1
255 1 17 GLU HA 1 21 THR H 4.150 . 4.650 4.116 3.879 4.398 . 0 0 "[ . 1 . ]" 1
256 1 17 GLU HA 1 40 THR MG 5.640 . 6.140 4.826 4.557 5.220 . 0 0 "[ . 1 . ]" 1
257 1 17 GLU QB 1 18 LEU H 4.370 . 4.870 2.840 2.601 3.091 . 0 0 "[ . 1 . ]" 1
258 1 17 GLU QB 1 40 THR MG 4.640 . 5.140 2.344 2.097 2.678 . 0 0 "[ . 1 . ]" 1
259 1 17 GLU HB2 1 40 THR MG 4.730 . 5.230 2.449 2.133 3.228 . 0 0 "[ . 1 . ]" 1
260 1 17 GLU HB3 1 40 THR MG 4.730 . 5.230 3.226 2.516 3.673 . 0 0 "[ . 1 . ]" 1
261 1 17 GLU QG 1 18 LEU H 5.300 . 5.800 4.313 3.712 4.620 . 0 0 "[ . 1 . ]" 1
262 1 17 GLU QG 1 36 ILE MG 5.960 . 6.460 4.205 2.551 5.116 . 0 0 "[ . 1 . ]" 1
263 1 17 GLU QG 1 40 THR MG 4.620 . 5.120 2.852 2.376 3.363 . 0 0 "[ . 1 . ]" 1
264 1 18 LEU CG 1 19 GLU H 6.770 . 7.270 4.458 4.371 4.568 . 0 0 "[ . 1 . ]" 1
265 1 18 LEU CG 1 21 THR MG 7.930 . 8.430 6.303 5.874 6.660 . 0 0 "[ . 1 . ]" 1
266 1 18 LEU CG 1 36 ILE MD 7.050 . 7.550 5.149 3.817 5.935 . 0 0 "[ . 1 . ]" 1
267 1 18 LEU CG 1 36 ILE MG 6.090 . 6.590 3.506 2.949 3.929 . 0 0 "[ . 1 . ]" 1
268 1 18 LEU CG 1 40 THR MG 7.780 . 8.280 3.714 3.152 4.578 . 0 0 "[ . 1 . ]" 1
269 1 18 LEU CG 1 42 LEU CG 7.990 . 8.490 6.788 5.962 7.476 . 0 0 "[ . 1 . ]" 1
270 1 18 LEU CG 1 42 LEU HB2 7.640 . 8.140 6.713 6.241 7.224 . 0 0 "[ . 1 . ]" 1
271 1 18 LEU CG 1 47 VAL HA 6.620 . 7.120 5.101 4.488 5.498 . 0 0 "[ . 1 . ]" 1
272 1 18 LEU CG 1 47 VAL MG1 5.960 . 6.460 4.157 3.242 4.761 . 0 0 "[ . 1 . ]" 1
273 1 18 LEU CG 1 47 VAL MG2 6.690 . 7.190 4.415 3.896 4.916 . 0 0 "[ . 1 . ]" 1
274 1 18 LEU CG 1 50 TRP QB 7.090 . 7.590 4.535 4.262 4.799 . 0 0 "[ . 1 . ]" 1
275 1 18 LEU CG 1 50 TRP HE1 6.160 . 6.660 5.768 5.180 6.500 . 0 0 "[ . 1 . ]" 1
276 1 18 LEU CG 1 51 PHE QE 6.640 . 7.140 4.186 3.023 4.729 . 0 0 "[ . 1 . ]" 1
277 1 18 LEU H 1 18 LEU HB2 3.760 . 4.260 2.370 2.318 2.468 . 0 0 "[ . 1 . ]" 1
278 1 18 LEU H 1 18 LEU QB 3.460 . 3.960 2.337 2.288 2.428 . 0 0 "[ . 1 . ]" 1
279 1 18 LEU H 1 18 LEU HB3 3.760 . 4.260 3.571 3.528 3.609 . 0 0 "[ . 1 . ]" 1
280 1 18 LEU H 1 18 LEU MD1 4.710 . 5.210 3.229 2.219 3.609 . 0 0 "[ . 1 . ]" 1
281 1 18 LEU H 1 18 LEU MD2 4.710 . 5.210 3.799 3.538 4.137 . 0 0 "[ . 1 . ]" 1
282 1 18 LEU H 1 18 LEU HG 4.050 . 4.550 2.687 2.299 3.738 . 0 0 "[ . 1 . ]" 1
283 1 18 LEU H 1 19 GLU QG 6.010 . 6.510 4.281 3.867 5.008 . 0 0 "[ . 1 . ]" 1
284 1 18 LEU H 1 20 ALA H 4.780 . 5.280 4.090 3.904 4.295 . 0 0 "[ . 1 . ]" 1
285 1 18 LEU H 1 20 ALA MB 5.780 . 6.280 4.669 4.460 4.907 . 0 0 "[ . 1 . ]" 1
286 1 18 LEU H 1 21 THR H 5.470 . 5.970 4.691 4.541 4.786 . 0 0 "[ . 1 . ]" 1
287 1 18 LEU H 1 36 ILE MG 5.640 . 6.140 4.346 3.875 4.765 . 0 0 "[ . 1 . ]" 1
288 1 18 LEU H 1 40 THR MG 5.270 . 5.770 3.817 3.332 4.198 . 0 0 "[ . 1 . ]" 1
289 1 18 LEU HA 1 18 LEU HG 3.980 . 4.480 2.810 2.344 3.100 . 0 0 "[ . 1 . ]" 1
290 1 18 LEU HA 1 20 ALA MB 6.150 . 6.650 5.098 4.877 5.273 . 0 0 "[ . 1 . ]" 1
291 1 18 LEU HA 1 21 THR H 4.390 . 4.890 3.586 3.338 3.740 . 0 0 "[ . 1 . ]" 1
292 1 18 LEU HA 1 36 ILE MG 5.540 . 6.040 3.333 3.007 3.672 . 0 0 "[ . 1 . ]" 1
293 1 18 LEU QB 1 19 GLU H 3.680 . 4.180 2.541 2.423 2.664 . 0 0 "[ . 1 . ]" 1
294 1 18 LEU QB 1 50 TRP HE1 5.330 . 5.830 4.441 3.967 4.937 . 0 0 "[ . 1 . ]" 1
295 1 18 LEU MD1 1 36 ILE MG 6.740 . 7.240 3.610 2.099 4.189 . 0 0 "[ . 1 . ]" 1
296 1 18 LEU MD1 1 47 VAL MG2 6.750 . 7.250 3.657 2.987 4.170 . 0 0 "[ . 1 . ]" 1
297 1 18 LEU MD2 1 36 ILE MG 6.740 . 7.240 2.319 1.994 3.367 . 0 0 "[ . 1 . ]" 1
298 1 18 LEU MD2 1 47 VAL MG2 6.750 . 7.250 2.542 2.317 2.872 . 0 0 "[ . 1 . ]" 1
299 1 18 LEU HG 1 19 GLU H 5.090 . 5.590 4.656 4.399 5.120 . 0 0 "[ . 1 . ]" 1
300 1 19 GLU H 1 19 GLU QB 3.670 . 3.790 2.453 2.367 2.574 . 0 0 "[ . 1 . ]" 1
301 1 19 GLU H 1 19 GLU HG2 3.750 . 4.250 2.429 2.224 2.871 . 0 0 "[ . 1 . ]" 1
302 1 19 GLU H 1 19 GLU HG3 3.750 . 4.250 3.655 3.286 3.917 . 0 0 "[ . 1 . ]" 1
303 1 19 GLU H 1 20 ALA H 3.420 . 3.920 2.710 2.533 2.822 . 0 0 "[ . 1 . ]" 1
304 1 19 GLU H 1 20 ALA MB 5.130 . 5.630 4.325 4.154 4.432 . 0 0 "[ . 1 . ]" 1
305 1 19 GLU H 1 22 PHE H 5.080 . 5.580 4.658 4.532 4.769 . 0 0 "[ . 1 . ]" 1
306 1 19 GLU H 1 22 PHE QB 5.370 . 5.870 4.645 4.506 4.776 . 0 0 "[ . 1 . ]" 1
307 1 19 GLU H 1 50 TRP HH2 4.330 . 4.830 3.903 3.596 4.287 . 0 0 "[ . 1 . ]" 1
308 1 19 GLU H 1 50 TRP HZ2 4.500 . 5.000 4.507 4.218 5.154 0.154 16 0 "[ . 1 . ]" 1
309 1 19 GLU H 1 50 TRP HZ3 5.270 . 5.770 5.119 4.621 5.525 . 0 0 "[ . 1 . ]" 1
310 1 19 GLU HA 1 21 THR H 4.520 . 5.020 4.115 3.694 4.343 . 0 0 "[ . 1 . ]" 1
311 1 19 GLU HA 1 22 PHE H 4.280 . 4.780 3.118 2.833 3.361 . 0 0 "[ . 1 . ]" 1
312 1 19 GLU HA 1 22 PHE QB 4.710 . 5.210 2.340 2.156 2.555 . 0 0 "[ . 1 . ]" 1
313 1 19 GLU HA 1 23 GLN H 4.380 . 4.880 4.008 3.792 4.497 . 0 0 "[ . 1 . ]" 1
314 1 19 GLU HA 1 50 TRP HH2 4.070 . 4.570 2.685 2.164 3.081 . 0 0 "[ . 1 . ]" 1
315 1 19 GLU HA 1 50 TRP HZ2 4.170 . 4.670 4.610 3.759 5.187 0.517 16 1 "[ . 1 .+ ]" 1
316 1 19 GLU HA 1 54 ARG HE 5.440 . 5.940 6.307 5.885 7.008 1.068 9 6 "[ *. * +* *- ]" 1
317 1 19 GLU QB 1 20 ALA H 4.120 . 4.440 3.556 3.490 3.751 . 0 0 "[ . 1 . ]" 1
318 1 19 GLU QB 1 21 THR H 5.500 . 6.000 5.063 4.815 5.195 . 0 0 "[ . 1 . ]" 1
319 1 19 GLU QB 1 23 GLN H 5.210 . 5.710 4.812 4.494 5.322 . 0 0 "[ . 1 . ]" 1
320 1 19 GLU QB 1 50 TRP HE1 5.500 . 6.000 6.053 5.274 6.594 0.594 5 2 "[ - + 1 . ]" 1
321 1 19 GLU QG 1 20 ALA H 4.330 . 4.830 2.291 2.074 2.601 . 0 0 "[ . 1 . ]" 1
322 1 19 GLU QG 1 21 THR H 4.840 . 5.340 4.541 4.365 4.782 . 0 0 "[ . 1 . ]" 1
323 1 19 GLU HG2 1 20 ALA H 4.500 . 5.000 2.519 2.127 2.893 . 0 0 "[ . 1 . ]" 1
324 1 19 GLU HG2 1 21 THR H 5.000 . 5.500 5.057 4.703 5.425 . 0 0 "[ . 1 . ]" 1
325 1 19 GLU HG3 1 20 ALA H 4.500 . 5.000 2.742 2.324 3.458 . 0 0 "[ . 1 . ]" 1
326 1 19 GLU HG3 1 21 THR H 5.000 . 5.500 5.170 4.785 5.766 0.266 12 0 "[ . 1 . ]" 1
327 1 20 ALA H 1 21 THR HB 4.860 . 5.360 5.062 4.864 5.201 . 0 0 "[ . 1 . ]" 1
328 1 20 ALA H 1 22 PHE H 4.370 . 4.870 4.272 4.105 4.440 . 0 0 "[ . 1 . ]" 1
329 1 20 ALA HA 1 23 GLN H 3.900 . 4.400 3.649 3.407 3.912 . 0 0 "[ . 1 . ]" 1
330 1 20 ALA HA 1 23 GLN HB2 4.510 . 5.010 3.472 2.645 5.302 0.292 15 0 "[ . 1 . ]" 1
331 1 20 ALA HA 1 23 GLN QB 4.390 . 4.890 3.164 2.619 4.236 . 0 0 "[ . 1 . ]" 1
332 1 20 ALA HA 1 23 GLN HB3 4.510 . 5.010 4.417 3.798 5.004 . 0 0 "[ . 1 . ]" 1
333 1 20 ALA HA 1 23 GLN QG 4.780 . 5.280 3.105 2.196 3.962 . 0 0 "[ . 1 . ]" 1
334 1 20 ALA MB 1 21 THR H 3.770 . 4.270 2.774 2.603 3.076 . 0 0 "[ . 1 . ]" 1
335 1 20 ALA MB 1 23 GLN H 5.800 . 6.300 4.835 4.542 5.108 . 0 0 "[ . 1 . ]" 1
336 1 21 THR H 1 21 THR HB 3.470 . 3.970 2.594 2.539 2.662 . 0 0 "[ . 1 . ]" 1
337 1 21 THR H 1 21 THR HG1 4.560 . 5.060 2.273 2.085 2.522 . 0 0 "[ . 1 . ]" 1
338 1 21 THR H 1 22 PHE H 3.470 . 3.970 2.613 2.363 2.798 . 0 0 "[ . 1 . ]" 1
339 1 21 THR H 1 22 PHE QB 4.840 . 5.340 4.260 4.021 4.457 . 0 0 "[ . 1 . ]" 1
340 1 21 THR H 1 24 ARG QD 6.170 . 6.670 5.603 4.813 6.152 . 0 0 "[ . 1 . ]" 1
341 1 21 THR H 1 36 ILE MD 6.060 . 6.560 5.056 4.479 5.679 . 0 0 "[ . 1 . ]" 1
342 1 21 THR H 1 36 ILE QG 6.010 . 6.510 5.823 5.444 6.131 . 0 0 "[ . 1 . ]" 1
343 1 21 THR H 1 51 PHE QE 6.170 . 6.670 5.419 5.112 5.949 . 0 0 "[ . 1 . ]" 1
344 1 21 THR H 1 51 PHE HZ 4.930 . 5.430 4.723 4.335 5.403 . 0 0 "[ . 1 . ]" 1
345 1 21 THR HA 1 24 ARG H 3.910 . 4.410 3.661 3.383 3.916 . 0 0 "[ . 1 . ]" 1
346 1 21 THR HA 1 24 ARG QD 5.140 . 5.640 3.385 2.720 4.055 . 0 0 "[ . 1 . ]" 1
347 1 21 THR HA 1 24 ARG QG 4.750 . 5.250 2.375 2.139 2.706 . 0 0 "[ . 1 . ]" 1
348 1 21 THR HA 1 25 ASN H 4.440 . 4.940 4.054 3.907 4.272 . 0 0 "[ . 1 . ]" 1
349 1 21 THR HA 1 51 PHE HZ 5.170 . 5.670 4.839 4.563 5.294 . 0 0 "[ . 1 . ]" 1
350 1 21 THR HB 1 22 PHE H 3.440 . 3.940 2.586 2.436 2.732 . 0 0 "[ . 1 . ]" 1
351 1 21 THR HB 1 23 GLN H 5.500 . 6.000 5.117 5.023 5.207 . 0 0 "[ . 1 . ]" 1
352 1 21 THR HB 1 36 ILE MD 5.510 . 6.010 3.294 2.942 3.717 . 0 0 "[ . 1 . ]" 1
353 1 21 THR HG1 1 22 PHE H 5.050 . 5.550 4.061 3.973 4.211 . 0 0 "[ . 1 . ]" 1
354 1 21 THR MG 1 22 PHE H 4.340 . 4.840 3.545 3.370 3.748 . 0 0 "[ . 1 . ]" 1
355 1 21 THR MG 1 24 ARG H 5.610 . 6.110 4.365 4.213 4.585 . 0 0 "[ . 1 . ]" 1
356 1 21 THR MG 1 25 ASN H 5.060 . 5.560 3.636 3.405 3.772 . 0 0 "[ . 1 . ]" 1
357 1 21 THR MG 1 25 ASN QB 5.730 . 6.230 2.680 2.442 2.924 . 0 0 "[ . 1 . ]" 1
358 1 21 THR MG 1 25 ASN QD 6.300 . 6.800 3.786 3.322 4.246 . 0 0 "[ . 1 . ]" 1
359 1 21 THR MG 1 32 THR MG 5.340 . 5.840 3.212 2.631 3.802 . 0 0 "[ . 1 . ]" 1
360 1 21 THR MG 1 36 ILE MD 5.030 . 5.530 2.099 1.995 2.401 . 0 0 "[ . 1 . ]" 1
361 1 21 THR MG 1 36 ILE QG 6.050 . 6.550 3.524 2.780 4.028 . 0 0 "[ . 1 . ]" 1
362 1 21 THR MG 1 36 ILE MG 5.960 . 6.460 4.070 3.433 4.974 . 0 0 "[ . 1 . ]" 1
363 1 21 THR MG 1 51 PHE QE 5.230 . 5.730 3.239 2.974 3.595 . 0 0 "[ . 1 . ]" 1
364 1 21 THR MG 1 51 PHE HZ 4.710 . 5.210 2.460 2.258 2.863 . 0 0 "[ . 1 . ]" 1
365 1 22 PHE H 1 22 PHE HB2 3.380 . 3.880 2.346 2.174 2.715 . 0 0 "[ . 1 . ]" 1
366 1 22 PHE H 1 22 PHE HB3 3.380 . 3.880 2.571 2.256 2.763 . 0 0 "[ . 1 . ]" 1
367 1 22 PHE H 1 22 PHE QD 4.730 . 5.230 4.120 3.979 4.184 . 0 0 "[ . 1 . ]" 1
368 1 22 PHE H 1 23 GLN H 3.790 . 4.290 2.892 2.807 3.023 . 0 0 "[ . 1 . ]" 1
369 1 22 PHE H 1 24 ARG H 4.400 . 4.900 4.321 4.205 4.485 . 0 0 "[ . 1 . ]" 1
370 1 22 PHE H 1 25 ASN H 5.380 . 5.880 4.765 4.700 4.827 . 0 0 "[ . 1 . ]" 1
371 1 22 PHE H 1 50 TRP HH2 4.560 . 5.060 4.773 3.995 5.440 0.380 17 0 "[ . 1 . ]" 1
372 1 22 PHE H 1 50 TRP HZ3 4.340 . 4.840 4.245 3.975 4.692 . 0 0 "[ . 1 . ]" 1
373 1 22 PHE H 1 51 PHE QE 4.480 . 4.980 4.072 3.534 4.475 . 0 0 "[ . 1 . ]" 1
374 1 22 PHE H 1 51 PHE HZ 3.980 . 4.480 3.322 2.782 3.806 . 0 0 "[ . 1 . ]" 1
375 1 22 PHE HA 1 25 ASN H 3.550 . 4.050 3.343 3.107 3.521 . 0 0 "[ . 1 . ]" 1
376 1 22 PHE HA 1 51 PHE QE 4.250 . 4.750 2.767 2.302 3.204 . 0 0 "[ . 1 . ]" 1
377 1 22 PHE QB 1 23 GLN H 3.910 . 4.410 2.813 2.603 3.122 . 0 0 "[ . 1 . ]" 1
378 1 22 PHE HB2 1 23 GLN H 4.250 . 4.750 4.012 3.803 4.197 . 0 0 "[ . 1 . ]" 1
379 1 22 PHE HB3 1 23 GLN H 4.250 . 4.750 2.876 2.650 3.236 . 0 0 "[ . 1 . ]" 1
380 1 22 PHE QD 1 23 GLN H 4.620 . 5.120 3.980 3.401 4.563 . 0 0 "[ . 1 . ]" 1
381 1 23 GLN H 1 23 GLN HB2 3.670 . 4.170 2.640 2.120 3.633 . 0 0 "[ . 1 . ]" 1
382 1 23 GLN H 1 23 GLN QB 3.580 . 4.080 2.334 2.102 2.656 . 0 0 "[ . 1 . ]" 1
383 1 23 GLN H 1 23 GLN HB3 3.670 . 4.170 3.303 2.345 3.696 . 0 0 "[ . 1 . ]" 1
384 1 23 GLN H 1 23 GLN HG2 3.740 . 4.240 2.837 2.336 3.534 . 0 0 "[ . 1 . ]" 1
385 1 23 GLN H 1 23 GLN QG 3.660 . 4.160 2.517 2.230 2.913 . 0 0 "[ . 1 . ]" 1
386 1 23 GLN H 1 23 GLN HG3 3.740 . 4.240 3.295 2.271 3.944 . 0 0 "[ . 1 . ]" 1
387 1 23 GLN H 1 24 ARG H 3.540 . 4.040 2.817 2.577 2.944 . 0 0 "[ . 1 . ]" 1
388 1 23 GLN H 1 24 ARG QB 5.500 . 6.000 5.083 4.749 5.267 . 0 0 "[ . 1 . ]" 1
389 1 23 GLN H 1 25 ASN H 4.000 . 4.500 4.277 4.140 4.491 . 0 0 "[ . 1 . ]" 1
390 1 23 GLN H 1 50 TRP HH2 5.500 . 6.000 6.227 5.753 6.882 0.882 11 4 "[ . - 1+ .**]" 1
391 1 23 GLN HA 1 23 GLN QE 4.340 . 4.840 3.777 2.351 4.586 . 0 0 "[ . 1 . ]" 1
392 1 23 GLN HA 1 25 ASN H 4.480 . 4.980 4.763 4.556 5.024 0.044 4 0 "[ . 1 . ]" 1
393 1 23 GLN QB 1 24 ARG H 4.130 . 4.630 3.390 3.005 3.944 . 0 0 "[ . 1 . ]" 1
394 1 23 GLN HB2 1 24 ARG H 4.220 . 4.720 3.646 3.143 4.468 . 0 0 "[ . 1 . ]" 1
395 1 23 GLN HB3 1 24 ARG H 4.220 . 4.720 4.111 3.822 4.389 . 0 0 "[ . 1 . ]" 1
396 1 23 GLN QE 1 24 ARG QB 5.500 . 6.000 5.885 3.188 7.243 1.243 6 4 "[ .+- *1 *. ]" 1
397 1 23 GLN QG 1 24 ARG H 5.110 . 5.610 4.178 2.540 4.733 . 0 0 "[ . 1 . ]" 1
398 1 24 ARG H 1 24 ARG QD 4.710 . 5.210 4.198 3.816 4.540 . 0 0 "[ . 1 . ]" 1
