NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
527876 |
2rs2   |
11450 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rs2
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 1681
_Distance_constraint_stats_list.Viol_count 155
_Distance_constraint_stats_list.Viol_total 1060.687
_Distance_constraint_stats_list.Viol_max 0.710
_Distance_constraint_stats_list.Viol_rms 0.0283
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0016
_Distance_constraint_stats_list.Viol_average_violations_only 0.3422
_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 26 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLY 11.854 0.619 4 19 "[ **+*************-**]"
1 32 GLY 15.263 0.615 4 14 "[- +*** **** **** *]"
1 33 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 TRP 0.498 0.041 20 0 "[ . 1 . 2]"
1 36 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 38 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 39 GLN 0.003 0.003 20 0 "[ . 1 . 2]"
1 40 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 41 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 52 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 MET 1.644 0.561 16 3 "[ - * 1 .+ 2]"
1 59 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 SER 0.452 0.041 20 0 "[ . 1 . 2]"
1 67 ARG 1.644 0.561 16 3 "[ - * 1 .+ 2]"
1 68 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 PHE 7.118 0.428 18 0 "[ . 1 . 2]"
1 72 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 73 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 81 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 82 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 83 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 86 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LYS 14.724 0.710 10 13 "[* *****+-* . ****]"
1 95 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 ARG 0.629 0.609 8 1 "[ . + 1 . 2]"
1 105 ARG 0.234 0.209 14 0 "[ . 1 . 2]"
1 106 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 109 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 G 14.770 0.710 10 13 "[* *****+-* . ****]"
2 2 U 27.117 0.619 4 20 [-**+****************]
2 3 A 0.000 0.000 . 0 "[ . 1 . 2]"
2 4 G 8.184 0.428 18 0 "[ . 1 . 2]"
2 5 U 0.864 0.609 8 1 "[ . + 1 . 2]"
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 26 CYS HA 1 80 VAL MG2 4.610 . 5.110 2.313 1.966 2.586 . 0 0 "[ . 1 . 2]" 1
2 1 26 CYS QB 1 73 THR MG 5.070 . 5.570 3.241 2.985 3.419 . 0 0 "[ . 1 . 2]" 1
3 1 26 CYS QB 1 74 PHE H 4.360 . 4.860 2.765 2.548 2.936 . 0 0 "[ . 1 . 2]" 1
4 1 26 CYS QB 1 74 PHE HB2 4.130 . 4.630 2.597 2.354 2.908 . 0 0 "[ . 1 . 2]" 1
5 1 26 CYS QB 1 74 PHE HB3 4.950 . 5.450 3.960 3.663 4.374 . 0 0 "[ . 1 . 2]" 1