399 1 24 ARG H 1 24 ARG HG2 4.060 . 4.560 2.397 2.187 2.696 . 0 0 "[ . 1 . ]" 1
400 1 24 ARG H 1 24 ARG QG 3.950 . 4.450 2.319 2.154 2.516 . 0 0 "[ . 1 . ]" 1
401 1 24 ARG H 1 24 ARG HG3 4.060 . 4.560 3.185 2.755 3.835 . 0 0 "[ . 1 . ]" 1
402 1 24 ARG H 1 25 ASN H 2.640 . 3.140 2.037 1.867 2.213 . 0 0 "[ . 1 . ]" 1
403 1 24 ARG H 1 25 ASN HA 5.130 . 5.630 4.797 4.676 4.969 . 0 0 "[ . 1 . ]" 1
404 1 24 ARG H 1 25 ASN QB 4.920 . 5.420 4.230 4.045 4.348 . 0 0 "[ . 1 . ]" 1
405 1 24 ARG HA 1 24 ARG HG2 3.940 . 4.440 3.812 3.756 3.926 . 0 0 "[ . 1 . ]" 1
406 1 24 ARG HA 1 24 ARG QG 3.810 . 4.310 3.377 3.354 3.403 . 0 0 "[ . 1 . ]" 1
407 1 24 ARG HA 1 24 ARG HG3 3.940 . 4.440 3.771 3.732 3.832 . 0 0 "[ . 1 . ]" 1
408 1 24 ARG QD 1 25 ASN H 4.940 . 5.440 4.677 4.398 4.842 . 0 0 "[ . 1 . ]" 1
409 1 24 ARG QG 1 25 ASN H 4.150 . 4.650 2.652 2.491 2.792 . 0 0 "[ . 1 . ]" 1
410 1 24 ARG HG2 1 25 ASN H 4.210 . 4.710 3.194 2.602 3.558 . 0 0 "[ . 1 . ]" 1
411 1 24 ARG HG3 1 25 ASN H 4.210 . 4.710 2.905 2.636 3.357 . 0 0 "[ . 1 . ]" 1
412 1 25 ASN H 1 25 ASN QB 3.590 . 4.090 2.685 2.577 2.784 . 0 0 "[ . 1 . ]" 1
413 1 25 ASN H 1 26 ARG H 4.550 . 5.050 3.983 3.609 4.206 . 0 0 "[ . 1 . ]" 1
414 1 25 ASN H 1 26 ARG HA 4.920 . 5.420 4.623 4.374 4.804 . 0 0 "[ . 1 . ]" 1
415 1 25 ASN H 1 26 ARG QG 5.540 . 6.040 4.550 4.041 5.142 . 0 0 "[ . 1 . ]" 1
416 1 25 ASN HA 1 26 ARG H 3.000 . 3.500 2.198 2.129 2.282 . 0 0 "[ . 1 . ]" 1
417 1 25 ASN HA 1 26 ARG HA 4.670 . 5.170 4.528 4.477 4.581 . 0 0 "[ . 1 . ]" 1
418 1 25 ASN HA 1 26 ARG QG 4.380 . 4.880 4.052 3.602 4.752 . 0 0 "[ . 1 . ]" 1
419 1 25 ASN HA 1 27 TYR H 3.700 . 4.200 3.502 3.319 3.717 . 0 0 "[ . 1 . ]" 1
420 1 25 ASN QB 1 26 ARG H 4.620 . 5.120 3.962 3.777 4.094 . 0 0 "[ . 1 . ]" 1
421 1 25 ASN QB 1 27 TYR H 4.930 . 5.430 4.003 3.818 4.403 . 0 0 "[ . 1 . ]" 1
422 1 25 ASN QD 1 27 TYR H 5.900 . 6.400 3.929 3.393 4.688 . 0 0 "[ . 1 . ]" 1
423 1 25 ASN QD 1 28 PRO HA 3.790 . 4.290 2.257 2.021 2.771 . 0 0 "[ . 1 . ]" 1
424 1 25 ASN QD 1 28 PRO HB2 5.320 . 5.820 4.263 3.805 4.993 . 0 0 "[ . 1 . ]" 1
425 1 25 ASN QD 1 29 ASP H 4.550 . 5.050 3.633 3.261 3.996 . 0 0 "[ . 1 . ]" 1
426 1 25 ASN QD 1 32 THR MG 4.930 . 5.430 3.242 2.727 3.770 . 0 0 "[ . 1 . ]" 1
427 1 25 ASN HD21 1 28 PRO HA 3.980 . 4.480 3.310 2.905 3.571 . 0 0 "[ . 1 . ]" 1
428 1 25 ASN HD21 1 29 ASP H 4.720 . 5.220 4.759 4.405 5.010 . 0 0 "[ . 1 . ]" 1
429 1 25 ASN HD21 1 32 THR MG 5.070 . 5.570 3.413 2.916 3.975 . 0 0 "[ . 1 . ]" 1
430 1 25 ASN HD22 1 28 PRO HA 3.980 . 4.480 2.309 2.038 2.939 . 0 0 "[ . 1 . ]" 1
431 1 25 ASN HD22 1 29 ASP H 4.720 . 5.220 3.782 3.338 4.226 . 0 0 "[ . 1 . ]" 1
432 1 25 ASN HD22 1 32 THR MG 5.070 . 5.570 4.054 3.234 4.680 . 0 0 "[ . 1 . ]" 1
433 1 26 ARG H 1 26 ARG HD2 4.510 . 5.010 4.659 3.931 5.128 0.118 9 0 "[ . 1 . ]" 1
434 1 26 ARG H 1 26 ARG QD 4.430 . 4.930 3.890 3.225 4.463 . 0 0 "[ . 1 . ]" 1
435 1 26 ARG H 1 26 ARG HD3 4.510 . 5.010 4.233 3.290 4.968 . 0 0 "[ . 1 . ]" 1
436 1 26 ARG H 1 26 ARG HE 5.500 . 6.000 5.010 2.948 5.747 . 0 0 "[ . 1 . ]" 1
437 1 26 ARG H 1 26 ARG HG2 3.730 . 4.230 3.403 2.024 4.300 0.070 2 0 "[ . 1 . ]" 1
438 1 26 ARG H 1 26 ARG QG 3.570 . 4.070 2.478 1.982 3.055 . 0 0 "[ . 1 . ]" 1
439 1 26 ARG H 1 26 ARG HG3 3.730 . 4.230 2.771 2.269 3.861 . 0 0 "[ . 1 . ]" 1
440 1 26 ARG H 1 27 TYR H 3.370 . 3.870 2.550 2.195 2.741 . 0 0 "[ . 1 . ]" 1
441 1 26 ARG H 1 27 TYR QD 4.820 . 5.320 3.757 3.112 4.224 . 0 0 "[ . 1 . ]" 1
442 1 26 ARG HA 1 26 ARG HE 4.780 . 5.280 4.710 3.722 5.037 . 0 0 "[ . 1 . ]" 1
443 1 26 ARG QB 1 27 TYR H 4.430 . 4.930 3.347 3.019 3.988 . 0 0 "[ . 1 . ]" 1
444 1 26 ARG HB2 1 26 ARG HE 4.150 . 4.650 3.048 2.020 4.278 . 0 0 "[ . 1 . ]" 1
445 1 26 ARG HB2 1 27 TYR H 4.700 . 5.200 3.529 3.117 4.407 . 0 0 "[ . 1 . ]" 1
446 1 26 ARG HB3 1 26 ARG HE 4.150 . 4.650 2.883 1.968 3.654 . 0 0 "[ . 1 . ]" 1
447 1 26 ARG HB3 1 27 TYR H 4.700 . 5.200 4.197 3.888 4.564 . 0 0 "[ . 1 . ]" 1
448 1 26 ARG HE 1 27 TYR QE 5.210 . 5.710 3.690 2.598 5.527 . 0 0 "[ . 1 . ]" 1
449 1 26 ARG QG 1 27 TYR H 4.580 . 5.080 4.310 3.302 4.660 . 0 0 "[ . 1 . ]" 1
450 1 27 TYR H 1 27 TYR HB2 4.070 . 4.570 2.751 2.531 2.924 . 0 0 "[ . 1 . ]" 1
451 1 27 TYR H 1 27 TYR HB3 4.070 . 4.570 3.837 3.715 3.918 . 0 0 "[ . 1 . ]" 1
452 1 27 TYR H 1 27 TYR QD 3.970 . 4.470 3.229 2.499 3.616 . 0 0 "[ . 1 . ]" 1
453 1 27 TYR H 1 27 TYR QE 5.200 . 5.700 4.976 4.623 5.246 . 0 0 "[ . 1 . ]" 1
454 1 27 TYR H 1 28 PRO QD 3.560 . 4.060 2.893 2.617 3.169 . 0 0 "[ . 1 . ]" 1
455 1 27 TYR H 1 28 PRO HG2 5.500 . 6.000 5.654 5.383 5.873 . 0 0 "[ . 1 . ]" 1
456 1 27 TYR H 1 28 PRO QG 5.380 . 5.880 4.894 4.642 5.128 . 0 0 "[ . 1 . ]" 1
457 1 27 TYR H 1 28 PRO HG3 5.500 . 6.000 5.360 5.071 5.656 . 0 0 "[ . 1 . ]" 1
458 1 27 TYR QD 3 3 DG H1' 6.730 . 7.230 6.239 4.227 6.737 . 0 0 "[ . 1 . ]" 1
459 1 27 TYR QD 3 3 DG H4' 6.730 . 7.230 3.765 2.087 5.051 . 0 0 "[ . 1 . ]" 1
460 1 27 TYR QD 3 3 DG H5' 6.730 . 7.230 3.901 2.424 4.571 . 0 0 "[ . 1 . ]" 1
461 1 27 TYR QD 3 3 DG H5'' 6.730 . 7.230 2.549 2.130 4.593 . 0 0 "[ . 1 . ]" 1
462 1 27 TYR QE 3 3 DG H1' 6.730 . 7.230 5.561 3.293 6.214 . 0 0 "[ . 1 . ]" 1
463 1 27 TYR QE 3 3 DG H4' 6.730 . 7.230 3.854 2.483 4.620 . 0 0 "[ . 1 . ]" 1
464 1 27 TYR QE 3 3 DG H5' 6.730 . 7.230 5.087 3.648 5.593 . 0 0 "[ . 1 . ]" 1
465 1 27 TYR QE 3 3 DG H5'' 6.730 . 7.230 3.793 2.552 5.704 . 0 0 "[ . 1 . ]" 1
466 1 27 TYR QE 3 3 DG H8 6.930 . 7.230 6.112 5.284 6.449 . 0 0 "[ . 1 . ]" 1
467 1 27 TYR QE 3 4 DG H8 6.730 . 7.230 6.326 5.825 6.906 . 0 0 "[ . 1 . ]" 1
468 1 28 PRO HA 1 29 ASP H 2.950 . 3.450 2.212 2.120 2.484 . 0 0 "[ . 1 . ]" 1
469 1 28 PRO HA 1 29 ASP QB 4.820 . 5.320 4.125 3.925 4.436 . 0 0 "[ . 1 . ]" 1
470 1 28 PRO HA 1 32 THR MG 4.650 . 5.150 3.569 2.992 4.123 . 0 0 "[ . 1 . ]" 1
471 1 28 PRO HB2 1 29 ASP H 4.160 . 4.660 3.203 2.448 3.645 . 0 0 "[ . 1 . ]" 1
472 1 28 PRO HB2 1 32 THR H 4.450 . 4.950 4.682 4.282 5.020 0.070 6 0 "[ . 1 . ]" 1
473 1 28 PRO HB2 1 32 THR MG 4.440 . 4.940 2.801 2.490 3.157 . 0 0 "[ . 1 . ]" 1
474 1 28 PRO HB2 1 33 ARG H 3.970 . 4.470 3.506 3.249 3.847 . 0 0 "[ . 1 . ]" 1
475 1 28 PRO HB3 1 29 ASP H 3.730 . 4.230 3.793 3.427 4.128 . 0 0 "[ . 1 . ]" 1
476 1 28 PRO HB3 1 32 THR MG 4.160 . 4.660 2.769 2.405 3.121 . 0 0 "[ . 1 . ]" 1
477 1 28 PRO HB3 1 33 ARG H 5.190 . 5.690 5.147 4.876 5.496 . 0 0 "[ . 1 . ]" 1
478 1 28 PRO HB3 1 33 ARG QG 5.310 . 5.810 4.018 3.591 5.215 . 0 0 "[ . 1 . ]" 1
479 1 28 PRO QG 1 33 ARG HE 6.010 . 6.510 4.961 2.768 5.680 . 0 0 "[ . 1 . ]" 1
480 1 29 ASP H 1 29 ASP HB2 3.770 . 4.270 2.709 2.261 3.694 . 0 0 "[ . 1 . ]" 1
481 1 29 ASP H 1 29 ASP QB 3.680 . 4.180 2.298 2.130 2.768 . 0 0 "[ . 1 . ]" 1
482 1 29 ASP H 1 29 ASP HB3 3.770 . 4.270 2.764 2.273 3.624 . 0 0 "[ . 1 . ]" 1
483 1 29 ASP H 1 30 MET H 4.840 . 5.340 4.681 4.599 4.721 . 0 0 "[ . 1 . ]" 1
484 1 29 ASP H 1 30 MET HA 5.500 . 6.000 5.808 5.524 6.010 0.010 15 0 "[ . 1 . ]" 1
485 1 29 ASP H 1 32 THR HA 4.750 . 5.250 5.525 4.898 6.083 0.833 1 5 "[+ *. * - *. ]" 1
486 1 29 ASP H 1 32 THR HB 3.610 . 4.110 2.719 2.289 3.264 . 0 0 "[ . 1 . ]" 1
487 1 29 ASP H 1 32 THR MG 4.720 . 5.220 3.710 3.301 4.293 . 0 0 "[ . 1 . ]" 1
488 1 29 ASP H 1 33 ARG H 4.660 . 5.160 4.396 3.950 4.878 . 0 0 "[ . 1 . ]" 1
489 1 29 ASP H 1 33 ARG HA 5.500 . 6.000 6.361 5.882 6.844 0.844 4 5 "[* +. * 1 - * ]" 1
490 1 29 ASP HA 1 30 MET H 3.290 . 3.790 2.401 2.313 2.530 . 0 0 "[ . 1 . ]" 1
491 1 29 ASP HA 1 31 SER H 4.650 . 5.150 4.410 4.057 4.648 . 0 0 "[ . 1 . ]" 1
492 1 29 ASP QB 1 30 MET H 3.610 . 4.110 3.035 2.426 3.561 . 0 0 "[ . 1 . ]" 1
493 1 29 ASP HB2 1 31 SER H 4.130 . 4.630 3.989 3.205 4.926 0.296 14 0 "[ . 1 . ]" 1
494 1 29 ASP HB3 1 31 SER H 4.130 . 4.630 3.534 2.455 4.782 0.152 12 0 "[ . 1 . ]" 1
495 1 30 MET H 1 30 MET QG 3.520 . 4.020 2.577 2.061 3.513 . 0 0 "[ . 1 . ]" 1
496 1 30 MET H 1 31 SER H 3.400 . 3.900 3.011 2.634 3.237 . 0 0 "[ . 1 . ]" 1
497 1 30 MET HA 1 33 ARG QB 4.430 . 4.930 2.510 2.177 2.779 . 0 0 "[ . 1 . ]" 1
498 1 30 MET HA 1 33 ARG HE 4.140 . 4.640 3.455 3.048 4.018 . 0 0 "[ . 1 . ]" 1
499 1 30 MET HA 1 34 GLU H 4.320 . 4.820 3.965 3.645 4.320 . 0 0 "[ . 1 . ]" 1
500 1 30 MET HA 1 48 ARG QG 6.010 . 6.510 5.685 5.268 6.295 . 0 0 "[ . 1 . ]" 1
501 1 30 MET QB 1 31 SER H 4.130 . 4.630 3.544 3.459 3.698 . 0 0 "[ . 1 . ]" 1
502 1 30 MET HB2 1 31 SER H 4.230 . 4.730 3.939 3.740 4.170 . 0 0 "[ . 1 . ]" 1
503 1 30 MET HB3 1 31 SER H 4.230 . 4.730 4.037 3.856 4.283 . 0 0 "[ . 1 . ]" 1
504 1 30 MET ME 1 31 SER QB 5.970 . 6.470 4.848 4.268 5.809 . 0 0 "[ . 1 . ]" 1
505 1 30 MET ME 3 1 DC H1' 7.210 . 7.710 5.194 4.409 6.372 . 0 0 "[ . 1 . ]" 1
506 1 30 MET ME 3 1 DC H4' 7.210 . 7.710 2.833 2.105 5.112 . 0 0 "[ . 1 . ]" 1
507 1 30 MET ME 3 2 DG H8 7.510 . 7.710 6.679 5.805 7.487 . 0 0 "[ . 1 . ]" 1
508 1 30 MET QG 1 31 SER H 3.460 . 3.960 2.361 2.035 3.016 . 0 0 "[ . 1 . ]" 1
509 1 31 SER H 1 31 SER QB 3.340 . 3.840 2.400 2.192 2.633 . 0 0 "[ . 1 . ]" 1
510 1 31 SER H 1 32 THR MG 6.610 . 7.110 5.884 5.664 6.066 . 0 0 "[ . 1 . ]" 1
511 1 31 SER H 1 33 ARG H 4.200 . 4.700 4.061 3.843 4.298 . 0 0 "[ . 1 . ]" 1
512 1 31 SER H 1 34 GLU H 5.490 . 5.990 4.826 4.528 5.158 . 0 0 "[ . 1 . ]" 1
513 1 31 SER HA 1 34 GLU H 3.870 . 4.370 3.693 3.184 4.067 . 0 0 "[ . 1 . ]" 1
514 1 31 SER HA 1 34 GLU QB 4.990 . 5.490 4.065 3.617 4.388 . 0 0 "[ . 1 . ]" 1
515 1 31 SER HA 1 34 GLU QG 5.330 . 5.830 2.323 2.053 2.686 . 0 0 "[ . 1 . ]" 1
516 1 31 SER HA 1 35 GLU H 4.380 . 4.880 4.552 3.993 5.204 0.324 16 0 "[ . 1 . ]" 1
517 1 31 SER HA 1 35 GLU QG 5.330 . 5.830 4.519 4.009 4.930 . 0 0 "[ . 1 . ]" 1
518 1 31 SER QB 1 32 THR H 3.770 . 4.270 3.170 2.604 3.761 . 0 0 "[ . 1 . ]" 1
519 1 32 THR H 1 32 THR HB 3.140 . 3.640 2.536 2.367 2.839 . 0 0 "[ . 1 . ]" 1
520 1 32 THR H 1 33 ARG H 3.430 . 3.930 2.474 2.212 2.858 . 0 0 "[ . 1 . ]" 1
521 1 32 THR H 1 34 GLU H 5.060 . 5.560 4.080 3.724 4.496 . 0 0 "[ . 1 . ]" 1
522 1 32 THR H 1 35 GLU H 4.910 . 5.410 4.841 4.656 5.159 . 0 0 "[ . 1 . ]" 1
523 1 32 THR HA 1 35 GLU H 5.310 . 5.810 3.440 3.195 3.836 . 0 0 "[ . 1 . ]" 1
524 1 32 THR HA 1 35 GLU HB2 3.490 . 3.990 2.861 2.617 3.578 . 0 0 "[ . 1 . ]" 1
525 1 32 THR HA 1 35 GLU HB3 4.490 . 4.990 4.492 4.199 5.298 0.308 7 0 "[ . 1 . ]" 1
526 1 32 THR HA 1 36 ILE H 4.320 . 4.820 4.173 4.028 4.588 . 0 0 "[ . 1 . ]" 1
527 1 32 THR HB 1 33 ARG H 3.530 . 4.030 2.656 2.430 2.804 . 0 0 "[ . 1 . ]" 1
528 1 32 THR MG 1 33 ARG H 4.610 . 5.110 3.633 3.473 3.832 . 0 0 "[ . 1 . ]" 1
529 1 32 THR MG 1 33 ARG HA 4.860 . 5.360 3.810 3.622 4.211 . 0 0 "[ . 1 . ]" 1
530 1 32 THR MG 1 34 GLU H 6.610 . 7.110 5.269 5.056 5.433 . 0 0 "[ . 1 . ]" 1
531 1 32 THR MG 1 35 GLU H 6.610 . 7.110 4.691 4.295 5.046 . 0 0 "[ . 1 . ]" 1
532 1 32 THR MG 1 35 GLU HB2 5.220 . 5.720 3.789 3.358 4.396 . 0 0 "[ . 1 . ]" 1
533 1 32 THR MG 1 36 ILE H 5.000 . 5.500 4.076 3.841 4.568 . 0 0 "[ . 1 . ]" 1
534 1 32 THR MG 1 36 ILE HB 5.150 . 5.650 4.497 4.172 5.142 . 0 0 "[ . 1 . ]" 1
535 1 32 THR MG 1 36 ILE MD 4.440 . 4.940 2.303 2.086 2.605 . 0 0 "[ . 1 . ]" 1
536 1 33 ARG H 1 33 ARG HB2 3.610 . 4.110 2.445 2.183 2.555 . 0 0 "[ . 1 . ]" 1
537 1 33 ARG H 1 33 ARG QB 3.520 . 4.020 2.399 2.112 2.509 . 0 0 "[ . 1 . ]" 1
538 1 33 ARG H 1 33 ARG HB3 3.610 . 4.110 3.523 2.598 3.665 . 0 0 "[ . 1 . ]" 1
539 1 33 ARG H 1 33 ARG HD2 5.330 . 5.830 5.026 4.959 5.340 . 0 0 "[ . 1 . ]" 1
540 1 33 ARG H 1 33 ARG QD 5.220 . 5.720 4.412 4.209 4.934 . 0 0 "[ . 1 . ]" 1
541 1 33 ARG H 1 33 ARG HD3 5.330 . 5.830 4.908 4.551 5.836 0.006 14 0 "[ . 1 . ]" 1
542 1 33 ARG H 1 33 ARG HE 5.230 . 5.730 4.921 4.537 5.220 . 0 0 "[ . 1 . ]" 1
543 1 33 ARG H 1 33 ARG QG 4.440 . 4.940 2.549 2.302 3.904 . 0 0 "[ . 1 . ]" 1
544 1 33 ARG H 1 34 GLU H 3.680 . 4.180 2.809 2.770 2.848 . 0 0 "[ . 1 . ]" 1
545 1 33 ARG H 1 35 GLU H 4.050 . 4.550 4.231 4.091 4.439 . 0 0 "[ . 1 . ]" 1
546 1 33 ARG H 1 36 ILE MD 5.500 . 6.000 4.227 3.828 4.525 . 0 0 "[ . 1 . ]" 1
547 1 33 ARG HA 1 35 GLU H 4.840 . 5.340 4.322 4.041 4.480 . 0 0 "[ . 1 . ]" 1
548 1 33 ARG HA 1 36 ILE H 4.190 . 4.690 3.521 3.337 3.642 . 0 0 "[ . 1 . ]" 1
549 1 33 ARG HA 1 36 ILE HB 3.850 . 4.350 2.676 2.463 2.940 . 0 0 "[ . 1 . ]" 1
550 1 33 ARG HA 1 36 ILE MD 4.700 . 5.200 2.470 2.131 2.964 . 0 0 "[ . 1 . ]" 1
551 1 33 ARG HA 1 36 ILE MG 5.120 . 5.620 4.002 3.837 4.258 . 0 0 "[ . 1 . ]" 1
552 1 33 ARG HA 1 37 ALA H 4.470 . 4.970 4.114 3.917 4.404 . 0 0 "[ . 1 . ]" 1
553 1 33 ARG HA 1 47 VAL MG1 4.650 . 5.150 2.583 2.340 3.063 . 0 0 "[ . 1 . ]" 1
554 1 33 ARG QB 1 33 ARG HE 3.380 . 3.880 2.511 2.296 2.661 . 0 0 "[ . 1 . ]" 1
555 1 33 ARG QB 1 34 GLU H 4.320 . 4.820 2.765 2.604 2.866 . 0 0 "[ . 1 . ]" 1
556 1 33 ARG QB 1 37 ALA H 6.010 . 6.510 4.873 4.591 5.438 . 0 0 "[ . 1 . ]" 1
557 1 33 ARG QB 1 44 GLU HA 4.920 . 5.420 3.082 2.400 4.063 . 0 0 "[ . 1 . ]" 1
558 1 33 ARG QB 1 44 GLU QG 4.610 . 5.110 2.217 1.979 3.862 . 0 0 "[ . 1 . ]" 1
559 1 33 ARG QB 1 47 VAL MG1 6.130 . 6.630 2.960 2.667 3.992 . 0 0 "[ . 1 . ]" 1
560 1 33 ARG HB2 1 33 ARG HE 3.630 . 4.130 2.737 2.408 2.961 . 0 0 "[ . 1 . ]" 1
561 1 33 ARG HB3 1 33 ARG HE 3.630 . 4.130 2.972 2.698 3.595 . 0 0 "[ . 1 . ]" 1
562 1 33 ARG QD 1 47 VAL MG1 5.890 . 6.390 2.767 2.382 3.271 . 0 0 "[ . 1 . ]" 1
563 1 33 ARG QD 1 48 ARG H 4.760 . 5.260 3.163 2.553 3.536 . 0 0 "[ . 1 . ]" 1
564 1 33 ARG QD 1 48 ARG HA 4.380 . 4.880 2.628 2.196 3.525 . 0 0 "[ . 1 . ]" 1
565 1 33 ARG QD 1 48 ARG HE 5.420 . 5.920 4.116 2.956 4.905 . 0 0 "[ . 1 . ]" 1
566 1 33 ARG HD2 1 48 ARG HE 5.500 . 6.000 4.398 3.129 5.633 . 0 0 "[ . 1 . ]" 1
567 1 33 ARG HD3 1 48 ARG HE 5.500 . 6.000 4.990 3.635 5.498 . 0 0 "[ . 1 . ]" 1
568 1 33 ARG HE 1 34 GLU H 5.340 . 5.840 5.534 5.180 6.115 0.275 17 0 "[ . 1 . ]" 1
569 1 33 ARG HE 1 44 GLU HA 5.000 . 5.500 4.739 3.667 6.507 1.007 17 2 "[ . 1 -. +]" 1
570 1 33 ARG HE 1 44 GLU QG 4.400 . 4.900 2.928 2.244 4.627 . 0 0 "[ . 1 . ]" 1
571 1 33 ARG HE 1 47 VAL MG1 5.560 . 6.060 4.540 4.311 4.742 . 0 0 "[ . 1 . ]" 1
572 1 33 ARG HE 1 48 ARG HA 4.510 . 5.010 4.127 3.728 5.183 0.173 9 0 "[ . 1 . ]" 1
573 1 33 ARG HE 1 48 ARG QB 4.610 . 5.110 3.010 2.329 4.515 . 0 0 "[ . 1 . ]" 1
574 1 33 ARG HE 1 48 ARG QD 4.830 . 5.330 4.250 2.921 5.001 . 0 0 "[ . 1 . ]" 1
575 1 33 ARG HE 1 48 ARG HE 4.490 . 4.990 3.204 2.567 5.299 0.309 9 0 "[ . 1 . ]" 1
576 1 33 ARG HE 1 48 ARG QG 3.790 . 4.290 2.942 2.358 3.501 . 0 0 "[ . 1 . ]" 1
577 1 33 ARG QG 1 34 GLU H 5.300 . 5.800 4.272 4.010 4.405 . 0 0 "[ . 1 . ]" 1
578 1 33 ARG QG 1 47 VAL MG1 6.430 . 6.930 2.453 2.118 2.762 . 0 0 "[ . 1 . ]" 1
579 1 34 GLU H 1 34 GLU HB2 3.600 . 4.100 3.673 3.637 3.707 . 0 0 "[ . 1 . ]" 1
580 1 34 GLU H 1 34 GLU QB 3.300 . 3.800 2.519 2.426 2.586 . 0 0 "[ . 1 . ]" 1
581 1 34 GLU H 1 34 GLU HB3 3.600 . 4.100 2.566 2.464 2.644 . 0 0 "[ . 1 . ]" 1
582 1 34 GLU H 1 34 GLU HG2 3.680 . 4.180 2.490 2.243 2.736 . 0 0 "[ . 1 . ]" 1
583 1 34 GLU H 1 34 GLU QG 3.480 . 3.980 2.441 2.222 2.679 . 0 0 "[ . 1 . ]" 1
584 1 34 GLU H 1 34 GLU HG3 3.680 . 4.180 3.549 3.162 3.820 . 0 0 "[ . 1 . ]" 1
585 1 34 GLU H 1 35 GLU H 3.550 . 4.050 2.743 2.671 2.816 . 0 0 "[ . 1 . ]" 1
586 1 34 GLU H 1 36 ILE H 5.500 . 6.000 4.398 4.312 4.508 . 0 0 "[ . 1 . ]" 1
587 1 34 GLU H 1 37 ALA MB 5.800 . 6.300 4.524 4.447 4.591 . 0 0 "[ . 1 . ]" 1
588 1 34 GLU H 1 47 VAL MG1 6.610 . 7.110 5.382 5.095 5.781 . 0 0 "[ . 1 . ]" 1
589 1 34 GLU HA 1 37 ALA H 3.650 . 4.150 3.135 2.908 3.356 . 0 0 "[ . 1 . ]" 1
590 1 34 GLU HA 1 37 ALA MB 4.440 . 4.940 2.190 2.091 2.318 . 0 0 "[ . 1 . ]" 1
591 1 34 GLU HA 1 44 GLU H 4.780 . 5.280 3.885 3.437 4.476 . 0 0 "[ . 1 . ]" 1
592 1 34 GLU HA 1 44 GLU HA 4.080 . 4.580 3.294 2.969 3.922 . 0 0 "[ . 1 . ]" 1
593 1 34 GLU QB 1 35 GLU H 4.710 . 5.210 3.742 3.633 3.870 . 0 0 "[ . 1 . ]" 1
594 1 34 GLU QB 1 38 VAL MG2 7.010 . 7.510 4.046 3.659 4.364 . 0 0 "[ . 1 . ]" 1
595 1 34 GLU QG 1 35 GLU H 4.770 . 5.270 2.629 2.368 2.838 . 0 0 "[ . 1 . ]" 1
596 1 34 GLU QG 1 35 GLU HA 4.610 . 5.110 3.645 3.397 3.901 . 0 0 "[ . 1 . ]" 1
597 1 34 GLU QG 1 35 GLU QG 4.060 . 4.560 2.903 2.491 3.266 . 0 0 "[ . 1 . ]" 1
598 1 34 GLU HG2 1 35 GLU HA 4.720 . 5.220 4.998 4.697 5.500 0.280 5 0 "[ . 1 . ]" 1
599 1 34 GLU HG3 1 35 GLU HA 4.720 . 5.220 3.750 3.485 3.990 . 0 0 "[ . 1 . ]" 1
600 1 35 GLU H 1 35 GLU HB2 3.370 . 3.870 2.397 2.295 2.532 . 0 0 "[ . 1 . ]" 1
601 1 35 GLU H 1 35 GLU HB3 3.570 . 4.070 3.617 3.580 3.665 . 0 0 "[ . 1 . ]" 1
602 1 35 GLU H 1 35 GLU HG2 3.990 . 4.490 3.745 3.465 3.892 . 0 0 "[ . 1 . ]" 1
603 1 35 GLU H 1 35 GLU QG 3.500 . 4.000 2.568 2.429 2.711 . 0 0 "[ . 1 . ]" 1
604 1 35 GLU H 1 35 GLU HG3 3.990 . 4.490 2.616 2.473 2.790 . 0 0 "[ . 1 . ]" 1
605 1 35 GLU H 1 36 ILE H 3.630 . 4.130 2.670 2.410 2.811 . 0 0 "[ . 1 . ]" 1
606 1 35 GLU H 1 36 ILE HB 5.090 . 5.590 4.650 4.318 4.834 . 0 0 "[ . 1 . ]" 1
607 1 35 GLU H 1 36 ILE MD 6.020 . 6.520 5.018 4.438 5.417 . 0 0 "[ . 1 . ]" 1
608 1 35 GLU H 1 36 ILE QG 6.010 . 6.510 4.423 4.142 4.711 . 0 0 "[ . 1 . ]" 1
609 1 35 GLU H 1 37 ALA H 4.280 . 4.780 3.922 3.714 4.113 . 0 0 "[ . 1 . ]" 1
610 1 35 GLU H 1 37 ALA MB 5.790 . 6.290 4.559 4.381 4.677 . 0 0 "[ . 1 . ]" 1
611 1 35 GLU H 1 38 VAL MG2 5.130 . 5.630 4.667 4.455 4.877 . 0 0 "[ . 1 . ]" 1
612 1 35 GLU HA 1 35 GLU HG2 3.860 . 4.360 2.447 2.286 2.611 . 0 0 "[ . 1 . ]" 1
613 1 35 GLU HA 1 35 GLU HG3 3.860 . 4.360 2.964 2.803 3.246 . 0 0 "[ . 1 . ]" 1
614 1 35 GLU HA 1 36 ILE HA 5.100 . 5.600 4.867 4.809 4.931 . 0 0 "[ . 1 . ]" 1
615 1 35 GLU HA 1 38 VAL H 3.470 . 3.970 3.127 2.903 3.334 . 0 0 "[ . 1 . ]" 1
616 1 35 GLU HA 1 38 VAL HB 3.840 . 4.340 2.926 2.419 3.569 . 0 0 "[ . 1 . ]" 1
617 1 35 GLU HA 1 38 VAL MG1 5.030 . 5.530 4.297 3.858 4.655 . 0 0 "[ . 1 . ]" 1
618 1 35 GLU HA 1 38 VAL MG2 4.310 . 4.810 2.776 2.198 3.185 . 0 0 "[ . 1 . ]" 1
619 1 35 GLU HA 1 39 TRP H 5.250 . 5.750 4.265 4.018 4.915 . 0 0 "[ . 1 . ]" 1
620 1 35 GLU HA 1 39 TRP HE1 4.710 . 5.210 4.795 4.261 5.144 . 0 0 "[ . 1 . ]" 1
621 1 35 GLU HB2 1 36 ILE H 3.650 . 4.150 2.617 2.461 2.768 . 0 0 "[ . 1 . ]" 1
622 1 35 GLU HB3 1 36 ILE H 3.700 . 4.200 3.440 3.257 3.563 . 0 0 "[ . 1 . ]" 1
623 1 35 GLU HB3 1 37 ALA H 5.500 . 6.000 5.446 5.366 5.518 . 0 0 "[ . 1 . ]" 1
624 1 35 GLU HB3 1 39 TRP H 5.250 . 5.750 4.976 4.712 5.422 . 0 0 "[ . 1 . ]" 1
625 1 35 GLU HB3 1 39 TRP HE1 4.220 . 4.720 2.791 2.254 3.232 . 0 0 "[ . 1 . ]" 1
626 1 35 GLU QG 1 36 ILE H 6.010 . 6.510 4.229 4.021 4.327 . 0 0 "[ . 1 . ]" 1
627 1 35 GLU QG 1 38 VAL MG2 7.210 . 7.710 3.899 3.387 4.323 . 0 0 "[ . 1 . ]" 1
628 1 35 GLU QG 1 39 TRP HE1 4.780 . 5.280 4.738 4.289 5.279 . 0 0 "[ . 1 . ]" 1
629 1 36 ILE H 1 36 ILE HB 3.240 . 3.740 2.434 2.351 2.519 . 0 0 "[ . 1 . ]" 1
630 1 36 ILE H 1 36 ILE MD 4.470 . 4.970 3.372 3.153 3.556 . 0 0 "[ . 1 . ]" 1
631 1 36 ILE H 1 36 ILE HG12 4.170 . 4.670 3.595 3.457 3.697 . 0 0 "[ . 1 . ]" 1
632 1 36 ILE H 1 36 ILE QG 3.700 . 4.200 2.189 2.048 2.315 . 0 0 "[ . 1 . ]" 1
633 1 36 ILE H 1 36 ILE HG13 4.170 . 4.670 2.208 2.064 2.339 . 0 0 "[ . 1 . ]" 1
634 1 36 ILE H 1 36 ILE MG 4.520 . 5.020 3.788 3.767 3.813 . 0 0 "[ . 1 . ]" 1
635 1 36 ILE H 1 37 ALA H 3.860 . 4.360 2.784 2.730 2.848 . 0 0 "[ . 1 . ]" 1
636 1 36 ILE H 1 37 ALA MB 5.270 . 5.770 4.403 4.303 4.477 . 0 0 "[ . 1 . ]" 1
637 1 36 ILE HA 1 36 ILE HG12 3.980 . 4.480 2.625 2.497 2.741 . 0 0 "[ . 1 . ]" 1
638 1 36 ILE HA 1 36 ILE QG 3.780 . 4.280 2.416 2.312 2.497 . 0 0 "[ . 1 . ]" 1
639 1 36 ILE HA 1 36 ILE HG13 3.980 . 4.480 2.828 2.727 2.957 . 0 0 "[ . 1 . ]" 1
640 1 36 ILE HA 1 39 TRP H 3.990 . 4.490 3.432 3.218 3.854 . 0 0 "[ . 1 . ]" 1
641 1 36 ILE HA 1 39 TRP HB2 4.210 . 4.710 3.062 2.632 4.125 . 0 0 "[ . 1 . ]" 1
642 1 36 ILE HA 1 39 TRP HD1 4.410 . 4.910 2.398 2.243 2.601 . 0 0 "[ . 1 . ]" 1
643 1 36 ILE HA 1 39 TRP HE1 5.370 . 5.870 3.812 3.019 4.306 . 0 0 "[ . 1 . ]" 1
644 1 36 ILE HB 1 37 ALA H 3.480 . 3.980 2.777 2.592 2.957 . 0 0 "[ . 1 . ]" 1
645 1 36 ILE HB 1 47 VAL MG1 5.000 . 5.500 2.721 2.316 3.515 . 0 0 "[ . 1 . ]" 1
646 1 36 ILE MD 1 37 ALA H 5.800 . 6.300 4.639 4.420 4.812 . 0 0 "[ . 1 . ]" 1
647 1 36 ILE MD 1 39 TRP HE1 6.610 . 7.110 5.374 4.804 5.960 . 0 0 "[ . 1 . ]" 1
648 1 36 ILE QG 1 39 TRP HE1 5.100 . 5.600 3.853 3.310 4.434 . 0 0 "[ . 1 . ]" 1
649 1 36 ILE MG 1 37 ALA H 4.260 . 4.760 3.453 3.290 3.588 . 0 0 "[ . 1 . ]" 1
650 1 36 ILE MG 1 39 TRP HB2 5.640 . 6.140 3.918 3.471 4.554 . 0 0 "[ . 1 . ]" 1
651 1 36 ILE MG 1 39 TRP HD1 4.790 . 5.290 3.820 3.541 4.257 . 0 0 "[ . 1 . ]" 1
652 1 36 ILE MG 1 39 TRP HE1 6.520 . 7.020 5.446 4.808 5.903 . 0 0 "[ . 1 . ]" 1
653 1 36 ILE MG 1 40 THR H 4.800 . 5.300 4.171 3.838 4.752 . 0 0 "[ . 1 . ]" 1
654 1 36 ILE MG 1 40 THR HA 6.610 . 7.110 5.505 5.231 5.911 . 0 0 "[ . 1 . ]" 1
655 1 36 ILE MG 1 40 THR HG1 5.250 . 5.750 2.878 2.472 3.203 . 0 0 "[ . 1 . ]" 1
656 1 36 ILE MG 1 51 PHE QE 5.720 . 6.220 3.487 2.959 4.473 . 0 0 "[ . 1 . ]" 1
657 1 37 ALA H 1 38 VAL H 3.470 . 3.970 2.809 2.747 2.868 . 0 0 "[ . 1 . ]" 1
658 1 37 ALA H 1 38 VAL HB 4.690 . 5.190 5.125 4.852 5.321 0.131 5 0 "[ . 1 . ]" 1
659 1 37 ALA H 1 38 VAL MG2 5.490 . 5.990 4.481 4.112 4.673 . 0 0 "[ . 1 . ]" 1
660 1 37 ALA H 1 39 TRP H 5.180 . 5.680 4.431 4.298 4.900 . 0 0 "[ . 1 . ]" 1
661 1 37 ALA H 1 40 THR H 4.820 . 5.320 4.904 4.754 5.210 . 0 0 "[ . 1 . ]" 1
662 1 37 ALA H 1 40 THR HG1 4.600 . 5.100 4.276 4.148 4.375 . 0 0 "[ . 1 . ]" 1
663 1 37 ALA H 1 42 LEU HB2 4.960 . 5.460 4.968 4.621 5.221 . 0 0 "[ . 1 . ]" 1
664 1 37 ALA H 1 47 VAL HB 5.500 . 6.000 5.043 4.712 5.789 . 0 0 "[ . 1 . ]" 1
665 1 37 ALA H 1 47 VAL MG1 5.980 . 6.480 4.282 3.897 5.031 . 0 0 "[ . 1 . ]" 1
666 1 37 ALA H 1 47 VAL MG2 4.680 . 5.180 2.992 2.764 3.384 . 0 0 "[ . 1 . ]" 1
667 1 37 ALA HA 1 40 THR H 4.010 . 4.510 3.500 3.254 3.802 . 0 0 "[ . 1 . ]" 1
668 1 37 ALA HA 1 40 THR HG1 4.080 . 4.580 2.538 2.384 2.946 . 0 0 "[ . 1 . ]" 1
669 1 37 ALA HA 1 40 THR MG 4.800 . 5.300 4.227 4.079 4.643 . 0 0 "[ . 1 . ]" 1
670 1 37 ALA HA 1 41 ASN H 4.560 . 5.060 4.126 3.780 4.452 . 0 0 "[ . 1 . ]" 1
671 1 37 ALA HA 1 42 LEU CG 6.900 . 7.400 4.414 4.226 4.604 . 0 0 "[ . 1 . ]" 1
672 1 37 ALA HA 1 42 LEU H 3.420 . 3.920 2.699 2.282 3.210 . 0 0 "[ . 1 . ]" 1
673 1 37 ALA HA 1 42 LEU HB2 4.040 . 4.540 2.314 2.162 2.574 . 0 0 "[ . 1 . ]" 1
674 1 37 ALA HA 1 43 THR H 4.450 . 4.950 4.701 4.412 5.091 0.141 13 0 "[ . 1 . ]" 1
675 1 37 ALA HA 1 47 VAL MG2 4.610 . 5.110 2.980 2.593 3.814 . 0 0 "[ . 1 . ]" 1
676 1 37 ALA MB 1 38 VAL H 4.130 . 4.630 2.941 2.637 3.183 . 0 0 "[ . 1 . ]" 1
677 1 37 ALA MB 1 38 VAL HA 5.730 . 6.230 4.191 4.047 4.350 . 0 0 "[ . 1 . ]" 1
678 1 37 ALA MB 1 39 TRP H 5.970 . 6.470 4.877 4.705 5.121 . 0 0 "[ . 1 . ]" 1
679 1 37 ALA MB 1 41 ASN H 5.740 . 6.240 4.883 4.655 5.092 . 0 0 "[ . 1 . ]" 1
680 1 37 ALA MB 1 42 LEU CG 7.420 . 7.920 4.655 4.411 4.955 . 0 0 "[ . 1 . ]" 1
681 1 37 ALA MB 1 42 LEU H 4.500 . 5.000 3.359 2.887 3.653 . 0 0 "[ . 1 . ]" 1
682 1 37 ALA MB 1 43 THR H 4.170 . 4.670 3.411 3.140 3.686 . 0 0 "[ . 1 . ]" 1
683 1 37 ALA MB 1 43 THR HA 5.130 . 5.630 2.404 2.176 2.659 . 0 0 "[ . 1 . ]" 1
684 1 37 ALA MB 1 44 GLU H 5.630 . 6.130 3.121 2.915 3.341 . 0 0 "[ . 1 . ]" 1
685 1 37 ALA MB 1 44 GLU HA 4.720 . 5.220 2.804 2.501 3.270 . 0 0 "[ . 1 . ]" 1
686 1 37 ALA MB 1 44 GLU QB 6.440 . 6.940 3.515 3.192 3.978 . 0 0 "[ . 1 . ]" 1
687 1 37 ALA MB 1 46 ARG H 6.170 . 6.670 4.906 4.685 5.143 . 0 0 "[ . 1 . ]" 1