6 1 26 CYS QB 1 77 GLN HA 4.570 . 5.070 2.856 2.351 3.307 . 0 0 "[ . 1 . 2]" 1
7 1 26 CYS QB 1 80 VAL MG2 4.430 . 4.930 2.487 2.200 3.155 . 0 0 "[ . 1 . 2]" 1
8 1 26 CYS HB2 1 73 THR MG 5.190 . 5.690 3.349 3.058 3.572 . 0 0 "[ . 1 . 2]" 1
9 1 26 CYS HB2 1 74 PHE H 4.610 . 5.110 2.913 2.575 3.238 . 0 0 "[ . 1 . 2]" 1
10 1 26 CYS HB2 1 74 PHE HB2 4.300 . 4.800 3.113 2.386 3.541 . 0 0 "[ . 1 . 2]" 1
11 1 26 CYS HB2 1 74 PHE HB3 5.160 . 5.660 4.541 3.855 4.809 . 0 0 "[ . 1 . 2]" 1
12 1 26 CYS HB2 1 77 GLN HA 4.810 . 5.310 4.088 3.365 4.582 . 0 0 "[ . 1 . 2]" 1
13 1 26 CYS HB2 1 80 VAL MG2 4.540 . 5.040 3.214 2.304 3.821 . 0 0 "[ . 1 . 2]" 1
14 1 26 CYS HB3 1 73 THR MG 5.190 . 5.690 4.330 4.173 4.369 . 0 0 "[ . 1 . 2]" 1
15 1 26 CYS HB3 1 74 PHE H 4.610 . 5.110 3.785 3.273 4.471 . 0 0 "[ . 1 . 2]" 1
16 1 26 CYS HB3 1 74 PHE HB2 4.300 . 4.800 3.184 2.408 4.020 . 0 0 "[ . 1 . 2]" 1
17 1 26 CYS HB3 1 74 PHE HB3 5.160 . 5.660 4.571 3.850 5.187 . 0 0 "[ . 1 . 2]" 1
18 1 26 CYS HB3 1 77 GLN HA 4.810 . 5.310 2.931 2.379 3.491 . 0 0 "[ . 1 . 2]" 1
19 1 26 CYS HB3 1 80 VAL MG2 4.540 . 5.040 2.870 2.435 3.790 . 0 0 "[ . 1 . 2]" 1
20 1 27 LYS H 1 27 LYS HB2 4.150 . 4.650 3.235 2.737 3.743 . 0 0 "[ . 1 . 2]" 1
21 1 27 LYS H 1 27 LYS HB3 4.150 . 4.650 3.190 2.565 3.909 . 0 0 "[ . 1 . 2]" 1
22 1 27 LYS H 1 101 ALA MB 6.610 . 7.110 4.414 3.975 5.145 . 0 0 "[ . 1 . 2]" 1
23 1 27 LYS HA 1 27 LYS QD 4.430 . 4.930 3.878 3.784 3.983 . 0 0 "[ . 1 . 2]" 1
24 1 27 LYS HA 1 27 LYS QE 5.470 . 5.970 4.399 4.222 4.747 . 0 0 "[ . 1 . 2]" 1
25 1 27 LYS HA 1 28 MET H 3.070 . 3.570 2.157 2.102 2.197 . 0 0 "[ . 1 . 2]" 1
26 1 27 LYS HA 1 28 MET HB2 4.450 . 4.950 4.283 4.207 4.355 . 0 0 "[ . 1 . 2]" 1
27 1 27 LYS HA 1 28 MET HG3 5.350 . 5.850 3.461 3.360 3.569 . 0 0 "[ . 1 . 2]" 1
28 1 27 LYS HA 1 73 THR HA 3.460 . 3.960 2.135 2.047 2.204 . 0 0 "[ . 1 . 2]" 1
29 1 27 LYS HA 1 73 THR MG 4.800 . 5.300 3.035 2.728 3.278 . 0 0 "[ . 1 . 2]" 1
30 1 27 LYS HA 1 74 PHE H 4.270 . 4.770 3.496 3.295 3.759 . 0 0 "[ . 1 . 2]" 1
31 1 27 LYS QB 1 73 THR MG 5.260 . 5.760 2.292 2.196 2.512 . 0 0 "[ . 1 . 2]" 1
32 1 27 LYS QB 1 101 ALA MB 5.190 . 5.690 2.524 2.314 2.739 . 0 0 "[ . 1 . 2]" 1
33 1 27 LYS HB2 1 28 MET H 4.630 . 5.130 4.047 3.997 4.146 . 0 0 "[ . 1 . 2]" 1
34 1 27 LYS HB2 1 101 ALA MB 5.340 . 5.840 3.965 3.828 4.120 . 0 0 "[ . 1 . 2]" 1
35 1 27 LYS HB3 1 28 MET H 4.630 . 5.130 3.910 3.851 4.010 . 0 0 "[ . 1 . 2]" 1
36 1 27 LYS HB3 1 101 ALA MB 5.340 . 5.840 2.553 2.333 2.782 . 0 0 "[ . 1 . 2]" 1
37 1 27 LYS QE 1 71 PHE HB2 4.730 . 5.230 3.539 3.306 3.933 . 0 0 "[ . 1 . 2]" 1
38 1 27 LYS QE 1 71 PHE HB3 4.500 . 5.000 2.399 2.184 2.797 . 0 0 "[ . 1 . 2]" 1
39 1 27 LYS QE 1 72 VAL H 5.480 . 5.980 3.921 3.665 4.584 . 0 0 "[ . 1 . 2]" 1