688 1 37 ALA MB 1 46 ARG QB 4.710 . 5.210 4.461 4.144 4.851 . 0 0 "[ . 1 . ]" 1
689 1 37 ALA MB 1 47 VAL H 5.080 . 5.580 4.078 3.802 4.398 . 0 0 "[ . 1 . ]" 1
690 1 37 ALA MB 1 47 VAL MG2 4.670 . 5.170 2.310 2.142 2.695 . 0 0 "[ . 1 . ]" 1
691 1 38 VAL H 1 38 VAL HB 3.250 . 3.750 2.533 2.312 2.727 . 0 0 "[ . 1 . ]" 1
692 1 38 VAL H 1 38 VAL MG2 3.700 . 4.200 2.417 2.180 2.580 . 0 0 "[ . 1 . ]" 1
693 1 38 VAL H 1 39 TRP H 3.550 . 4.050 2.647 2.477 2.836 . 0 0 "[ . 1 . ]" 1
694 1 38 VAL H 1 39 TRP HA 5.440 . 5.940 5.278 5.085 5.441 . 0 0 "[ . 1 . ]" 1
695 1 38 VAL H 1 39 TRP HB2 5.500 . 6.000 5.038 4.803 5.246 . 0 0 "[ . 1 . ]" 1
696 1 38 VAL H 1 42 LEU H 5.500 . 6.000 5.067 4.773 5.426 . 0 0 "[ . 1 . ]" 1
697 1 38 VAL HA 1 39 TRP HA 5.200 . 5.700 4.797 4.723 4.837 . 0 0 "[ . 1 . ]" 1
698 1 38 VAL HA 1 40 THR H 5.500 . 6.000 4.412 4.037 4.753 . 0 0 "[ . 1 . ]" 1
699 1 38 VAL HA 1 41 ASN H 4.170 . 4.670 3.598 3.360 3.781 . 0 0 "[ . 1 . ]" 1
700 1 38 VAL HA 1 42 LEU H 5.130 . 5.630 4.607 4.099 5.070 . 0 0 "[ . 1 . ]" 1
701 1 38 VAL HB 1 39 TRP H 3.400 . 3.900 2.614 2.375 2.869 . 0 0 "[ . 1 . ]" 1
702 1 38 VAL HB 1 39 TRP HE1 4.770 . 5.270 5.446 4.802 5.903 0.633 12 4 "[ - . * + .* ]" 1
703 1 38 VAL MG1 1 39 TRP H 4.380 . 4.880 3.361 3.138 3.559 . 0 0 "[ . 1 . ]" 1
704 1 38 VAL MG1 1 39 TRP HA 4.950 . 5.450 3.417 3.164 3.610 . 0 0 "[ . 1 . ]" 1
705 1 38 VAL MG1 1 39 TRP HE1 6.610 . 7.110 6.003 5.560 6.351 . 0 0 "[ . 1 . ]" 1
706 1 38 VAL MG1 1 41 ASN H 5.740 . 6.240 4.713 4.523 4.961 . 0 0 "[ . 1 . ]" 1
707 1 38 VAL MG2 1 39 TRP H 4.850 . 5.350 3.948 3.727 4.148 . 0 0 "[ . 1 . ]" 1
708 1 39 TRP H 1 39 TRP HB2 3.530 . 4.030 2.735 2.664 2.925 . 0 0 "[ . 1 . ]" 1
709 1 39 TRP H 1 39 TRP HB3 3.620 . 4.120 3.595 3.536 3.627 . 0 0 "[ . 1 . ]" 1
710 1 39 TRP H 1 39 TRP HD1 4.320 . 4.820 3.862 3.556 4.107 . 0 0 "[ . 1 . ]" 1
711 1 39 TRP H 1 39 TRP HE1 5.040 . 5.540 4.796 4.321 5.056 . 0 0 "[ . 1 . ]" 1
712 1 39 TRP H 1 39 TRP HE3 4.900 . 5.400 3.402 3.084 3.720 . 0 0 "[ . 1 . ]" 1
713 1 39 TRP H 1 40 THR HA 5.320 . 5.820 5.484 5.405 5.553 . 0 0 "[ . 1 . ]" 1
714 1 39 TRP HA 1 39 TRP HD1 4.880 . 5.380 4.858 4.791 4.886 . 0 0 "[ . 1 . ]" 1
715 1 39 TRP HA 1 39 TRP HE3 4.320 . 4.820 2.237 2.161 2.356 . 0 0 "[ . 1 . ]" 1
716 1 39 TRP HA 1 40 THR MG 6.520 . 7.020 4.673 4.424 4.850 . 0 0 "[ . 1 . ]" 1
717 1 39 TRP HB2 1 39 TRP HE1 4.720 . 5.220 4.705 4.675 4.745 . 0 0 "[ . 1 . ]" 1
718 1 39 TRP HB2 1 40 THR H 3.510 . 4.010 2.798 2.502 3.216 . 0 0 "[ . 1 . ]" 1
719 1 39 TRP HB2 1 41 ASN H 4.570 . 5.070 5.003 4.762 5.195 0.125 15 0 "[ . 1 . ]" 1
720 1 39 TRP HB3 1 39 TRP HE1 5.280 . 5.780 5.052 4.946 5.148 . 0 0 "[ . 1 . ]" 1
721 1 39 TRP HB3 1 40 THR H 4.040 . 4.540 3.943 3.730 4.222 . 0 0 "[ . 1 . ]" 1
722 1 39 TRP HB3 1 40 THR MG 5.270 . 5.770 3.833 3.573 4.204 . 0 0 "[ . 1 . ]" 1
723 1 39 TRP HB3 1 41 ASN H 5.500 . 6.000 5.651 5.488 5.827 . 0 0 "[ . 1 . ]" 1
724 1 39 TRP HD1 1 40 THR MG 5.140 . 5.640 4.310 3.859 4.646 . 0 0 "[ . 1 . ]" 1
725 1 39 TRP HE1 1 40 THR MG 6.610 . 7.110 6.432 5.893 6.808 . 0 0 "[ . 1 . ]" 1
726 1 40 THR H 1 40 THR HG1 3.510 . 4.010 2.094 2.006 2.218 . 0 0 "[ . 1 . ]" 1
727 1 40 THR H 1 40 THR MG 4.230 . 4.730 2.593 2.400 2.845 . 0 0 "[ . 1 . ]" 1
728 1 40 THR H 1 41 ASN HA 4.910 . 5.410 4.537 4.158 4.787 . 0 0 "[ . 1 . ]" 1
729 1 40 THR H 1 41 ASN HB2 5.270 . 5.770 5.335 5.086 5.542 . 0 0 "[ . 1 . ]" 1
730 1 40 THR H 1 42 LEU CG 6.570 . 7.070 6.172 5.703 6.462 . 0 0 "[ . 1 . ]" 1
731 1 40 THR H 1 42 LEU H 3.820 . 4.320 3.746 3.384 4.201 . 0 0 "[ . 1 . ]" 1
732 1 40 THR HB 1 42 LEU CG 6.460 . 6.960 4.161 3.200 4.633 . 0 0 "[ . 1 . ]" 1
733 1 40 THR HG1 1 41 ASN H 4.150 . 4.650 3.747 3.588 3.971 . 0 0 "[ . 1 . ]" 1
734 1 40 THR HG1 1 42 LEU H 4.270 . 4.770 3.494 3.060 3.899 . 0 0 "[ . 1 . ]" 1
735 1 40 THR MG 1 41 ASN H 4.830 . 5.330 4.301 4.243 4.350 . 0 0 "[ . 1 . ]" 1
736 1 40 THR MG 1 42 LEU HB2 4.890 . 5.390 4.323 4.088 4.562 . 0 0 "[ . 1 . ]" 1
737 1 41 ASN H 1 41 ASN HA 2.820 . 3.320 2.210 2.161 2.251 . 0 0 "[ . 1 . ]" 1
738 1 41 ASN H 1 41 ASN HB2 3.760 . 4.260 3.050 2.928 3.235 . 0 0 "[ . 1 . ]" 1
739 1 41 ASN H 1 41 ASN HB3 4.000 . 4.500 3.731 3.606 3.919 . 0 0 "[ . 1 . ]" 1
740 1 41 ASN H 1 42 LEU CG 6.700 . 7.200 5.946 5.299 6.187 . 0 0 "[ . 1 . ]" 1
741 1 41 ASN H 1 42 LEU H 3.270 . 3.770 2.731 2.523 2.925 . 0 0 "[ . 1 . ]" 1
742 1 41 ASN H 1 42 LEU HA 5.300 . 5.800 5.441 5.269 5.564 . 0 0 "[ . 1 . ]" 1
743 1 41 ASN H 1 42 LEU HB2 5.070 . 5.570 4.592 4.378 4.973 . 0 0 "[ . 1 . ]" 1
744 1 41 ASN HA 1 41 ASN HD22 4.950 . 5.450 4.508 3.952 4.699 . 0 0 "[ . 1 . ]" 1
745 1 41 ASN HA 1 42 LEU H 3.370 . 3.870 2.735 2.490 3.112 . 0 0 "[ . 1 . ]" 1
746 1 41 ASN HB2 1 42 LEU H 4.310 . 4.810 4.599 4.486 4.656 . 0 0 "[ . 1 . ]" 1
747 1 41 ASN HB3 1 41 ASN HD22 4.100 . 4.600 3.574 3.480 3.704 . 0 0 "[ . 1 . ]" 1
748 1 41 ASN HB3 1 42 LEU H 3.980 . 4.480 4.313 4.027 4.487 0.007 7 0 "[ . 1 . ]" 1
749 1 42 LEU CG 1 43 THR H 5.860 . 6.360 3.553 3.298 3.911 . 0 0 "[ . 1 . ]" 1
750 1 42 LEU CG 1 46 ARG QB 6.670 . 7.170 3.264 2.865 4.463 . 0 0 "[ . 1 . ]" 1
751 1 42 LEU CG 1 47 VAL H 6.940 . 7.440 5.190 4.605 6.521 . 0 0 "[ . 1 . ]" 1
752 1 42 LEU CG 1 47 VAL MG2 6.210 . 6.710 3.812 3.477 4.592 . 0 0 "[ . 1 . ]" 1
753 1 42 LEU H 1 42 LEU HB2 3.510 . 4.010 2.290 2.117 2.581 . 0 0 "[ . 1 . ]" 1
754 1 42 LEU H 1 42 LEU HB3 3.560 . 4.060 3.475 3.360 3.750 . 0 0 "[ . 1 . ]" 1
755 1 42 LEU H 1 42 LEU MD1 4.840 . 5.340 3.185 2.659 4.192 . 0 0 "[ . 1 . ]" 1
756 1 42 LEU H 1 42 LEU MD2 4.840 . 5.340 4.086 3.754 4.387 . 0 0 "[ . 1 . ]" 1
757 1 42 LEU H 1 42 LEU HG 4.220 . 4.720 4.169 2.679 4.637 . 0 0 "[ . 1 . ]" 1
758 1 42 LEU H 1 43 THR H 4.450 . 4.950 4.404 4.252 4.554 . 0 0 "[ . 1 . ]" 1
759 1 42 LEU HA 1 42 LEU HG 3.590 . 4.090 2.598 2.411 3.165 . 0 0 "[ . 1 . ]" 1
760 1 42 LEU HA 1 43 THR H 3.380 . 3.880 2.683 2.487 2.911 . 0 0 "[ . 1 . ]" 1
761 1 42 LEU HB2 1 43 THR H 3.790 . 4.290 3.483 2.829 3.766 . 0 0 "[ . 1 . ]" 1
762 1 42 LEU HB2 1 47 VAL MG2 4.560 . 5.060 3.028 2.651 3.571 . 0 0 "[ . 1 . ]" 1
763 1 42 LEU HB3 1 43 THR H 3.320 . 3.820 2.068 1.873 2.338 . 0 0 "[ . 1 . ]" 1
764 1 42 LEU HB3 1 47 VAL H 4.560 . 5.060 3.805 3.293 4.845 . 0 0 "[ . 1 . ]" 1
765 1 42 LEU MD1 1 43 THR H 5.130 . 5.630 4.148 3.873 4.327 . 0 0 "[ . 1 . ]" 1
766 1 42 LEU MD2 1 43 THR H 5.130 . 5.630 3.676 3.207 3.954 . 0 0 "[ . 1 . ]" 1
767 1 42 LEU HG 1 43 THR H 3.670 . 4.170 3.413 2.873 4.693 0.523 11 1 "[ . 1+ . ]" 1
768 1 42 LEU HG 1 46 ARG QB 4.260 . 4.760 2.960 2.260 5.439 0.679 10 2 "[ - . + . ]" 1
769 1 43 THR H 1 46 ARG H 4.460 . 4.960 3.564 3.121 4.179 . 0 0 "[ . 1 . ]" 1
770 1 43 THR H 1 46 ARG HA 5.500 . 6.000 5.234 4.703 6.044 0.044 10 0 "[ . 1 . ]" 1
771 1 43 THR H 1 46 ARG QB 3.940 . 4.440 2.393 1.910 3.197 . 0 0 "[ . 1 . ]" 1
772 1 43 THR H 1 46 ARG HD2 5.500 . 6.000 5.334 4.714 5.853 . 0 0 "[ . 1 . ]" 1
773 1 43 THR H 1 46 ARG QD 5.330 . 5.830 4.703 4.116 5.205 . 0 0 "[ . 1 . ]" 1
774 1 43 THR H 1 46 ARG HD3 5.500 . 6.000 5.239 4.537 5.831 . 0 0 "[ . 1 . ]" 1
775 1 43 THR H 1 46 ARG HG2 4.550 . 5.050 3.057 2.352 3.910 . 0 0 "[ . 1 . ]" 1
776 1 43 THR H 1 46 ARG HG3 3.890 . 4.390 3.119 2.576 3.851 . 0 0 "[ . 1 . ]" 1
777 1 43 THR H 1 47 VAL H 4.160 . 4.660 4.134 3.702 4.698 0.038 11 0 "[ . 1 . ]" 1
778 1 43 THR H 1 47 VAL HB 5.500 . 6.000 5.970 5.517 6.656 0.656 11 1 "[ . 1+ . ]" 1
779 1 43 THR HA 1 44 GLU H 3.290 . 3.790 2.371 2.210 2.504 . 0 0 "[ . 1 . ]" 1
780 1 43 THR HA 1 44 GLU QB 5.850 . 6.350 4.180 4.036 4.322 . 0 0 "[ . 1 . ]" 1
781 1 43 THR HB 1 45 ALA H 3.370 . 3.870 3.373 2.725 3.755 . 0 0 "[ . 1 . ]" 1
782 1 43 THR HB 1 46 ARG H 4.290 . 4.790 4.036 3.254 4.607 . 0 0 "[ . 1 . ]" 1
783 1 43 THR MG 1 44 GLU H 4.410 . 4.910 3.604 2.326 4.073 . 0 0 "[ . 1 . ]" 1
784 1 43 THR MG 1 45 ALA H 4.760 . 5.260 4.576 2.897 4.984 . 0 0 "[ . 1 . ]" 1
785 1 43 THR MG 1 46 ARG H 5.610 . 6.110 4.604 3.898 5.238 . 0 0 "[ . 1 . ]" 1
786 1 43 THR MG 1 46 ARG HG2 5.500 . 6.000 3.846 2.576 4.618 . 0 0 "[ . 1 . ]" 1
787 1 44 GLU H 1 44 GLU HB2 3.700 . 4.200 2.514 2.335 3.632 . 0 0 "[ . 1 . ]" 1
788 1 44 GLU H 1 44 GLU QB 3.610 . 4.110 2.183 2.051 2.380 . 0 0 "[ . 1 . ]" 1
789 1 44 GLU H 1 44 GLU HB3 3.700 . 4.200 2.454 2.157 2.612 . 0 0 "[ . 1 . ]" 1
790 1 44 GLU H 1 44 GLU HG2 4.640 . 5.140 4.395 3.798 4.497 . 0 0 "[ . 1 . ]" 1
791 1 44 GLU H 1 44 GLU HG3 4.640 . 5.140 4.424 2.673 4.603 . 0 0 "[ . 1 . ]" 1
792 1 44 GLU H 1 45 ALA H 3.820 . 4.320 3.049 2.839 3.335 . 0 0 "[ . 1 . ]" 1
793 1 44 GLU H 1 45 ALA MB 5.700 . 6.200 4.631 4.400 5.001 . 0 0 "[ . 1 . ]" 1
794 1 44 GLU H 1 46 ARG H 4.370 . 4.870 4.431 4.290 4.541 . 0 0 "[ . 1 . ]" 1
795 1 44 GLU HA 1 44 GLU HG2 4.200 . 4.700 2.657 2.419 4.258 . 0 0 "[ . 1 . ]" 1
796 1 44 GLU HA 1 44 GLU HG3 4.200 . 4.700 3.679 3.546 3.835 . 0 0 "[ . 1 . ]" 1
797 1 44 GLU HA 1 46 ARG H 4.920 . 5.420 4.356 4.052 4.632 . 0 0 "[ . 1 . ]" 1
798 1 44 GLU HA 1 47 VAL H 3.760 . 4.260 3.537 3.086 3.841 . 0 0 "[ . 1 . ]" 1
799 1 44 GLU HA 1 47 VAL HB 4.730 . 5.230 2.983 2.683 3.499 . 0 0 "[ . 1 . ]" 1
800 1 44 GLU HA 1 47 VAL MG1 5.360 . 5.860 4.303 4.044 4.706 . 0 0 "[ . 1 . ]" 1
801 1 44 GLU HA 1 47 VAL MG2 4.890 . 5.390 3.138 2.594 3.457 . 0 0 "[ . 1 . ]" 1
802 1 44 GLU HA 1 48 ARG H 4.390 . 4.890 4.228 3.986 4.887 . 0 0 "[ . 1 . ]" 1
803 1 44 GLU QB 1 45 ALA H 3.770 . 4.270 2.689 2.445 3.673 . 0 0 "[ . 1 . ]" 1
804 1 44 GLU HB2 1 45 ALA H 4.090 . 4.590 3.995 3.860 4.242 . 0 0 "[ . 1 . ]" 1
805 1 44 GLU HB3 1 45 ALA H 4.090 . 4.590 2.749 2.473 4.065 . 0 0 "[ . 1 . ]" 1
806 1 44 GLU QG 1 45 ALA H 4.210 . 4.710 4.032 2.677 4.246 . 0 0 "[ . 1 . ]" 1
807 1 44 GLU QG 1 45 ALA HA 4.830 . 5.330 4.532 4.291 4.736 . 0 0 "[ . 1 . ]" 1
808 1 44 GLU HG2 1 45 ALA H 4.600 . 5.100 4.450 4.271 4.614 . 0 0 "[ . 1 . ]" 1
809 1 44 GLU HG3 1 45 ALA H 4.600 . 5.100 4.710 2.705 5.069 . 0 0 "[ . 1 . ]" 1
810 1 45 ALA H 1 46 ARG H 3.630 . 4.130 2.836 2.665 2.953 . 0 0 "[ . 1 . ]" 1
811 1 45 ALA H 1 46 ARG QB 5.490 . 5.990 4.999 4.784 5.172 . 0 0 "[ . 1 . ]" 1
812 1 45 ALA H 1 47 VAL H 4.600 . 5.100 4.332 4.229 4.567 . 0 0 "[ . 1 . ]" 1
813 1 45 ALA H 1 48 ARG QB 6.010 . 6.510 4.663 4.403 5.563 . 0 0 "[ . 1 . ]" 1
814 1 45 ALA HA 1 48 ARG H 4.000 . 4.500 3.307 2.922 3.536 . 0 0 "[ . 1 . ]" 1
815 1 45 ALA HA 1 48 ARG QB 5.020 . 5.520 2.468 2.117 2.983 . 0 0 "[ . 1 . ]" 1
816 1 45 ALA HA 1 49 VAL CB 6.560 . 7.060 5.972 5.673 6.391 . 0 0 "[ . 1 . ]" 1
817 1 45 ALA MB 1 46 ARG H 4.100 . 4.600 2.738 2.502 3.036 . 0 0 "[ . 1 . ]" 1
818 1 45 ALA MB 1 46 ARG HE 6.590 . 7.090 4.975 2.754 6.367 . 0 0 "[ . 1 . ]" 1
819 1 45 ALA MB 1 46 ARG HG2 4.800 . 5.300 3.605 3.221 4.386 . 0 0 "[ . 1 . ]" 1
820 1 45 ALA MB 1 47 VAL H 6.120 . 6.620 4.626 4.474 4.807 . 0 0 "[ . 1 . ]" 1
821 1 45 ALA MB 1 49 VAL H 6.230 . 6.730 4.509 4.275 5.009 . 0 0 "[ . 1 . ]" 1
822 1 46 ARG H 1 46 ARG QB 3.230 . 3.730 2.541 2.351 2.690 . 0 0 "[ . 1 . ]" 1
823 1 46 ARG H 1 46 ARG HD2 4.200 . 4.700 3.910 2.920 4.740 0.040 9 0 "[ . 1 . ]" 1
824 1 46 ARG H 1 46 ARG QD 4.110 . 4.610 3.396 2.835 3.871 . 0 0 "[ . 1 . ]" 1
825 1 46 ARG H 1 46 ARG HD3 4.200 . 4.700 4.031 3.098 4.716 0.016 14 0 "[ . 1 . ]" 1
826 1 46 ARG H 1 46 ARG HG2 3.360 . 3.860 2.335 2.094 2.841 . 0 0 "[ . 1 . ]" 1
827 1 46 ARG H 1 46 ARG HG3 3.680 . 4.180 3.756 3.580 4.140 . 0 0 "[ . 1 . ]" 1
828 1 46 ARG H 1 47 VAL H 3.510 . 4.010 2.620 2.372 2.829 . 0 0 "[ . 1 . ]" 1
829 1 46 ARG H 1 47 VAL HA 5.490 . 5.990 5.328 5.137 5.477 . 0 0 "[ . 1 . ]" 1
830 1 46 ARG H 1 47 VAL HB 4.880 . 5.380 4.850 4.493 5.163 . 0 0 "[ . 1 . ]" 1
831 1 46 ARG H 1 47 VAL MG2 5.570 . 6.070 4.178 4.019 4.370 . 0 0 "[ . 1 . ]" 1
832 1 46 ARG H 1 48 ARG H 4.670 . 5.170 4.089 3.661 4.504 . 0 0 "[ . 1 . ]" 1
833 1 46 ARG HA 1 46 ARG QD 4.550 . 5.050 2.287 2.127 3.033 . 0 0 "[ . 1 . ]" 1
834 1 46 ARG HA 1 46 ARG HE 4.450 . 4.950 3.944 2.484 4.733 . 0 0 "[ . 1 . ]" 1
835 1 46 ARG HA 1 46 ARG HG2 3.680 . 4.180 3.301 2.990 3.553 . 0 0 "[ . 1 . ]" 1
836 1 46 ARG HA 1 46 ARG HG3 4.190 . 4.690 3.815 3.703 3.901 . 0 0 "[ . 1 . ]" 1
837 1 46 ARG HA 1 49 VAL CB 6.710 . 7.210 3.691 3.082 4.306 . 0 0 "[ . 1 . ]" 1
838 1 46 ARG HA 1 49 VAL H 4.180 . 4.680 3.395 3.018 3.621 . 0 0 "[ . 1 . ]" 1
839 1 46 ARG HA 1 50 TRP H 4.530 . 5.030 4.054 3.804 4.334 . 0 0 "[ . 1 . ]" 1
840 1 46 ARG QB 1 47 VAL H 3.750 . 4.250 2.725 2.592 3.081 . 0 0 "[ . 1 . ]" 1
841 1 46 ARG QB 1 47 VAL MG2 5.390 . 5.890 3.348 3.167 3.573 . 0 0 "[ . 1 . ]" 1
842 1 46 ARG QB 1 49 VAL CB 7.080 . 7.580 5.365 4.684 6.005 . 0 0 "[ . 1 . ]" 1
843 1 46 ARG QB 1 50 TRP H 5.240 . 5.740 4.758 4.407 5.097 . 0 0 "[ . 1 . ]" 1
844 1 46 ARG QD 1 47 VAL H 5.560 . 6.060 4.974 4.734 5.151 . 0 0 "[ . 1 . ]" 1
845 1 46 ARG QD 1 49 VAL CB 6.790 . 7.290 4.841 3.705 5.838 . 0 0 "[ . 1 . ]" 1
846 1 46 ARG HE 1 46 ARG HG2 3.760 . 4.260 3.392 2.234 4.137 . 0 0 "[ . 1 . ]" 1
847 1 46 ARG HG2 1 47 VAL H 4.730 . 5.230 4.348 4.021 4.756 . 0 0 "[ . 1 . ]" 1
848 1 46 ARG HG3 1 47 VAL H 5.420 . 5.920 5.080 4.838 5.440 . 0 0 "[ . 1 . ]" 1
849 1 47 VAL H 1 47 VAL HB 3.300 . 3.800 2.540 2.439 2.656 . 0 0 "[ . 1 . ]" 1
850 1 47 VAL H 1 47 VAL MG2 3.950 . 4.450 2.236 2.162 2.329 . 0 0 "[ . 1 . ]" 1
851 1 47 VAL H 1 48 ARG H 3.660 . 4.160 2.661 2.568 2.849 . 0 0 "[ . 1 . ]" 1
852 1 47 VAL H 1 50 TRP H 5.240 . 5.740 4.787 4.577 5.043 . 0 0 "[ . 1 . ]" 1
853 1 47 VAL HA 1 50 TRP H 4.070 . 4.570 3.440 3.203 3.638 . 0 0 "[ . 1 . ]" 1
854 1 47 VAL HA 1 50 TRP QB 5.160 . 5.660 2.753 2.538 3.034 . 0 0 "[ . 1 . ]" 1
855 1 47 VAL HB 1 48 ARG H 3.700 . 4.200 2.666 2.555 2.793 . 0 0 "[ . 1 . ]" 1
856 1 47 VAL MG1 1 48 ARG H 4.660 . 5.160 3.498 3.396 3.726 . 0 0 "[ . 1 . ]" 1
857 1 47 VAL MG1 1 48 ARG QG 6.470 . 6.970 4.890 3.932 5.196 . 0 0 "[ . 1 . ]" 1
858 1 47 VAL MG1 1 51 PHE H 5.220 . 5.720 4.058 3.895 4.296 . 0 0 "[ . 1 . ]" 1
859 1 47 VAL MG1 1 51 PHE QD 5.470 . 5.970 2.525 2.307 3.057 . 0 0 "[ . 1 . ]" 1
860 1 47 VAL MG1 1 51 PHE QE 5.240 . 5.740 2.675 2.237 3.078 . 0 0 "[ . 1 . ]" 1
861 1 47 VAL MG2 1 48 ARG H 4.940 . 5.440 3.924 3.859 4.043 . 0 0 "[ . 1 . ]" 1
862 1 48 ARG H 1 48 ARG HB2 3.460 . 3.960 2.249 2.110 2.561 . 0 0 "[ . 1 . ]" 1
863 1 48 ARG H 1 48 ARG HB3 3.460 . 3.960 2.894 2.704 3.633 . 0 0 "[ . 1 . ]" 1
864 1 48 ARG H 1 48 ARG QD 5.680 . 6.180 4.783 3.725 4.946 . 0 0 "[ . 1 . ]" 1
865 1 48 ARG H 1 48 ARG QG 4.290 . 4.790 3.693 2.200 3.915 . 0 0 "[ . 1 . ]" 1
866 1 48 ARG H 1 49 VAL H 3.850 . 4.350 2.862 2.726 2.963 . 0 0 "[ . 1 . ]" 1
867 1 48 ARG H 1 50 TRP H 4.560 . 5.060 4.330 4.154 4.558 . 0 0 "[ . 1 . ]" 1
868 1 48 ARG HA 1 48 ARG HE 4.630 . 5.130 4.564 4.198 5.186 0.056 11 0 "[ . 1 . ]" 1
869 1 48 ARG HA 1 48 ARG HG2 3.900 . 4.400 2.645 2.422 2.766 . 0 0 "[ . 1 . ]" 1
870 1 48 ARG HA 1 48 ARG QG 3.780 . 4.280 2.361 2.282 2.516 . 0 0 "[ . 1 . ]" 1
871 1 48 ARG HA 1 48 ARG HG3 3.900 . 4.400 2.676 2.561 3.132 . 0 0 "[ . 1 . ]" 1
872 1 48 ARG HA 1 51 PHE H 3.780 . 4.280 3.613 3.375 4.038 . 0 0 "[ . 1 . ]" 1
873 1 48 ARG QB 1 48 ARG HE 3.280 . 3.780 2.252 2.085 3.208 . 0 0 "[ . 1 . ]" 1
874 1 48 ARG QB 1 49 VAL CB 7.830 . 8.330 4.547 4.297 4.776 . 0 0 "[ . 1 . ]" 1
875 1 48 ARG QB 1 49 VAL H 4.070 . 4.570 2.501 2.315 2.994 . 0 0 "[ . 1 . ]" 1
876 1 48 ARG QB 1 50 TRP H 5.690 . 6.190 4.845 4.678 5.125 . 0 0 "[ . 1 . ]" 1
877 1 48 ARG HB2 1 48 ARG HE 3.360 . 3.860 2.382 2.143 3.456 . 0 0 "[ . 1 . ]" 1
878 1 48 ARG HB3 1 48 ARG HE 3.360 . 3.860 3.026 2.339 4.282 0.422 11 0 "[ . 1 . ]" 1
879 1 48 ARG QD 1 49 VAL CB 8.310 . 8.810 6.056 5.531 7.236 . 0 0 "[ . 1 . ]" 1
880 1 48 ARG QD 1 49 VAL H 5.430 . 5.930 4.610 4.352 5.210 . 0 0 "[ . 1 . ]" 1
881 1 48 ARG QD 3 2 DG H1' 6.730 . 7.230 5.159 4.583 6.709 . 0 0 "[ . 1 . ]" 1
882 1 48 ARG QD 3 2 DG H3' 6.730 . 7.230 3.691 2.618 6.487 . 0 0 "[ . 1 . ]" 1
883 1 48 ARG QD 3 2 DG H8 6.730 . 7.230 4.324 3.217 6.258 . 0 0 "[ . 1 . ]" 1
884 1 48 ARG QD 3 3 DG H8 6.730 . 7.230 5.085 4.600 5.562 . 0 0 "[ . 1 . ]" 1
885 1 48 ARG HE 1 48 ARG HG2 3.720 . 4.220 3.643 2.535 3.771 . 0 0 "[ . 1 . ]" 1
886 1 48 ARG HE 1 48 ARG QG 3.640 . 4.140 2.685 2.443 2.949 . 0 0 "[ . 1 . ]" 1
887 1 48 ARG HE 1 48 ARG HG3 3.720 . 4.220 2.824 2.480 3.646 . 0 0 "[ . 1 . ]" 1
888 1 48 ARG QG 1 49 VAL H 5.880 . 6.380 4.042 3.925 4.443 . 0 0 "[ . 1 . ]" 1
889 1 48 ARG HG2 3 3 DG H8 6.000 . 6.500 5.436 4.933 6.191 . 0 0 "[ . 1 . ]" 1
890 1 48 ARG HG3 3 3 DG H8 6.000 . 6.500 6.111 5.402 7.096 0.596 11 1 "[ . 1+ . ]" 1
891 1 49 VAL CB 1 50 TRP H 5.760 . 6.260 3.195 3.049 3.511 . 0 0 "[ . 1 . ]" 1
892 1 49 VAL CB 1 53 ASN QB 6.400 . 6.900 5.307 4.249 5.594 . 0 0 "[ . 1 . ]" 1
893 1 49 VAL CB 1 53 ASN HD21 5.930 . 6.430 4.565 3.674 6.763 0.333 13 0 "[ . 1 . ]" 1
894 1 49 VAL CB 1 53 ASN HD22 6.800 . 7.300 5.069 4.290 7.682 0.382 10 0 "[ . 1 . ]" 1
895 1 49 VAL H 1 49 VAL HB 3.100 . 3.600 2.640 2.259 3.736 0.136 1 0 "[ . 1 . ]" 1
896 1 49 VAL H 1 50 TRP H 3.780 . 4.280 2.845 2.551 2.993 . 0 0 "[ . 1 . ]" 1
897 1 49 VAL H 1 51 PHE H 5.140 . 5.640 4.337 4.186 4.468 . 0 0 "[ . 1 . ]" 1
898 1 49 VAL H 1 52 LYS QD 6.010 . 6.510 4.851 4.170 5.699 . 0 0 "[ . 1 . ]" 1
899 1 49 VAL H 1 52 LYS QG 6.010 . 6.510 4.543 4.290 4.956 . 0 0 "[ . 1 . ]" 1
900 1 49 VAL HA 1 52 LYS H 3.610 . 4.110 3.589 3.172 3.857 . 0 0 "[ . 1 . ]" 1
901 1 49 VAL HA 1 52 LYS HB3 4.940 . 5.440 4.395 3.326 4.828 . 0 0 "[ . 1 . ]" 1
902 1 49 VAL HA 1 52 LYS QD 4.960 . 5.460 2.789 2.443 3.220 . 0 0 "[ . 1 . ]" 1
903 1 49 VAL HA 1 52 LYS QG 4.520 . 5.020 2.217 2.056 2.393 . 0 0 "[ . 1 . ]" 1
904 1 49 VAL HA 1 53 ASN H 4.050 . 4.550 3.921 3.615 4.391 . 0 0 "[ . 1 . ]" 1
905 1 49 VAL HA 2 6 DA H8 7.300 . 7.500 7.778 7.241 8.554 1.054 10 5 "[* . * + * - ]" 1
906 1 49 VAL HA 2 7 DA H8 6.000 . 6.500 5.337 4.352 6.135 . 0 0 "[ . 1 . ]" 1
907 1 49 VAL HA 2 8 DT H6 6.500 . 7.000 6.656 6.252 7.095 0.095 4 0 "[ . 1 . ]" 1
908 1 49 VAL HA 2 8 DT M7 6.730 . 7.230 3.334 2.895 3.718 . 0 0 "[ . 1 . ]" 1
909 1 49 VAL HB 1 50 TRP H 3.990 . 4.490 2.980 2.604 4.117 . 0 0 "[ . 1 . ]" 1
910 1 49 VAL HB 2 7 DA H8 6.000 . 6.500 4.568 2.787 5.627 . 0 0 "[ . 1 . ]" 1
911 1 49 VAL QG 2 6 DA H1' 8.300 . 8.800 4.745 3.958 5.484 . 0 0 "[ . 1 . ]" 1
912 1 49 VAL QG 2 6 DA H3' 8.300 . 8.800 4.030 3.272 4.908 . 0 0 "[ . 1 . ]" 1
913 1 49 VAL QG 2 6 DA H8 8.300 . 8.800 4.748 4.183 5.796 . 0 0 "[ . 1 . ]" 1
914 1 49 VAL QG 2 7 DA H1' 8.300 . 8.800 4.608 4.423 4.886 . 0 0 "[ . 1 . ]" 1
915 1 49 VAL QG 2 7 DA H2'' 8.300 . 8.800 3.449 2.828 4.015 . 0 0 "[ . 1 . ]" 1
916 1 49 VAL QG 2 7 DA H3' 8.300 . 8.800 3.575 2.695 4.102 . 0 0 "[ . 1 . ]" 1
917 1 49 VAL QG 2 7 DA H4' 8.300 . 8.800 5.195 4.427 5.690 . 0 0 "[ . 1 . ]" 1
918 1 49 VAL QG 2 7 DA H8 8.300 . 8.800 2.395 1.968 3.110 . 0 0 "[ . 1 . ]" 1
919 1 49 VAL QG 2 8 DT H6 8.300 . 8.800 3.824 3.507 4.144 . 0 0 "[ . 1 . ]" 1
920 1 49 VAL QG 2 8 DT H1' 8.300 . 8.800 6.557 6.185 6.828 . 0 0 "[ . 1 . ]" 1
921 1 49 VAL MG1 1 50 TRP H 4.900 . 5.400 3.427 2.963 4.178 . 0 0 "[ . 1 . ]" 1
922 1 49 VAL MG2 1 50 TRP H 4.900 . 5.400 3.803 2.398 4.259 . 0 0 "[ . 1 . ]" 1
923 1 50 TRP H 1 50 TRP QB 3.630 . 4.130 2.256 2.220 2.293 . 0 0 "[ . 1 . ]" 1
924 1 50 TRP H 1 50 TRP HD1 5.270 . 5.770 4.835 4.656 5.026 . 0 0 "[ . 1 . ]" 1
925 1 50 TRP H 1 50 TRP HE3 4.960 . 5.460 4.986 4.807 5.139 . 0 0 "[ . 1 . ]" 1
926 1 50 TRP H 1 51 PHE H 3.890 . 4.390 2.833 2.752 2.906 . 0 0 "[ . 1 . ]" 1
927 1 50 TRP H 1 51 PHE QD 5.110 . 5.610 4.666 4.157 4.872 . 0 0 "[ . 1 . ]" 1
928 1 50 TRP H 1 52 LYS H 5.170 . 5.670 4.548 4.307 4.696 . 0 0 "[ . 1 . ]" 1
929 1 50 TRP H 1 53 ASN QB 5.560 . 6.060 4.981 4.639 5.265 . 0 0 "[ . 1 . ]" 1
930 1 50 TRP QB 1 51 PHE H 4.560 . 5.060 2.613 2.463 2.767 . 0 0 "[ . 1 . ]" 1
931 1 50 TRP HE3 1 51 PHE H 3.990 . 4.490 3.205 2.981 3.532 . 0 0 "[ . 1 . ]" 1
932 1 50 TRP HE3 1 51 PHE HA 4.280 . 4.780 2.669 2.492 2.902 . 0 0 "[ . 1 . ]" 1
933 1 50 TRP HE3 1 54 ARG H 4.580 . 5.080 4.920 4.618 5.326 0.246 16 0 "[ . 1 . ]" 1
934 1 50 TRP HE3 1 54 ARG HE 4.330 . 4.830 4.349 3.273 6.150 1.320 6 4 "[ .+- * .* ]" 1
935 1 50 TRP HH2 1 54 ARG HE 3.940 . 4.440 3.768 3.087 5.127 0.687 10 1 "[ . + . ]" 1
936 1 50 TRP HZ2 1 54 ARG HE 3.850 . 4.350 3.314 2.683 4.421 0.071 9 0 "[ . 1 . ]" 1
937 1 50 TRP HZ3 1 54 ARG HE 4.920 . 5.420 4.261 3.295 6.104 0.684 10 1 "[ . + . ]" 1
938 1 51 PHE H 1 51 PHE QB 3.420 . 3.920 2.181 2.124 2.266 . 0 0 "[ . 1 . ]" 1
939 1 51 PHE H 1 51 PHE QD 3.970 . 4.470 2.633 2.243 2.840 . 0 0 "[ . 1 . ]" 1
940 1 51 PHE H 1 52 LYS H 3.940 . 4.440 2.920 2.814 2.979 . 0 0 "[ . 1 . ]" 1
941 1 51 PHE H 1 53 ASN H 4.950 . 5.450 4.289 4.049 4.420 . 0 0 "[ . 1 . ]" 1
942 1 51 PHE HA 1 54 ARG H 5.290 . 5.790 3.381 3.152 3.912 . 0 0 "[ . 1 . ]" 1
943 1 51 PHE HA 1 54 ARG HB2 4.550 . 5.050 2.917 2.324 3.923 . 0 0 "[ . 1 . ]" 1
944 1 51 PHE HA 1 54 ARG QB 4.150 . 4.650 2.581 2.277 3.181 . 0 0 "[ . 1 . ]" 1
945 1 51 PHE HA 1 54 ARG HB3 4.550 . 5.050 3.219 2.588 4.835 . 0 0 "[ . 1 . ]" 1
946 1 51 PHE QB 1 52 LYS H 4.140 . 4.640 2.748 2.610 2.838 . 0 0 "[ . 1 . ]" 1
947 1 51 PHE QD 1 55 ARG H 6.170 . 6.670 5.709 5.198 6.205 . 0 0 "[ . 1 . ]" 1
948 1 52 LYS H 1 52 LYS HB2 3.640 . 4.140 3.689 3.612 3.745 . 0 0 "[ . 1 . ]" 1
949 1 52 LYS H 1 52 LYS HB3 3.560 . 4.060 2.610 2.370 2.866 . 0 0 "[ . 1 . ]" 1
950 1 52 LYS H 1 52 LYS QD 4.760 . 5.260 3.920 3.507 4.372 . 0 0 "[ . 1 . ]" 1
951 1 52 LYS H 1 52 LYS QG 4.190 . 4.460 2.398 2.195 2.927 . 0 0 "[ . 1 . ]" 1
952 1 52 LYS H 1 53 ASN H 3.560 . 4.060 2.801 2.721 2.892 . 0 0 "[ . 1 . ]" 1
953 1 52 LYS H 1 53 ASN QB 5.060 . 5.560 4.732 4.479 4.939 . 0 0 "[ . 1 . ]" 1
954 1 52 LYS H 1 54 ARG H 4.680 . 5.180 4.185 4.022 4.384 . 0 0 "[ . 1 . ]" 1
955 1 52 LYS HA 1 55 ARG H 4.200 . 4.700 3.326 2.985 3.682 . 0 0 "[ . 1 . ]" 1
956 1 52 LYS HA 1 55 ARG HE 4.320 . 4.820 3.990 2.803 5.545 0.725 4 3 "[ +. 1- * ]" 1
957 1 52 LYS HA 1 56 ALA H 4.490 . 4.990 4.010 3.615 4.535 . 0 0 "[ . 1 . ]" 1
958 1 52 LYS HB2 1 53 ASN H 3.880 . 4.380 4.055 3.770 4.277 . 0 0 "[ . 1 . ]" 1
959 1 52 LYS HB2 1 56 ALA H 5.010 . 5.510 4.935 4.648 5.491 . 0 0 "[ . 1 . ]" 1
960 1 52 LYS HB3 1 52 LYS QZ 5.090 . 5.590 3.561 2.370 4.080 . 0 0 "[ . 1 . ]" 1
961 1 52 LYS HB3 1 53 ASN H 4.190 . 4.690 4.147 3.873 4.514 . 0 0 "[ . 1 . ]" 1
962 1 52 LYS QD 1 53 ASN H 5.120 . 5.620 4.377 3.947 4.855 . 0 0 "[ . 1 . ]" 1
963 1 52 LYS HD2 2 9 DC H5 7.000 . 7.500 6.637 5.466 7.475 . 0 0 "[ . 1 . ]" 1
964 1 52 LYS HD3 2 9 DC H5 6.300 . 6.500 6.152 5.429 7.015 0.515 8 1 "[ . + 1 . ]" 1
965 1 52 LYS QE 2 8 DT H3 6.000 . 6.500 5.022 4.203 6.370 . 0 0 "[ . 1 . ]" 1
966 1 52 LYS QE 2 8 DT H6 6.300 . 6.500 6.334 5.162 7.205 0.705 8 1 "[ . + 1 . ]" 1
967 1 52 LYS QE 2 8 DT M7 6.730 . 7.230 3.386 2.474 3.997 . 0 0 "[ . 1 . ]" 1
968 1 52 LYS QE 2 9 DC H41 6.000 . 6.500 3.526 2.194 4.305 . 0 0 "[ . 1 . ]" 1
969 1 52 LYS QE 2 9 DC H42 6.000 . 6.500 3.289 2.407 4.405 . 0 0 "[ . 1 . ]" 1
970 1 52 LYS QE 2 9 DC H5 6.000 . 6.500 5.573 4.240 6.229 . 0 0 "[ . 1 . ]" 1
971 1 52 LYS QE 2 9 DC H6 7.000 . 7.500 7.545 6.317 8.345 0.845 8 1 "[ . + 1 . ]" 1
972 1 52 LYS QE 3 3 DG H8 6.000 . 6.500 5.006 3.643 5.920 . 0 0 "[ . 1 . ]" 1
973 1 52 LYS QE 3 4 DG H1 6.000 . 6.500 5.450 4.404 6.970 0.470 13 0 "[ . 1 . ]" 1
974 1 52 LYS QE 3 4 DG H8 6.300 . 6.500 3.824 3.229 5.403 . 0 0 "[ . 1 . ]" 1
975 1 52 LYS QE 3 5 DG H1 6.000 . 6.500 4.732 4.089 5.871 . 0 0 "[ . 1 . ]" 1