40 1 27 LYS HE2 1 27 LYS HG2 4.180 . 4.680 2.599 2.449 3.689 . 0 0 "[ . 1 . 2]" 1
41 1 27 LYS HE2 1 27 LYS HG3 4.180 . 4.680 3.062 2.338 3.732 . 0 0 "[ . 1 . 2]" 1
42 1 27 LYS HE2 1 71 PHE QD 4.860 . 5.360 2.699 2.338 4.331 . 0 0 "[ . 1 . 2]" 1
43 1 27 LYS HE3 1 27 LYS HG2 4.180 . 4.680 2.966 2.607 3.754 . 0 0 "[ . 1 . 2]" 1
44 1 27 LYS HE3 1 27 LYS HG3 4.180 . 4.680 2.410 2.238 3.522 . 0 0 "[ . 1 . 2]" 1
45 1 27 LYS HE3 1 71 PHE QD 4.860 . 5.360 3.563 3.144 4.381 . 0 0 "[ . 1 . 2]" 1
46 1 27 LYS QG 1 28 MET H 3.930 . 4.430 2.274 2.192 2.360 . 0 0 "[ . 1 . 2]" 1
47 1 27 LYS QG 1 71 PHE HA 5.460 . 5.960 4.736 4.599 4.872 . 0 0 "[ . 1 . 2]" 1
48 1 27 LYS QG 1 71 PHE HB2 5.680 . 6.180 5.004 4.864 5.087 . 0 0 "[ . 1 . 2]" 1
49 1 27 LYS QG 1 71 PHE HB3 4.860 . 5.360 3.518 3.393 3.606 . 0 0 "[ . 1 . 2]" 1
50 1 27 LYS QG 1 71 PHE QD 4.570 . 5.070 2.972 2.783 3.285 . 0 0 "[ . 1 . 2]" 1
51 1 27 LYS QG 1 72 VAL H 4.980 . 5.480 3.581 3.432 3.797 . 0 0 "[ . 1 . 2]" 1
52 1 27 LYS QG 1 73 THR HA 5.250 . 5.750 2.898 2.522 3.421 . 0 0 "[ . 1 . 2]" 1
53 1 27 LYS HG2 1 28 MET H 4.060 . 4.560 2.661 2.491 2.842 . 0 0 "[ . 1 . 2]" 1
54 1 27 LYS HG2 1 71 PHE QD 4.990 . 5.490 3.064 2.873 3.409 . 0 0 "[ . 1 . 2]" 1
55 1 27 LYS HG3 1 28 MET H 4.060 . 4.560 2.490 2.341 2.925 . 0 0 "[ . 1 . 2]" 1
56 1 27 LYS HG3 1 71 PHE QD 4.990 . 5.490 4.028 3.673 4.357 . 0 0 "[ . 1 . 2]" 1
57 1 28 MET H 1 28 MET HB2 3.630 . 4.130 2.697 2.677 2.725 . 0 0 "[ . 1 . 2]" 1
58 1 28 MET H 1 28 MET HG2 4.590 . 5.090 3.970 3.878 4.048 . 0 0 "[ . 1 . 2]" 1
59 1 28 MET H 1 28 MET HG3 3.930 . 4.430 3.065 2.993 3.127 . 0 0 "[ . 1 . 2]" 1
60 1 28 MET H 1 29 PHE H 4.620 . 5.120 4.347 4.323 4.361 . 0 0 "[ . 1 . 2]" 1
61 1 28 MET H 1 30 ILE MD 5.900 . 6.400 4.250 4.030 4.363 . 0 0 "[ . 1 . 2]" 1
62 1 28 MET H 1 71 PHE HA 5.020 . 5.520 4.762 4.691 4.859 . 0 0 "[ . 1 . 2]" 1
63 1 28 MET H 1 72 VAL H 3.880 . 4.380 3.024 2.974 3.100 . 0 0 "[ . 1 . 2]" 1
64 1 28 MET H 1 72 VAL HB 4.690 . 5.190 4.250 4.057 4.412 . 0 0 "[ . 1 . 2]" 1
65 1 28 MET H 1 72 VAL MG1 6.560 . 7.060 4.553 4.394 4.680 . 0 0 "[ . 1 . 2]" 1
66 1 28 MET H 1 73 THR HA 3.890 . 4.390 3.449 3.317 3.531 . 0 0 "[ . 1 . 2]" 1
67 1 28 MET H 1 101 ALA MB 5.550 . 6.050 3.230 3.184 3.303 . 0 0 "[ . 1 . 2]" 1
68 1 28 MET HA 1 28 MET ME 4.760 . 5.260 3.700 3.635 3.750 . 0 0 "[ . 1 . 2]" 1
69 1 28 MET HA 1 28 MET HG2 3.700 . 4.200 2.454 2.429 2.484 . 0 0 "[ . 1 . 2]" 1
70 1 28 MET HA 1 28 MET HG3 3.890 . 4.390 3.160 3.117 3.202 . 0 0 "[ . 1 . 2]" 1
71 1 28 MET HA 1 29 PHE H 3.290 . 3.790 2.101 2.087 2.120 . 0 0 "[ . 1 . 2]" 1
72 1 28 MET HA 1 100 VAL HA 3.340 . 3.840 2.734 2.646 2.859 . 0 0 "[ . 1 . 2]" 1
73 1 28 MET HA 1 100 VAL MG1 6.610 . 7.110 4.222 4.139 4.343 . 0 0 "[ . 1 . 2]" 1