976 1 52 LYS QE 3 5 DG H8 7.000 . 7.500 5.721 5.241 6.591 . 0 0 "[ . 1 . ]" 1
977 1 52 LYS QG 1 53 ASN H 4.150 . 4.650 2.465 2.247 3.033 . 0 0 "[ . 1 . ]" 1
978 1 52 LYS QG 2 8 DT H3 6.000 . 6.500 6.372 5.605 6.879 0.379 13 0 "[ . 1 . ]" 1
979 1 52 LYS QG 2 9 DC H5 7.000 . 7.500 7.280 6.797 7.668 0.168 5 0 "[ . 1 . ]" 1
980 1 52 LYS QG 3 5 DG H1 6.300 . 6.500 7.084 6.313 7.624 1.124 13 9 "[* * **-**1 +*. ]" 1
981 1 52 LYS QG 3 6 DA H62 6.000 . 6.500 4.885 4.109 5.441 . 0 0 "[ . 1 . ]" 1
982 1 52 LYS QZ 2 7 DA H62 9.610 . 10.110 6.675 5.023 8.726 . 0 0 "[ . 1 . ]" 1
983 1 52 LYS QZ 2 9 DC H41 6.000 . 6.500 2.492 1.983 3.931 . 0 0 "[ . 1 . ]" 1
984 1 52 LYS QZ 2 9 DC H42 6.000 . 6.500 2.711 2.061 4.380 . 0 0 "[ . 1 . ]" 1
985 1 52 LYS QZ 2 9 DC H5 9.610 . 10.110 4.321 3.497 5.651 . 0 0 "[ . 1 . ]" 1
986 1 52 LYS QZ 3 5 DG H1 7.210 . 7.710 4.142 3.416 6.329 . 0 0 "[ . 1 . ]" 1
987 1 52 LYS QZ 3 6 DA H61 6.500 . 7.000 5.171 3.861 6.655 . 0 0 "[ . 1 . ]" 1
988 1 53 ASN H 1 53 ASN QB 3.330 . 3.670 2.320 2.203 2.477 . 0 0 "[ . 1 . ]" 1
989 1 53 ASN H 1 54 ARG H 3.520 . 4.020 2.718 2.459 2.824 . 0 0 "[ . 1 . ]" 1
990 1 53 ASN H 1 54 ARG QB 5.480 . 5.980 4.464 4.182 4.683 . 0 0 "[ . 1 . ]" 1
991 1 53 ASN H 2 6 DA H8 6.000 . 6.500 6.365 5.776 6.915 0.415 10 0 "[ . 1 . ]" 1
992 1 53 ASN HA 1 56 ALA H 4.160 . 4.660 3.147 2.716 3.548 . 0 0 "[ . 1 . ]" 1
993 1 53 ASN HA 1 56 ALA MB 4.500 . 5.000 2.217 2.027 2.560 . 0 0 "[ . 1 . ]" 1
994 1 53 ASN QB 1 54 ARG H 3.830 . 4.330 2.971 2.717 3.300 . 0 0 "[ . 1 . ]" 1
995 1 53 ASN QB 1 54 ARG HE 5.280 . 5.780 4.994 3.755 6.870 1.090 16 1 "[ . 1 .+ ]" 1
996 1 53 ASN QB 2 6 DA H8 6.000 . 6.500 3.418 2.727 4.103 . 0 0 "[ . 1 . ]" 1
997 1 53 ASN HD21 2 6 DA H8 6.000 . 6.500 3.851 2.939 4.818 . 0 0 "[ . 1 . ]" 1
998 1 53 ASN HD21 2 7 DA H8 6.000 . 6.500 3.991 3.286 4.931 . 0 0 "[ . 1 . ]" 1
999 1 53 ASN HD22 2 6 DA H1' 6.000 . 6.500 5.145 4.495 5.997 . 0 0 "[ . 1 . ]" 1
1000 1 53 ASN HD22 2 6 DA H2 6.300 . 6.500 6.603 6.048 7.023 0.523 12 1 "[ . 1 + . ]" 1
1001 1 53 ASN HD22 2 6 DA H8 6.000 . 6.500 3.621 2.810 4.677 . 0 0 "[ . 1 . ]" 1
1002 1 53 ASN HD22 2 7 DA H62 6.000 . 6.500 4.639 4.250 5.202 . 0 0 "[ . 1 . ]" 1
1003 1 53 ASN HD22 2 7 DA H8 6.000 . 6.500 3.247 2.630 4.724 . 0 0 "[ . 1 . ]" 1
1004 1 54 ARG H 1 54 ARG HB2 3.680 . 4.180 2.286 2.158 2.674 . 0 0 "[ . 1 . ]" 1
1005 1 54 ARG H 1 54 ARG HB3 3.680 . 4.180 2.972 2.361 3.596 . 0 0 "[ . 1 . ]" 1
1006 1 54 ARG H 1 54 ARG HE 4.680 . 5.180 4.023 2.993 5.374 0.194 16 0 "[ . 1 . ]" 1
1007 1 54 ARG H 1 55 ARG H 3.630 . 4.130 2.760 2.431 2.942 . 0 0 "[ . 1 . ]" 1
1008 1 54 ARG H 1 55 ARG QG 4.930 . 5.430 4.500 3.830 4.793 . 0 0 "[ . 1 . ]" 1
1009 1 54 ARG H 1 56 ALA H 4.140 . 4.640 4.164 3.885 4.334 . 0 0 "[ . 1 . ]" 1
1010 1 54 ARG HA 1 54 ARG HE 3.850 . 4.350 3.412 2.674 4.003 . 0 0 "[ . 1 . ]" 1
1011 1 54 ARG HA 1 56 ALA H 4.920 . 5.420 4.547 4.195 4.789 . 0 0 "[ . 1 . ]" 1
1012 1 54 ARG HA 1 57 LYS H 4.160 . 4.660 3.464 2.992 3.919 . 0 0 "[ . 1 . ]" 1
1013 1 54 ARG QB 1 54 ARG HE 4.130 . 4.630 2.385 2.075 3.782 . 0 0 "[ . 1 . ]" 1
1014 1 54 ARG HB2 1 54 ARG HE 4.310 . 4.810 2.505 2.087 4.224 . 0 0 "[ . 1 . ]" 1
1015 1 54 ARG HB2 1 55 ARG H 3.950 . 4.450 3.650 3.080 4.145 . 0 0 "[ . 1 . ]" 1
1016 1 54 ARG HB3 1 54 ARG HE 4.310 . 4.810 3.751 2.325 4.267 . 0 0 "[ . 1 . ]" 1
1017 1 54 ARG HB3 1 55 ARG H 3.950 . 4.450 2.936 2.656 3.952 . 0 0 "[ . 1 . ]" 1
1018 1 54 ARG HE 1 54 ARG HG2 3.790 . 4.290 2.813 2.258 3.641 . 0 0 "[ . 1 . ]" 1
1019 1 54 ARG HE 1 54 ARG QG 3.730 . 4.230 2.675 2.233 2.998 . 0 0 "[ . 1 . ]" 1
1020 1 54 ARG HE 1 54 ARG HG3 3.790 . 4.290 3.644 2.496 3.906 . 0 0 "[ . 1 . ]" 1
1021 1 54 ARG QG 1 55 ARG H 5.330 . 5.830 4.239 3.450 4.656 . 0 0 "[ . 1 . ]" 1
1022 1 55 ARG H 1 55 ARG HB2 3.690 . 4.190 2.793 2.413 3.730 . 0 0 "[ . 1 . ]" 1
1023 1 55 ARG H 1 55 ARG HB3 3.690 . 4.190 3.472 2.805 3.732 . 0 0 "[ . 1 . ]" 1
1024 1 55 ARG H 1 55 ARG QD 4.920 . 5.420 4.183 3.733 4.465 . 0 0 "[ . 1 . ]" 1
1025 1 55 ARG H 1 55 ARG HE 5.500 . 6.000 4.584 2.679 5.547 . 0 0 "[ . 1 . ]" 1
1026 1 55 ARG H 1 55 ARG QG 3.910 . 4.410 2.386 2.003 2.715 . 0 0 "[ . 1 . ]" 1
1027 1 55 ARG H 1 56 ALA H 3.630 . 4.130 2.661 2.384 2.903 . 0 0 "[ . 1 . ]" 1
1028 1 55 ARG H 1 57 LYS H 4.130 . 4.630 4.171 3.902 4.671 0.041 7 0 "[ . 1 . ]" 1
1029 1 55 ARG QB 1 56 ALA H 4.050 . 4.550 2.842 2.404 3.667 . 0 0 "[ . 1 . ]" 1
1030 1 55 ARG HB2 1 55 ARG HE 4.090 . 4.590 2.831 2.182 3.977 . 0 0 "[ . 1 . ]" 1
1031 1 55 ARG HB2 1 56 ALA H 4.130 . 4.630 2.964 2.441 3.998 . 0 0 "[ . 1 . ]" 1
1032 1 55 ARG HB3 1 55 ARG HE 4.090 . 4.590 3.254 2.175 4.377 . 0 0 "[ . 1 . ]" 1
1033 1 55 ARG HB3 1 56 ALA H 4.130 . 4.630 3.770 3.274 4.265 . 0 0 "[ . 1 . ]" 1
1034 1 55 ARG HE 1 56 ALA MB 6.170 . 6.670 5.529 3.925 6.288 . 0 0 "[ . 1 . ]" 1
1035 1 55 ARG QG 1 56 ALA H 4.240 . 4.740 3.754 2.216 4.328 . 0 0 "[ . 1 . ]" 1
1036 1 56 ALA H 1 57 LYS H 3.560 . 4.060 2.923 2.788 3.093 . 0 0 "[ . 1 . ]" 1
1037 1 56 ALA H 1 57 LYS HA 5.450 . 5.950 5.500 5.338 5.684 . 0 0 "[ . 1 . ]" 1
1038 1 56 ALA H 1 58 TRP H 4.680 . 5.180 4.614 4.100 5.098 . 0 0 "[ . 1 . ]" 1
1039 1 56 ALA HA 1 58 TRP H 4.050 . 4.550 4.199 3.553 4.644 0.094 10 0 "[ . 1 . ]" 1
1040 1 56 ALA HA 1 59 ARG H 3.810 . 4.310 3.343 3.061 3.734 . 0 0 "[ . 1 . ]" 1
1041 1 56 ALA HA 1 59 ARG QG 4.500 . 5.000 2.922 2.075 3.910 . 0 0 "[ . 1 . ]" 1
1042 1 56 ALA HA 1 60 LYS H 4.400 . 4.900 4.059 3.742 4.504 . 0 0 "[ . 1 . ]" 1
1043 1 56 ALA MB 1 57 LYS H 4.000 . 4.500 2.812 2.442 3.370 . 0 0 "[ . 1 . ]" 1
1044 1 56 ALA MB 1 57 LYS HA 5.760 . 6.260 4.095 3.951 4.324 . 0 0 "[ . 1 . ]" 1
1045 1 56 ALA MB 1 59 ARG QB 6.670 . 7.170 3.987 2.906 5.461 . 0 0 "[ . 1 . ]" 1
1046 1 56 ALA MB 1 60 LYS QB 6.660 . 7.160 4.220 3.751 4.873 . 0 0 "[ . 1 . ]" 1
1047 1 56 ALA MB 1 60 LYS QE 6.150 . 6.650 2.600 1.981 4.236 . 0 0 "[ . 1 . ]" 1
1048 1 56 ALA MB 3 5 DG H8 7.210 . 7.710 4.652 4.113 5.882 . 0 0 "[ . 1 . ]" 1
1049 1 56 ALA MB 3 6 DA H62 7.210 . 7.710 5.220 4.380 5.866 . 0 0 "[ . 1 . ]" 1
1050 1 56 ALA MB 3 7 DT H3 7.510 . 7.710 6.786 6.134 7.773 0.063 7 0 "[ . 1 . ]" 1
1051 1 57 LYS H 1 57 LYS HB2 3.650 . 4.150 2.377 2.090 2.783 . 0 0 "[ . 1 . ]" 1
1052 1 57 LYS H 1 57 LYS QB 3.310 . 3.810 2.327 2.055 2.704 . 0 0 "[ . 1 . ]" 1
1053 1 57 LYS H 1 57 LYS HB3 3.650 . 4.150 3.361 2.744 3.672 . 0 0 "[ . 1 . ]" 1
1054 1 57 LYS H 1 57 LYS QD 4.020 . 4.520 3.430 2.668 4.009 . 0 0 "[ . 1 . ]" 1
1055 1 57 LYS H 1 57 LYS QE 5.720 . 6.220 4.772 3.756 5.854 . 0 0 "[ . 1 . ]" 1
1056 1 57 LYS H 1 57 LYS HG2 4.710 . 5.210 3.371 2.169 4.611 . 0 0 "[ . 1 . ]" 1
1057 1 57 LYS H 1 57 LYS QG 4.620 . 5.120 3.109 2.154 4.082 . 0 0 "[ . 1 . ]" 1
1058 1 57 LYS H 1 57 LYS HG3 4.710 . 5.210 4.067 3.601 4.580 . 0 0 "[ . 1 . ]" 1
1059 1 57 LYS H 1 58 TRP H 3.240 . 3.740 2.958 2.525 3.267 . 0 0 "[ . 1 . ]" 1
1060 1 57 LYS H 1 59 ARG H 4.980 . 5.480 4.443 4.060 4.791 . 0 0 "[ . 1 . ]" 1
1061 1 57 LYS H 1 60 LYS QD 6.170 . 6.670 4.888 4.249 5.930 . 0 0 "[ . 1 . ]" 1
1062 1 57 LYS HA 1 57 LYS QD 4.590 . 5.090 2.324 2.168 2.871 . 0 0 "[ . 1 . ]" 1
1063 1 57 LYS HA 1 57 LYS HG2 3.990 . 4.490 3.421 2.985 3.786 . 0 0 "[ . 1 . ]" 1
1064 1 57 LYS HA 1 57 LYS HG3 3.990 . 4.490 3.240 2.336 3.857 . 0 0 "[ . 1 . ]" 1
1065 1 57 LYS HA 1 60 LYS H 3.770 . 4.270 3.466 2.662 3.829 . 0 0 "[ . 1 . ]" 1
1066 1 57 LYS HA 1 60 LYS QB 3.540 . 4.040 2.721 2.205 3.150 . 0 0 "[ . 1 . ]" 1
1067 1 57 LYS HA 1 60 LYS QD 5.230 . 5.730 3.877 2.993 4.907 . 0 0 "[ . 1 . ]" 1
1068 1 57 LYS HB2 1 58 TRP H 3.850 . 4.350 3.185 2.348 3.901 . 0 0 "[ . 1 . ]" 1
1069 1 57 LYS HB3 1 58 TRP H 3.850 . 4.350 3.291 2.372 4.000 . 0 0 "[ . 1 . ]" 1
1070 1 57 LYS QD 1 58 TRP H 5.610 . 6.110 5.029 4.648 5.280 . 0 0 "[ . 1 . ]" 1
1071 1 57 LYS QD 1 60 LYS QB 4.740 . 5.240 3.790 3.372 4.170 . 0 0 "[ . 1 . ]" 1
1072 1 57 LYS QE 1 60 LYS QB 6.930 . 7.430 4.617 2.770 5.936 . 0 0 "[ . 1 . ]" 1
1073 1 57 LYS QE 2 5 DT H6 6.730 . 7.230 4.454 2.620 6.364 . 0 0 "[ . 1 . ]" 1
1074 1 58 TRP H 1 58 TRP HB2 3.580 . 4.080 2.862 2.195 3.641 . 0 0 "[ . 1 . ]" 1
1075 1 58 TRP H 1 58 TRP QB 3.490 . 3.990 2.225 2.008 2.422 . 0 0 "[ . 1 . ]" 1
1076 1 58 TRP H 1 58 TRP HB3 3.580 . 4.080 2.399 2.028 2.709 . 0 0 "[ . 1 . ]" 1
1077 1 58 TRP H 1 58 TRP HD1 5.500 . 6.000 4.956 4.554 5.185 . 0 0 "[ . 1 . ]" 1
1078 1 58 TRP H 1 59 ARG QG 5.140 . 5.640 4.339 3.826 4.798 . 0 0 "[ . 1 . ]" 1
1079 1 58 TRP HA 1 58 TRP HD1 4.990 . 5.490 3.432 2.430 4.438 . 0 0 "[ . 1 . ]" 1
1080 1 58 TRP HA 1 60 LYS H 5.390 . 5.890 4.636 4.236 5.147 . 0 0 "[ . 1 . ]" 1
1081 1 58 TRP HA 1 61 ARG H 4.360 . 4.860 3.868 3.342 4.387 . 0 0 "[ . 1 . ]" 1
1082 1 58 TRP HA 1 61 ARG QB 4.570 . 5.070 3.466 2.441 4.622 . 0 0 "[ . 1 . ]" 1
1083 1 58 TRP HA 1 62 GLU H 4.410 . 4.910 3.801 3.219 4.888 . 0 0 "[ . 1 . ]" 1
1084 1 58 TRP HA 1 62 GLU QG 4.660 . 5.160 4.004 2.533 6.961 1.801 7 2 "[ .-+ 1 . ]" 1
1085 1 58 TRP HA 1 63 GLU H 5.500 . 6.000 5.294 4.303 6.975 0.975 9 2 "[ . +1 .- ]" 1
1086 1 58 TRP QB 1 59 ARG H 3.830 . 4.330 2.914 2.327 3.701 . 0 0 "[ . 1 . ]" 1
1087 1 58 TRP HB2 1 59 ARG H 4.120 . 4.620 4.020 3.789 4.399 . 0 0 "[ . 1 . ]" 1
1088 1 58 TRP HB3 1 59 ARG H 4.120 . 4.620 3.045 2.348 4.074 . 0 0 "[ . 1 . ]" 1
1089 1 58 TRP HD1 1 59 ARG H 5.120 . 5.620 4.327 3.111 5.449 . 0 0 "[ . 1 . ]" 1
1090 1 58 TRP HE1 1 59 ARG H 5.500 . 6.000 5.928 4.232 7.315 1.315 7 4 "[ -* . + 1 * . ]" 1
1091 1 58 TRP HE1 1 59 ARG HA 4.420 . 4.920 5.391 4.388 6.839 1.919 12 9 "[ ** . * 1 +***-*]" 1
1092 1 58 TRP HE1 1 59 ARG QG 5.790 . 6.290 5.359 2.797 7.344 1.054 12 2 "[ - . 1 + . ]" 1
1093 1 58 TRP HE1 1 62 GLU QB 6.170 . 6.670 4.733 2.803 8.208 1.538 7 2 "[ .-+ 1 . ]" 1
1094 1 59 ARG H 1 59 ARG QB 3.670 . 4.170 2.563 2.423 2.729 . 0 0 "[ . 1 . ]" 1
1095 1 59 ARG H 1 59 ARG QG 3.470 . 3.970 2.321 1.918 2.631 . 0 0 "[ . 1 . ]" 1
1096 1 59 ARG H 1 60 LYS H 3.460 . 3.960 2.646 2.098 2.976 . 0 0 "[ . 1 . ]" 1
1097 1 59 ARG H 1 61 ARG H 4.830 . 5.330 4.164 3.535 4.467 . 0 0 "[ . 1 . ]" 1
1098 1 59 ARG HA 1 59 ARG HE 4.380 . 4.880 3.661 2.465 4.993 0.113 9 0 "[ . 1 . ]" 1
1099 1 59 ARG HA 1 61 ARG H 4.720 . 5.220 4.255 3.557 4.777 . 0 0 "[ . 1 . ]" 1
1100 1 59 ARG HA 1 62 GLU H 4.710 . 5.210 3.666 3.032 4.427 . 0 0 "[ . 1 . ]" 1
1101 1 59 ARG HA 1 62 GLU QB 4.820 . 5.320 4.550 3.944 5.314 . 0 0 "[ . 1 . ]" 1
1102 1 59 ARG HA 1 63 GLU H 3.460 . 3.960 3.043 2.285 3.697 . 0 0 "[ . 1 . ]" 1
1103 1 59 ARG HA 1 63 GLU QB 5.100 . 5.600 4.183 2.083 4.914 . 0 0 "[ . 1 . ]" 1
1104 1 59 ARG HA 1 64 PHE H 3.920 . 4.420 4.485 2.682 5.447 1.027 16 3 "[ - . 1 *+ ]" 1
1105 1 59 ARG HA 1 65 ILE H 5.500 . 6.000 5.670 4.254 6.565 0.565 13 1 "[ . 1 + . ]" 1
1106 1 59 ARG QB 1 59 ARG HE 3.480 . 3.980 2.501 2.002 3.368 . 0 0 "[ . 1 . ]" 1
1107 1 59 ARG QG 1 60 LYS H 4.160 . 4.660 3.840 2.556 4.323 . 0 0 "[ . 1 . ]" 1
1108 1 60 LYS H 1 60 LYS QB 3.430 . 3.930 2.390 2.289 2.658 . 0 0 "[ . 1 . ]" 1
1109 1 60 LYS H 1 60 LYS QD 4.790 . 5.290 3.754 2.837 4.131 . 0 0 "[ . 1 . ]" 1
1110 1 60 LYS H 1 60 LYS QE 5.430 . 5.930 4.581 3.973 4.993 . 0 0 "[ . 1 . ]" 1
1111 1 60 LYS H 1 60 LYS HG2 3.990 . 4.490 3.520 2.319 3.878 . 0 0 "[ . 1 . ]" 1
1112 1 60 LYS H 1 60 LYS QG 3.580 . 4.080 2.440 2.136 2.721 . 0 0 "[ . 1 . ]" 1
1113 1 60 LYS H 1 60 LYS HG3 3.990 . 4.490 2.646 2.159 3.895 . 0 0 "[ . 1 . ]" 1
1114 1 60 LYS H 1 61 ARG H 3.610 . 4.110 2.732 2.606 2.956 . 0 0 "[ . 1 . ]" 1
1115 1 60 LYS H 1 62 GLU H 4.050 . 4.550 4.202 3.488 4.496 . 0 0 "[ . 1 . ]" 1
1116 1 60 LYS HA 1 60 LYS QD 4.460 . 4.960 3.792 2.265 4.155 . 0 0 "[ . 1 . ]" 1
1117 1 60 LYS HA 1 62 GLU H 4.570 . 5.070 4.697 3.861 5.112 0.042 2 0 "[ . 1 . ]" 1
1118 1 60 LYS QB 1 61 ARG H 3.730 . 4.230 3.080 2.530 3.622 . 0 0 "[ . 1 . ]" 1
1119 1 60 LYS QB 1 62 GLU H 5.620 . 6.120 5.013 4.331 5.356 . 0 0 "[ . 1 . ]" 1
1120 1 60 LYS QE 2 5 DT H3 6.730 . 7.230 6.299 5.598 7.820 0.590 13 1 "[ . 1 + . ]" 1
1121 1 60 LYS QE 3 5 DG H8 6.730 . 7.230 6.231 4.723 7.488 0.258 15 0 "[ . 1 . ]" 1
1122 1 60 LYS QE 3 6 DA H8 6.730 . 7.230 5.616 4.620 6.730 . 0 0 "[ . 1 . ]" 1
1123 1 60 LYS QE 3 7 DT M7 7.560 . 8.060 3.480 2.480 4.346 . 0 0 "[ . 1 . ]" 1
1124 1 61 ARG H 1 61 ARG HB2 3.770 . 4.270 2.712 2.388 3.226 . 0 0 "[ . 1 . ]" 1
1125 1 61 ARG H 1 61 ARG QB 3.580 . 4.080 2.409 2.207 2.743 . 0 0 "[ . 1 . ]" 1
1126 1 61 ARG H 1 61 ARG HB3 3.770 . 4.270 2.879 2.488 3.841 . 0 0 "[ . 1 . ]" 1
1127 1 61 ARG H 1 61 ARG QG 4.530 . 5.030 3.774 2.425 4.228 . 0 0 "[ . 1 . ]" 1
1128 1 61 ARG H 1 62 GLU H 3.620 . 4.120 2.300 1.814 2.820 . 0 0 "[ . 1 . ]" 1
1129 1 61 ARG HA 1 61 ARG QD 4.750 . 5.250 3.613 2.203 4.269 . 0 0 "[ . 1 . ]" 1
1130 1 61 ARG HA 1 61 ARG QG 3.770 . 4.270 2.602 2.274 3.162 . 0 0 "[ . 1 . ]" 1
1131 1 61 ARG QB 1 62 GLU H 3.460 . 3.960 2.852 2.519 3.310 . 0 0 "[ . 1 . ]" 1
1132 1 61 ARG QG 1 62 GLU H 4.740 . 5.240 4.046 3.704 4.485 . 0 0 "[ . 1 . ]" 1
1133 1 62 GLU H 1 62 GLU QG 3.670 . 4.170 2.788 2.275 3.241 . 0 0 "[ . 1 . ]" 1
1134 1 62 GLU HA 1 65 ILE H 4.420 . 4.920 4.128 2.753 4.604 . 0 0 "[ . 1 . ]" 1
1135 1 62 GLU HA 1 65 ILE MD 6.610 . 7.110 4.408 3.303 5.730 . 0 0 "[ . 1 . ]" 1
1136 1 62 GLU HA 1 65 ILE QG 5.070 . 5.570 4.395 3.344 5.054 . 0 0 "[ . 1 . ]" 1
1137 1 62 GLU QB 1 63 GLU H 3.890 . 4.390 3.345 2.311 4.010 . 0 0 "[ . 1 . ]" 1
1138 1 62 GLU QB 1 64 PHE H 4.600 . 5.100 3.330 2.743 4.384 . 0 0 "[ . 1 . ]" 1
1139 1 62 GLU QB 1 64 PHE HA 5.560 . 6.060 4.864 3.262 6.060 0.000 16 0 "[ . 1 . ]" 1
1140 1 62 GLU QB 1 64 PHE QB 6.360 . 6.860 5.173 4.474 5.591 . 0 0 "[ . 1 . ]" 1
1141 1 62 GLU QB 1 65 ILE H 4.030 . 4.530 2.653 2.062 3.472 . 0 0 "[ . 1 . ]" 1
1142 1 62 GLU QB 1 65 ILE MD 5.650 . 6.150 3.454 2.111 5.564 . 0 0 "[ . 1 . ]" 1
1143 1 62 GLU QB 1 65 ILE QG 5.280 . 5.780 3.229 2.191 4.648 . 0 0 "[ . 1 . ]" 1
1144 1 62 GLU QB 1 65 ILE MG 7.130 . 7.630 3.818 3.591 4.380 . 0 0 "[ . 1 . ]" 1
1145 1 62 GLU QB 1 66 VAL H 5.810 . 6.310 5.213 4.684 5.631 . 0 0 "[ . 1 . ]" 1
1146 1 62 GLU QG 1 65 ILE H 4.690 . 5.190 4.352 3.684 5.173 . 0 0 "[ . 1 . ]" 1
1147 1 62 GLU QG 1 65 ILE MD 6.240 . 6.740 4.223 2.190 5.915 . 0 0 "[ . 1 . ]" 1
1148 1 63 GLU H 1 64 PHE H 3.770 . 4.270 3.257 1.994 3.763 . 0 0 "[ . 1 . ]" 1
1149 1 63 GLU H 1 64 PHE HA 5.500 . 6.000 5.305 4.690 5.700 . 0 0 "[ . 1 . ]" 1
1150 1 63 GLU HA 1 63 GLU HG2 3.770 . 4.270 3.116 2.361 3.884 . 0 0 "[ . 1 . ]" 1
1151 1 63 GLU HA 1 63 GLU QG 3.650 . 4.150 2.566 2.158 3.397 . 0 0 "[ . 1 . ]" 1
1152 1 63 GLU HA 1 63 GLU HG3 3.770 . 4.270 2.950 2.310 3.932 . 0 0 "[ . 1 . ]" 1
1153 1 63 GLU HA 1 64 PHE H 3.490 . 3.990 3.473 2.665 3.595 . 0 0 "[ . 1 . ]" 1
1154 1 63 GLU HA 1 64 PHE HA 5.140 . 5.640 4.642 4.483 4.852 . 0 0 "[ . 1 . ]" 1
1155 1 64 PHE H 1 64 PHE QD 4.670 . 5.170 3.032 2.308 4.372 . 0 0 "[ . 1 . ]" 1
1156 1 64 PHE QB 1 65 ILE H 4.660 . 5.160 3.726 2.734 4.133 . 0 0 "[ . 1 . ]" 1
1157 1 64 PHE QD 1 65 ILE H 5.230 . 5.730 3.687 3.152 4.504 . 0 0 "[ . 1 . ]" 1
1158 1 64 PHE QD 1 65 ILE HA 5.280 . 5.780 3.754 3.000 4.762 . 0 0 "[ . 1 . ]" 1
1159 1 64 PHE QE 1 65 ILE MD 6.050 . 6.550 3.716 2.447 6.041 . 0 0 "[ . 1 . ]" 1
1160 1 65 ILE H 1 65 ILE HB 3.750 . 4.250 2.722 2.471 3.630 . 0 0 "[ . 1 . ]" 1
1161 1 65 ILE H 1 65 ILE HG12 4.200 . 4.700 3.171 2.083 4.011 . 0 0 "[ . 1 . ]" 1
1162 1 65 ILE H 1 65 ILE QG 4.100 . 4.600 2.303 1.953 3.003 . 0 0 "[ . 1 . ]" 1
1163 1 65 ILE H 1 65 ILE HG13 4.200 . 4.700 2.767 1.971 4.564 . 0 0 "[ . 1 . ]" 1
1164 1 65 ILE H 1 66 VAL H 4.600 . 5.100 4.469 3.895 4.696 . 0 0 "[ . 1 . ]" 1
1165 1 65 ILE HA 1 66 VAL H 2.850 . 3.350 2.169 2.098 2.307 . 0 0 "[ . 1 . ]" 1
1166 1 65 ILE HA 1 66 VAL HB 5.100 . 5.600 4.515 4.063 5.612 0.012 12 0 "[ . 1 . ]" 1
1167 1 65 ILE HB 1 66 VAL H 4.530 . 5.030 4.161 3.919 4.471 . 0 0 "[ . 1 . ]" 1
1168 1 65 ILE QG 1 66 VAL H 5.430 . 5.930 4.332 3.976 4.809 . 0 0 "[ . 1 . ]" 1
1169 1 65 ILE HG12 1 66 VAL H 5.490 . 5.990 4.653 4.174 5.311 . 0 0 "[ . 1 . ]" 1
1170 1 65 ILE HG13 1 66 VAL H 5.490 . 5.990 5.189 4.999 5.641 . 0 0 "[ . 1 . ]" 1
1171 1 65 ILE MG 1 66 VAL H 4.500 . 5.000 2.644 2.219 3.289 . 0 0 "[ . 1 . ]" 1
1172 1 65 ILE MG 1 66 VAL HA 5.460 . 5.960 3.899 3.206 4.564 . 0 0 "[ . 1 . ]" 1
1173 1 65 ILE MG 1 67 THR H 6.360 . 6.860 4.468 2.058 5.416 . 0 0 "[ . 1 . ]" 1
1174 1 66 VAL CB 1 67 THR H 6.070 . 6.570 3.396 3.106 3.994 . 0 0 "[ . 1 . ]" 1
1175 1 66 VAL CB 1 68 ASP H 6.560 . 7.060 5.323 3.387 6.867 . 0 0 "[ . 1 . ]" 1
1176 1 66 VAL H 1 66 VAL HB 3.720 . 4.220 2.907 2.325 3.750 . 0 0 "[ . 1 . ]" 1
1177 1 66 VAL HA 1 67 THR H 3.170 . 3.670 2.326 2.126 3.407 . 0 0 "[ . 1 . ]" 1
1178 1 66 VAL HB 1 67 THR H 4.540 . 5.040 4.124 3.953 4.505 . 0 0 "[ . 1 . ]" 1
1179 1 66 VAL MG1 1 67 THR H 5.320 . 5.820 3.502 2.363 4.411 . 0 0 "[ . 1 . ]" 1
1180 1 66 VAL MG1 1 68 ASP H 6.400 . 6.900 4.255 2.256 5.741 . 0 0 "[ . 1 . ]" 1
1181 1 66 VAL MG2 1 67 THR H 5.320 . 5.820 2.950 2.150 4.173 . 0 0 "[ . 1 . ]" 1
1182 1 66 VAL MG2 1 68 ASP H 6.400 . 6.900 4.296 2.083 5.362 . 0 0 "[ . 1 . ]" 1
1183 1 67 THR HB 1 68 ASP H 4.000 . 4.500 3.626 2.669 4.344 . 0 0 "[ . 1 . ]" 1
1184 2 1 DG H1' 2 2 DC H5 4.070 . 4.550 4.308 3.738 4.802 0.252 11 0 "[ . 1 . ]" 1
1185 2 1 DG H2'' 2 2 DC H5 3.980 . 4.480 3.363 2.655 3.743 . 0 0 "[ . 1 . ]" 1
1186 2 1 DG H2'' 2 2 DC H6 3.820 . 4.320 2.320 2.146 2.520 . 0 0 "[ . 1 . ]" 1
1187 2 1 DG H8 2 2 DC H42 5.100 2.390 5.400 4.477 3.981 5.611 0.211 10 0 "[ . 1 . ]" 1
1188 2 1 DG H8 2 2 DC H5 4.080 . 4.390 3.593 3.199 3.944 . 0 0 "[ . 1 . ]" 1
1189 2 1 DG H8 2 2 DC H6 4.270 . 4.510 4.745 4.345 5.209 0.699 15 3 "[ - 1 *+ ]" 1
1190 2 1 DG H8 2 3 DT M7 7.210 2.730 7.710 6.187 5.554 6.908 . 0 0 "[ . 1 . ]" 1
1191 2 2 DC H1' 2 2 DC H5 5.710 2.300 6.210 5.460 5.433 5.470 . 0 0 "[ . 1 . ]" 1
1192 2 2 DC H1' 2 3 DT H6 3.690 . 4.080 3.820 3.202 4.288 0.208 15 0 "[ . 1 . ]" 1
1193 2 2 DC H1' 2 3 DT M7 7.210 . 7.710 4.165 3.799 4.625 . 0 0 "[ . 1 . ]" 1
1194 2 2 DC H2' 2 3 DT M7 7.210 . 7.710 2.538 2.203 2.841 . 0 0 "[ . 1 . ]" 1
1195 2 2 DC H2'' 2 2 DC H5 5.300 2.350 5.330 5.529 5.406 5.654 0.324 17 0 "[ . 1 . ]" 1
1196 2 2 DC H41 2 2 DC H42 4.030 . 4.510 1.764 1.752 1.776 . 0 0 "[ . 1 . ]" 1
1197 2 2 DC H41 2 2 DC H5 3.990 . 4.430 3.589 2.391 3.677 . 0 0 "[ . 1 . ]" 1
1198 2 2 DC H41 2 3 DT M7 7.210 2.720 7.710 4.623 4.126 5.196 . 0 0 "[ . 1 . ]" 1
1199 2 2 DC H41 3 12 DG H1 5.300 2.580 5.800 2.428 2.129 3.934 0.451 11 0 "[ . 1 . ]" 1
1200 2 2 DC H42 2 2 DC H6 5.540 . 6.040 4.654 4.581 5.341 . 0 0 "[ . 1 . ]" 1
1201 2 2 DC H42 3 12 DG H1 . 2.780 5.390 3.823 2.345 4.147 0.435 10 0 "[ . 1 . ]" 1
1202 2 2 DC H5 2 2 DC H6 3.330 . 3.830 2.450 2.441 2.456 . 0 0 "[ . 1 . ]" 1
1203 2 2 DC H5 2 3 DT M7 7.210 . 7.710 3.129 2.739 3.681 . 0 0 "[ . 1 . ]" 1
1204 2 3 DT H3 3 11 DA H2 4.270 . 4.770 2.752 2.547 2.937 . 0 0 "[ . 1 . ]" 1
1205 2 3 DT H6 2 3 DT M7 7.210 . 7.710 2.248 2.226 2.266 . 0 0 "[ . 1 . ]" 1
1206 2 3 DT H6 2 4 DC H5 4.370 . 4.770 3.905 3.506 4.315 . 0 0 "[ . 1 . ]" 1
1207 2 3 DT M7 2 4 DC H42 7.210 2.500 7.710 3.663 2.834 4.342 . 0 0 "[ . 1 . ]" 1
1208 2 3 DT M7 2 4 DC H5 7.210 . 7.710 3.790 2.972 4.456 . 0 0 "[ . 1 . ]" 1
1209 2 3 DT M7 3 10 DG H1 7.210 2.520 7.710 5.366 4.407 6.167 . 0 0 "[ . 1 . ]" 1
1210 2 4 DC H2' 2 4 DC H5 4.810 2.340 5.240 4.491 4.342 4.763 . 0 0 "[ . 1 . ]" 1
1211 2 4 DC H2'' 2 5 DT H6 4.350 . 4.850 2.851 2.409 3.387 . 0 0 "[ . 1 . ]" 1
1212 2 4 DC H41 2 4 DC H42 4.680 . 5.180 1.764 1.747 1.779 . 0 0 "[ . 1 . ]" 1
1213 2 4 DC H41 2 4 DC H5 3.860 . 4.360 2.411 2.357 2.492 . 0 0 "[ . 1 . ]" 1
1214 2 4 DC H41 2 5 DT M7 7.210 2.600 7.710 4.053 3.271 5.030 . 0 0 "[ . 1 . ]" 1
1215 2 4 DC H41 3 10 DG H1 5.510 2.690 5.830 3.851 3.554 4.142 . 0 0 "[ . 1 . ]" 1
1216 2 4 DC H42 2 4 DC H5 4.170 . 4.670 3.669 3.651 3.699 . 0 0 "[ . 1 . ]" 1
1217 2 4 DC H5 2 5 DT H3 5.280 2.570 5.620 5.288 4.742 5.685 0.065 12 0 "[ . 1 . ]" 1
1218 2 4 DC H5 2 5 DT M7 7.210 . 7.710 2.682 2.293 3.509 . 0 0 "[ . 1 . ]" 1
1219 2 4 DC H5 3 8 DT M7 7.210 2.680 7.710 6.223 5.467 7.136 . 0 0 "[ . 1 . ]" 1
1220 2 4 DC H5 3 10 DG H1 5.380 2.620 5.410 4.976 4.809 5.130 . 0 0 "[ . 1 . ]" 1
1221 2 4 DC H6 2 5 DT M7 7.210 . 7.710 2.798 2.485 3.170 . 0 0 "[ . 1 . ]" 1
1222 2 5 DT H2' 2 6 DA H8 5.480 2.670 5.810 4.610 4.126 4.971 . 0 0 "[ . 1 . ]" 1
1223 2 5 DT H3 2 6 DA H2 5.680 2.770 6.180 4.831 4.141 5.399 . 0 0 "[ . 1 . ]" 1
1224 2 5 DT H3 3 8 DT H3 5.510 2.690 6.010 4.332 4.051 4.689 . 0 0 "[ . 1 . ]" 1
1225 2 5 DT H3 3 8 DT M7 7.210 . 7.710 5.349 4.955 5.917 . 0 0 "[ . 1 . ]" 1
1226 2 5 DT H3 3 9 DA H2 4.720 2.300 4.770 2.810 2.539 3.234 . 0 0 "[ . 1 . ]" 1
1227 2 5 DT H3 3 10 DG H1 6.150 2.990 6.650 3.669 3.288 4.274 . 0 0 "[ . 1 . ]" 1
1228 2 5 DT H6 2 5 DT M7 7.210 . 7.710 2.223 2.206 2.251 . 0 0 "[ . 1 . ]" 1
1229 2 5 DT M7 3 8 DT H3 7.510 2.710 7.710 6.157 5.281 6.675 . 0 0 "[ . 1 . ]" 1
1230 2 6 DA H1' 2 6 DA H3' 5.130 2.500 5.610 3.824 3.723 3.935 . 0 0 "[ . 1 . ]" 1
1231 2 6 DA H1' 2 6 DA H8 4.940 2.410 5.440 3.905 3.894 3.925 . 0 0 "[ . 1 . ]" 1
1232 2 6 DA H1' 2 8 DT M7 7.210 2.370 7.710 6.153 5.409 6.628 . 0 0 "[ . 1 . ]" 1
1233 2 6 DA H2 3 9 DA H2 5.270 2.570 5.770 3.116 2.822 3.550 . 0 0 "[ . 1 . ]" 1
1234 2 6 DA H2'' 2 6 DA H8 5.460 2.660 5.960 3.826 3.658 4.071 . 0 0 "[ . 1 . ]" 1
1235 2 6 DA H2'' 2 7 DA H8 5.360 2.110 5.860 2.361 2.111 3.032 . 0 0 "[ . 1 . ]" 1
1236 2 6 DA H3' 2 6 DA H8 5.070 2.670 5.570 4.442 4.143 4.762 . 0 0 "[ . 1 . ]" 1
1237 2 6 DA H3' 2 7 DA H8 . 2.650 5.370 4.870 4.421 5.597 0.227 2 0 "[ . 1 . ]" 1
1238 2 7 DA H1' 2 7 DA H2' 4.300 . 4.800 3.029 2.984 3.059 . 0 0 "[ . 1 . ]" 1
1239 2 7 DA H1' 2 7 DA H2'' 4.330 . 4.580 2.343 2.290 2.412 . 0 0 "[ . 1 . ]" 1
1240 2 7 DA H1' 2 8 DT M7 7.210 . 7.710 4.101 3.660 4.576 . 0 0 "[ . 1 . ]" 1
1241 2 7 DA H2 2 8 DT M7 7.210 2.610 7.710 5.415 4.961 5.734 . 0 0 "[ . 1 . ]" 1
1242 2 7 DA H2 3 7 DT H1' 4.830 2.350 5.330 5.026 4.771 5.475 0.145 17 0 "[ . 1 . ]" 1
1243 2 7 DA H2 3 7 DT H3 3.330 . 3.830 2.631 2.291 2.872 . 0 0 "[ . 1 . ]" 1
1244 2 7 DA H2 3 7 DT M7 7.410 2.640 7.710 6.236 5.977 6.443 . 0 0 "[ . 1 . ]" 1
1245 2 7 DA H2 3 8 DT H3 3.960 . 4.460 3.326 3.010 3.627 . 0 0 "[ . 1 . ]" 1
1246 2 7 DA H2 3 8 DT M7 7.210 2.400 7.710 5.647 5.320 6.038 . 0 0 "[ . 1 . ]" 1
1247 2 7 DA H2' 2 7 DA H8 4.550 . 5.050 2.340 2.112 2.725 . 0 0 "[ . 1 . ]" 1
1248 2 7 DA H2' 2 8 DT M7 7.210 . 7.710 2.891 2.460 3.534 . 0 0 "[ . 1 . ]" 1
1249 2 7 DA H2'' 2 7 DA H8 4.490 . 4.990 3.773 3.380 4.135 . 0 0 "[ . 1 . ]" 1
1250 2 7 DA H2'' 2 8 DT M7 7.210 . 7.710 2.947 2.410 3.565 . 0 0 "[ . 1 . ]" 1
1251 2 7 DA H3' 2 7 DA H8 4.780 2.330 5.280 4.148 3.898 4.409 . 0 0 "[ . 1 . ]" 1
1252 2 7 DA H3' 2 8 DT M7 7.210 . 7.710 4.678 4.135 5.437 . 0 0 "[ . 1 . ]" 1
1253 2 7 DA H8 2 8 DT M7 7.210 . 7.710 3.124 2.922 3.459 . 0 0 "[ . 1 . ]" 1
1254 2 8 DT H1' 2 8 DT M7 7.210 . 7.710 5.174 5.071 5.226 . 0 0 "[ . 1 . ]" 1
1255 2 8 DT H2' 2 8 DT M7 7.210 2.380 7.710 4.168 3.839 4.613 . 0 0 "[ . 1 . ]" 1
1256 2 8 DT H2' 2 9 DC H5 4.390 2.300 4.890 3.248 2.535 4.135 . 0 0 "[ . 1 . ]" 1
1257 2 8 DT H2'' 2 8 DT M7 7.210 2.480 7.710 5.302 4.972 5.616 . 0 0 "[ . 1 . ]" 1
1258 2 8 DT H2'' 2 9 DC H5 4.320 . 4.680 3.466 2.505 4.086 . 0 0 "[ . 1 . ]" 1
1259 2 8 DT H3 2 8 DT M7 7.210 2.750 7.710 4.143 4.123 4.165 . 0 0 "[ . 1 . ]" 1
1260 2 8 DT H3 2 9 DC H1' 5.890 2.870 6.390 5.750 5.045 6.475 0.085 1 0 "[ . 1 . ]" 1
1261 2 8 DT H3 2 9 DC H5 5.350 2.610 5.850 4.591 4.210 5.061 . 0 0 "[ . 1 . ]" 1
1262 2 8 DT H3 3 5 DG H1 5.450 2.650 5.590 3.976 3.561 4.266 . 0 0 "[ . 1 . ]" 1
1263 2 8 DT H3 3 7 DT H1' 5.950 2.900 6.450 5.560 5.230 6.060 . 0 0 "[ . 1 . ]" 1
1264 2 8 DT M7 2 9 DC H41 7.210 2.360 7.710 3.337 2.695 3.844 . 0 0 "[ . 1 . ]" 1
1265 2 8 DT M7 2 9 DC H5 7.210 . 7.710 4.083 3.614 4.629 . 0 0 "[ . 1 . ]" 1
1266 2 8 DT M7 2 9 DC H6 7.210 . 7.710 5.776 5.300 6.385 . 0 0 "[ . 1 . ]" 1
1267 2 8 DT M7 3 5 DG H1 7.210 2.850 7.710 5.920 5.133 6.428 . 0 0 "[ . 1 . ]" 1
1268 2 8 DT M7 3 6 DA H2 7.210 2.430 7.710 6.254 5.844 6.504 . 0 0 "[ . 1 . ]" 1
1269 2 9 DC H1' 2 9 DC H2'' 3.190 . 3.690 2.333 2.215 2.389 . 0 0 "[ . 1 . ]" 1
1270 2 9 DC H1' 2 10 DC H6 4.060 . 4.360 4.077 3.502 4.574 0.214 9 0 "[ . 1 . ]" 1
1271 2 9 DC H1' 3 5 DG H1 5.440 2.550 5.730 5.346 5.095 5.476 . 0 0 "[ . 1 . ]" 1
1272 2 9 DC H1' 3 6 DA H2 4.230 . 4.670 3.937 3.226 4.500 . 0 0 "[ . 1 . ]" 1
1273 2 9 DC H2' 2 9 DC H5 4.480 . 4.780 4.452 4.348 4.621 . 0 0 "[ . 1 . ]" 1
1274 2 9 DC H2'' 2 10 DC H5 4.250 . 4.750 3.876 2.671 4.727 . 0 0 "[ . 1 . ]" 1
1275 2 9 DC H2'' 2 10 DC H6 3.770 . 4.270 2.401 2.201 3.049 . 0 0 "[ . 1 . ]" 1
1276 2 9 DC H41 2 9 DC H42 4.250 . 4.750 1.774 1.758 1.786 . 0 0 "[ . 1 . ]" 1
1277 2 9 DC H42 2 9 DC H5 4.010 . 4.510 3.657 3.638 3.673 . 0 0 "[ . 1 . ]" 1
1278 2 9 DC H42 3 4 DG H1 5.480 2.670 5.980 3.961 3.185 4.525 . 0 0 "[ . 1 . ]" 1
1279 2 9 DC H42 3 5 DG H1 4.400 . 4.850 2.208 2.016 2.564 . 0 0 "[ . 1 . ]" 1
1280 2 9 DC H5 2 9 DC H6 3.330 . 3.830 2.449 2.436 2.457 . 0 0 "[ . 1 . ]" 1
1281 2 9 DC H5 2 10 DC H5 4.040 . 4.540 3.984 3.643 4.525 . 0 0 "[ . 1 . ]" 1
1282 2 9 DC H5 3 4 DG H1 5.750 2.710 5.820 6.138 5.402 6.934 1.114 6 4 "[ .+* 1 * .- ]" 1
1283 2 9 DC H5 3 5 DG H1 4.670 . 4.920 4.946 4.833 5.148 0.228 15 0 "[ . 1 . ]" 1
1284 2 9 DC H5 3 6 DA H2 5.300 2.450 5.530 5.550 5.148 6.141 0.611 16 1 "[ . 1 .+ ]" 1
1285 2 10 DC H2' 2 10 DC H2'' 3.260 . 3.760 1.778 1.762 1.788 . 0 0 "[ . 1 . ]" 1
1286 2 10 DC H2' 2 11 DC H5 4.210 . 4.710 3.779 3.200 4.391 . 0 0 "[ . 1 . ]" 1
1287 2 10 DC H2'' 2 10 DC H6 3.620 . 4.120 3.730 3.575 3.994 . 0 0 "[ . 1 . ]" 1
1288 2 10 DC H42 2 10 DC H6 5.400 2.330 5.700 5.338 5.327 5.350 . 0 0 "[ . 1 . ]" 1
1289 2 10 DC H42 3 4 DG H1 4.730 2.100 4.870 2.307 1.950 2.516 0.150 2 0 "[ . 1 . ]" 1
1290 2 10 DC H42 3 5 DG H1 5.710 2.780 6.180 3.946 3.497 4.526 . 0 0 "[ . 1 . ]" 1
1291 2 10 DC H5 3 5 DG H1 5.700 2.580 5.790 5.625 4.829 6.365 0.575 9 1 "[ . +1 . ]" 1
1292 2 11 DC H2' 2 12 DC H6 3.740 . 4.240 3.120 2.488 4.052 . 0 0 "[ . 1 . ]" 1
1293 2 11 DC H2'' 2 12 DC H5 3.810 . 4.310 3.355 2.673 3.953 . 0 0 "[ . 1 . ]" 1
1294 2 11 DC H2'' 2 12 DC H6 3.800 . 4.300 2.368 2.235 2.696 . 0 0 "[ . 1 . ]" 1
1295 2 11 DC H41 2 11 DC H42 4.200 . 4.580 1.763 1.744 1.774 . 0 0 "[ . 1 . ]" 1
1296 2 11 DC H41 2 11 DC H5 3.800 . 4.270 2.401 2.347 2.446 . 0 0 "[ . 1 . ]" 1
1297 2 11 DC H42 2 11 DC H5 3.970 . 4.470 3.662 3.643 3.677 . 0 0 "[ . 1 . ]" 1
1298 2 11 DC H5 2 12 DC H41 5.160 2.510 5.660 3.730 3.032 4.362 . 0 0 "[ . 1 . ]" 1
1299 2 11 DC H5 2 12 DC H42 5.790 2.820 6.290 4.356 3.888 4.777 . 0 0 "[ . 1 . ]" 1
1300 2 11 DC H5 3 4 DG H1 5.800 2.830 5.940 5.222 4.526 5.636 . 0 0 "[ . 1 . ]" 1
1301 2 12 DC H1' 2 12 DC H2' 3.600 . 4.010 3.013 2.892 3.051 . 0 0 "[ . 1 . ]" 1
1302 2 12 DC H1' 2 12 DC H6 3.640 . 4.140 3.745 3.727 3.763 . 0 0 "[ . 1 . ]" 1
1303 2 12 DC H1' 2 13 DG H1' 5.010 2.440 5.510 4.881 4.144 5.885 0.375 1 0 "[ . 1 . ]" 1
1304 2 12 DC H1' 2 13 DG H8 3.900 . 4.400 4.245 3.887 5.172 0.772 2 2 "[-+ . 1 . ]" 1
1305 2 12 DC H2' 2 12 DC H5 4.360 . 4.660 4.448 4.313 4.654 . 0 0 "[ . 1 . ]" 1
1306 2 12 DC H2' 2 12 DC H6 3.440 . 3.940 2.300 2.088 2.959 . 0 0 "[ . 1 . ]" 1
1307 2 12 DC H2' 2 13 DG H1' 5.610 2.730 6.110 5.788 4.599 6.306 0.196 13 0 "[ . 1 . ]" 1
1308 2 12 DC H2' 2 13 DG H8 4.070 . 4.400 2.983 2.515 3.522 . 0 0 "[ . 1 . ]" 1
1309 2 12 DC H41 2 12 DC H42 4.270 . 4.770 1.765 1.752 1.776 . 0 0 "[ . 1 . ]" 1
1310 2 12 DC H42 2 12 DC H6 5.260 2.560 5.700 5.334 5.313 5.355 . 0 0 "[ . 1 . ]" 1
1311 2 12 DC H5 2 13 DG H8 . 2.790 5.340 5.184 4.766 5.526 0.186 15 0 "[ . 1 . ]" 1
1312 2 12 DC H6 2 13 DG H8 4.300 . 4.670 4.217 3.703 4.537 . 0 0 "[ . 1 . ]" 1
1313 3 1 DC H2' 3 2 DG H8 3.720 . 4.220 2.802 2.188 3.880 . 0 0 "[ . 1 . ]" 1
1314 3 1 DC H2'' 3 2 DG H8 3.590 . 3.970 2.831 2.110 3.637 . 0 0 "[ . 1 . ]" 1
1315 3 1 DC H3' 3 2 DG H8 4.430 . 4.490 4.442 3.808 5.019 0.529 7 1 "[ . + 1 . ]" 1
1316 3 1 DC H5 3 2 DG H8 5.000 2.310 5.240 5.340 4.938 5.860 0.620 8 3 "[ . -+ * . ]" 1
1317 3 1 DC Q5' 3 2 DG H8 4.850 2.370 5.350 5.079 3.946 5.685 0.335 5 0 "[ . 1 . ]" 1
1318 3 1 DC H6 3 2 DG H8 4.160 . 4.480 4.350 3.796 4.983 0.503 10 1 "[ . + . ]" 1
1319 3 2 DG H2' 3 2 DG H8 3.280 . 3.780 2.306 2.228 2.435 . 0 0 "[ . 1 . ]" 1
1320 3 2 DG H2'' 3 2 DG H8 3.390 . 3.890 3.083 2.717 3.333 . 0 0 "[ . 1 . ]" 1
1321 3 2 DG H3' 3 3 DG H8 5.230 . 5.730 4.415 4.258 4.656 . 0 0 "[ . 1 . ]" 1
1322 3 3 DG H1' 3 4 DG H8 3.700 . 4.200 3.777 3.183 4.312 0.112 9 0 "[ . 1 . ]" 1
1323 3 3 DG H2' 3 4 DG H8 3.660 . 4.160 3.059 2.673 3.523 . 0 0 "[ . 1 . ]" 1
1324 3 3 DG H2'' 3 4 DG H8 3.830 . 4.270 2.353 2.114 2.733 . 0 0 "[ . 1 . ]" 1
1325 3 3 DG H8 3 4 DG H8 4.380 . 4.680 4.457 3.967 5.404 0.724 15 1 "[ . 1 + ]" 1
1326 3 4 DG H1 3 5 DG H1 5.140 2.510 5.490 3.386 3.171 3.756 . 0 0 "[ . 1 . ]" 1
1327 3 4 DG H2' 3 4 DG H2'' 3.690 . 4.190 1.788 1.779 1.800 . 0 0 "[ . 1 . ]" 1
1328 3 4 DG H2' 3 4 DG H8 3.890 . 4.320 2.567 2.185 3.028 . 0 0 "[ . 1 . ]" 1
1329 3 4 DG H2'' 3 5 DG H8 3.920 . 4.340 2.634 2.192 3.629 . 0 0 "[ . 1 . ]" 1
1330 3 5 DG H1 3 5 DG H1' 5.860 2.760 6.160 5.889 5.840 5.958 . 0 0 "[ . 1 . ]" 1
1331 3 5 DG H1 3 6 DA H1' 5.700 2.680 6.000 5.728 5.326 6.095 0.095 16 0 "[ . 1 . ]" 1
1332 3 5 DG H1' 3 5 DG H2'' 3.840 . 4.240 2.364 2.297 2.398 . 0 0 "[ . 1 . ]" 1
1333 3 5 DG H1' 3 6 DA H8 3.740 . 4.190 3.397 3.068 3.989 . 0 0 "[ . 1 . ]" 1
1334 3 5 DG H1' 3 7 DT M7 7.210 2.480 7.710 5.708 5.357 6.269 . 0 0 "[ . 1 . ]" 1
1335 3 5 DG H2' 3 5 DG H2'' 3.820 . 4.320 1.777 1.763 1.787 . 0 0 "[ . 1 . ]" 1
1336 3 5 DG H2' 3 6 DA H8 3.970 . 4.360 3.599 3.124 3.977 . 0 0 "[ . 1 . ]" 1
1337 3 5 DG H2'' 3 6 DA H8 3.870 . 4.370 2.215 2.095 2.351 . 0 0 "[ . 1 . ]" 1
1338 3 6 DA H1' 3 6 DA H8 3.870 . 4.250 3.899 3.870 3.919 . 0 0 "[ . 1 . ]" 1
1339 3 6 DA H1' 3 7 DT H1' 4.550 . 5.010 4.611 4.084 5.250 0.240 16 0 "[ . 1 . ]" 1
1340 3 6 DA H1' 3 7 DT M7 7.210 . 7.710 4.394 3.951 4.629 . 0 0 "[ . 1 . ]" 1
1341 3 6 DA H1' 3 8 DT M7 7.210 2.520 7.710 6.173 5.692 6.468 . 0 0 "[ . 1 . ]" 1
1342 3 6 DA H2 3 7 DT H6 5.500 2.430 5.700 5.514 4.693 5.835 0.135 12 0 "[ . 1 . ]" 1
1343 3 6 DA H2' 3 6 DA H8 3.870 . 4.240 2.374 2.216 2.513 . 0 0 "[ . 1 . ]" 1
1344 3 6 DA H2'' 3 7 DT H1' 5.610 2.730 6.110 4.954 4.501 5.768 . 0 0 "[ . 1 . ]" 1
1345 3 6 DA H2'' 3 7 DT H6 4.060 . 4.560 2.472 2.280 2.998 . 0 0 "[ . 1 . ]" 1
1346 3 6 DA H2'' 3 7 DT M7 7.210 . 7.710 3.182 2.781 3.501 . 0 0 "[ . 1 . ]" 1
1347 3 6 DA H8 3 7 DT H6 4.300 . 4.470 4.571 4.210 4.886 0.416 10 0 "[ . 1 . ]" 1
1348 3 6 DA H8 3 7 DT M7 7.210 . 7.710 2.863 2.590 3.272 . 0 0 "[ . 1 . ]" 1
1349 3 6 DA H8 3 8 DT M7 7.210 2.530 7.710 6.310 5.996 6.700 . 0 0 "[ . 1 . ]" 1
1350 3 7 DT H1' 3 7 DT H2' 4.020 . 4.520 3.024 2.963 3.046 . 0 0 "[ . 1 . ]" 1
1351 3 7 DT H1' 3 7 DT H3 5.470 2.660 5.970 4.520 4.485 4.545 . 0 0 "[ . 1 . ]" 1
1352 3 7 DT H1' 3 7 DT H6 4.080 . 4.450 3.731 3.715 3.754 . 0 0 "[ . 1 . ]" 1
1353 3 7 DT H1' 3 7 DT M7 7.210 2.290 7.710 5.185 5.169 5.210 . 0 0 "[ . 1 . ]" 1
1354 3 7 DT H1' 3 8 DT H2' 5.540 2.700 6.040 5.889 5.201 6.354 0.314 7 0 "[ . 1 . ]" 1
1355 3 7 DT H1' 3 8 DT H6 4.320 . 4.750 4.300 3.788 4.664 . 0 0 "[ . 1 . ]" 1
1356 3 7 DT H1' 3 8 DT M7 7.210 . 7.710 4.494 4.317 4.739 . 0 0 "[ . 1 . ]" 1
1357 3 7 DT H2' 3 7 DT H6 4.320 . 4.630 2.520 2.186 2.764 . 0 0 "[ . 1 . ]" 1
1358 3 7 DT H2' 3 8 DT H6 4.800 2.340 5.300 3.034 2.717 3.546 . 0 0 "[ . 1 . ]" 1
1359 3 7 DT H2' 3 8 DT M7 7.210 . 7.710 2.525 2.192 3.018 . 0 0 "[ . 1 . ]" 1
1360 3 7 DT H3 3 7 DT M7 7.210 2.290 7.710 4.161 4.144 4.186 . 0 0 "[ . 1 . ]" 1
1361 3 7 DT H3 3 8 DT H3 4.640 . 5.140 3.412 3.096 3.712 . 0 0 "[ . 1 . ]" 1
1362 3 7 DT H3 3 8 DT M7 7.210 2.520 7.710 4.470 4.137 5.019 . 0 0 "[ . 1 . ]" 1
1363 3 7 DT H3' 3 8 DT H6 6.090 2.970 6.590 4.748 4.443 5.186 . 0 0 "[ . 1 . ]" 1
1364 3 7 DT H6 3 8 DT H6 4.860 . 5.060 4.951 4.687 5.365 0.305 1 0 "[ . 1 . ]" 1
1365 3 7 DT H6 3 8 DT M7 7.210 . 7.710 2.968 2.775 3.218 . 0 0 "[ . 1 . ]" 1
1366 3 7 DT M7 3 8 DT H6 7.210 2.380 7.710 5.503 5.246 5.983 . 0 0 "[ . 1 . ]" 1
1367 3 7 DT M7 3 8 DT M7 8.650 . 9.150 2.725 2.453 3.165 . 0 0 "[ . 1 . ]" 1
1368 3 8 DT H1' 3 8 DT H6 4.000 . 4.500 3.743 3.720 3.766 . 0 0 "[ . 1 . ]" 1
1369 3 8 DT H1' 3 8 DT M7 7.210 2.450 7.710 5.199 5.167 5.226 . 0 0 "[ . 1 . ]" 1
1370 3 8 DT H2' 3 8 DT H6 4.310 . 4.760 2.425 2.200 2.797 . 0 0 "[ . 1 . ]" 1
1371 3 8 DT H2' 3 9 DA H8 4.500 . 5.000 2.883 2.518 3.302 . 0 0 "[ . 1 . ]" 1
1372 3 8 DT H3 3 8 DT M7 7.210 2.720 7.710 4.149 4.133 4.169 . 0 0 "[ . 1 . ]" 1
1373 3 8 DT H3 3 9 DA H2 5.810 2.830 6.310 4.152 3.636 4.870 . 0 0 "[ . 1 . ]" 1
1374 3 8 DT H3' 3 8 DT H6 5.230 2.550 5.730 3.768 3.141 4.345 . 0 0 "[ . 1 . ]" 1
1375 3 8 DT H6 3 8 DT M7 7.210 . 7.710 2.251 2.239 2.273 . 0 0 "[ . 1 . ]" 1
1376 3 8 DT H6 3 9 DA H8 4.580 . 4.780 4.692 3.976 5.340 0.560 14 1 "[ . 1 +. ]" 1
1377 3 8 DT M7 3 9 DA H8 7.210 2.370 7.710 5.317 4.447 6.048 . 0 0 "[ . 1 . ]" 1
1378 3 9 DA H1' 3 9 DA H2'' 5.400 2.330 5.900 2.356 2.281 2.436 0.049 1 0 "[ . 1 . ]" 1
1379 3 9 DA H1' 3 10 DG H8 4.720 2.300 5.220 3.718 2.632 4.471 . 0 0 "[ . 1 . ]" 1
1380 3 9 DA H2' 3 9 DA H8 3.800 . 4.210 2.422 2.173 3.070 . 0 0 "[ . 1 . ]" 1
1381 3 9 DA H2'' 3 9 DA H3' 3.510 . 4.010 2.777 2.699 2.920 . 0 0 "[ . 1 . ]" 1
1382 3 9 DA H2'' 3 9 DA H8 3.830 . 4.270 3.750 2.962 4.407 0.137 1 0 "[ . 1 . ]" 1
1383 3 9 DA H2'' 3 10 DG H8 4.260 . 4.740 2.391 2.171 2.818 . 0 0 "[ . 1 . ]" 1
1384 3 9 DA H3' 3 9 DA H8 4.140 . 4.340 4.272 3.956 4.579 0.239 16 0 "[ . 1 . ]" 1
1385 3 9 DA H8 3 10 DG H8 4.550 . 4.850 4.708 4.161 5.520 0.670 16 1 "[ . 1 .+ ]" 1
1386 3 10 DG H1 3 11 DA H2 5.880 2.860 6.380 3.930 3.307 4.419 . 0 0 "[ . 1 . ]" 1
1387 3 10 DG H1' 3 10 DG H3' 4.880 2.380 5.380 3.807 3.666 4.014 . 0 0 "[ . 1 . ]" 1
1388 3 10 DG H1' 3 10 DG H8 4.990 2.430 5.490 3.887 3.671 3.924 . 0 0 "[ . 1 . ]" 1
1389 3 10 DG H1' 3 11 DA H8 5.860 2.860 6.360 3.810 2.854 4.958 0.006 6 0 "[ . 1 . ]" 1
1390 3 10 DG H2'' 3 10 DG H8 4.090 . 4.590 3.777 2.899 4.494 . 0 0 "[ . 1 . ]" 1
1391 3 10 DG H3' 3 10 DG H8 4.440 . 4.640 4.399 3.565 4.790 0.150 10 0 "[ . 1 . ]" 1
1392 3 11 DA H1' 3 11 DA H2'' 3.410 . 3.910 2.357 2.242 2.409 . 0 0 "[ . 1 . ]" 1
1393 3 11 DA H1' 3 11 DA H8 3.990 . 4.360 3.895 3.831 3.917 . 0 0 "[ . 1 . ]" 1
1394 3 11 DA H2 3 12 DG H1 6.190 3.020 6.690 4.773 4.172 5.456 . 0 0 "[ . 1 . ]" 1
1395 3 11 DA H2'' 3 12 DG H8 4.150 . 4.650 2.490 2.063 3.310 . 0 0 "[ . 1 . ]" 1
1396 3 12 DG H1' 3 13 DC H1' 4.880 2.380 5.380 5.110 4.347 5.926 0.546 16 1 "[ . 1 .+ ]" 1
1397 3 12 DG H1' 3 13 DC H5 4.190 2.290 4.690 4.730 4.081 5.224 0.534 4 1 "[ +. 1 . ]" 1
1398 3 12 DG H2' 3 13 DC H5 4.700 2.290 5.200 3.520 2.518 3.845 . 0 0 "[ . 1 . ]" 1
1399 3 12 DG H4' 3 13 DC H6 5.150 2.510 5.650 5.933 5.186 6.247 0.597 14 3 "[ *. 1 - +. ]" 1
1400 3 12 DG H8 3 13 DC H5 4.120 . 4.620 3.725 3.336 4.354 . 0 0 "[ . 1 . ]" 1
1401 3 12 DG H8 3 13 DC H6 4.500 . 4.800 4.753 3.910 5.659 0.859 13 2 "[ . 1 + .- ]" 1
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