74 1 28 MET HA 1 100 VAL QG 6.310 . 6.810 3.910 3.831 4.025 . 0 0 "[ . 1 . 2]" 1
75 1 28 MET HA 1 100 VAL MG2 6.610 . 7.110 4.616 4.518 4.757 . 0 0 "[ . 1 . 2]" 1
76 1 28 MET HA 1 101 ALA H 3.620 . 4.120 2.397 2.321 2.515 . 0 0 "[ . 1 . 2]" 1
77 1 28 MET HA 1 101 ALA MB 4.710 . 5.210 2.527 2.461 2.631 . 0 0 "[ . 1 . 2]" 1
78 1 28 MET HB2 1 29 PHE H 4.630 . 5.130 4.028 3.999 4.055 . 0 0 "[ . 1 . 2]" 1
79 1 28 MET HB2 1 30 ILE MD 4.490 . 4.990 2.511 2.377 2.609 . 0 0 "[ . 1 . 2]" 1
80 1 28 MET HB2 1 72 VAL H 4.430 . 4.930 3.520 3.408 3.659 . 0 0 "[ . 1 . 2]" 1
81 1 28 MET HB2 1 72 VAL HB 3.920 . 4.420 3.264 3.166 3.327 . 0 0 "[ . 1 . 2]" 1
82 1 28 MET HB2 1 72 VAL MG2 6.390 . 6.890 4.642 4.547 4.733 . 0 0 "[ . 1 . 2]" 1
83 1 28 MET HB3 1 28 MET ME 3.570 . 4.070 2.303 2.267 2.338 . 0 0 "[ . 1 . 2]" 1
84 1 28 MET HB3 1 29 PHE H 4.030 . 4.530 2.980 2.933 3.045 . 0 0 "[ . 1 . 2]" 1
85 1 28 MET HB3 1 30 ILE MD 4.300 . 4.800 2.688 2.605 2.737 . 0 0 "[ . 1 . 2]" 1
86 1 28 MET HB3 1 30 ILE HG12 5.410 . 5.910 4.725 4.635 4.816 . 0 0 "[ . 1 . 2]" 1
87 1 28 MET HB3 1 72 VAL HB 4.800 . 5.300 4.745 4.625 4.810 . 0 0 "[ . 1 . 2]" 1
88 1 28 MET HB3 1 83 VAL MG1 5.780 . 6.280 4.158 3.948 4.296 . 0 0 "[ . 1 . 2]" 1
89 1 28 MET HB3 1 99 LYS H 4.840 . 5.340 3.062 3.016 3.181 . 0 0 "[ . 1 . 2]" 1
90 1 28 MET HB3 1 100 VAL HA 4.480 . 4.980 4.079 3.981 4.193 . 0 0 "[ . 1 . 2]" 1
91 1 28 MET ME 1 30 ILE MD 5.730 . 6.230 3.522 3.407 3.629 . 0 0 "[ . 1 . 2]" 1
92 1 28 MET ME 1 46 PHE QE 6.740 . 7.240 4.683 4.579 4.802 . 0 0 "[ . 1 . 2]" 1
93 1 28 MET ME 1 74 PHE QE 6.230 . 6.730 4.339 4.183 4.556 . 0 0 "[ . 1 . 2]" 1
94 1 28 MET ME 1 80 VAL HA 4.920 . 5.420 3.818 3.678 3.916 . 0 0 "[ . 1 . 2]" 1
95 1 28 MET ME 1 80 VAL MG1 4.380 . 4.880 2.837 2.683 2.967 . 0 0 "[ . 1 . 2]" 1
96 1 28 MET ME 1 80 VAL MG2 5.970 . 6.470 4.057 3.835 4.149 . 0 0 "[ . 1 . 2]" 1
97 1 28 MET ME 1 83 VAL H 5.800 . 6.300 4.554 4.452 4.678 . 0 0 "[ . 1 . 2]" 1
98 1 28 MET ME 1 83 VAL HA 5.970 . 6.470 4.615 4.520 4.776 . 0 0 "[ . 1 . 2]" 1
99 1 28 MET ME 1 83 VAL HB 4.020 . 4.520 2.592 2.513 2.688 . 0 0 "[ . 1 . 2]" 1
100 1 28 MET ME 1 83 VAL MG1 4.100 . 4.600 2.089 2.056 2.125 . 0 0 "[ . 1 . 2]" 1
101 1 28 MET ME 1 84 LEU H 4.790 . 5.290 3.575 3.488 3.750 . 0 0 "[ . 1 . 2]" 1
102 1 28 MET ME 1 84 LEU HA 5.190 . 5.690 3.691 3.576 3.850 . 0 0 "[ . 1 . 2]" 1
103 1 28 MET ME 1 84 LEU MD1 5.440 . 5.940 3.456 3.362 3.550 . 0 0 "[ . 1 . 2]" 1
104 1 28 MET ME 1 84 LEU MD2 3.620 . 4.120 2.028 1.989 2.096 . 0 0 "[ . 1 . 2]" 1
105 1 28 MET ME 1 98 PRO HA 5.370 . 5.870 3.936 3.732 4.117 . 0 0 "[ . 1 . 2]" 1
106 1 28 MET ME 1 99 LYS H 4.550 . 5.050 2.872 2.790 3.071 . 0 0 "[ . 1 . 2]" 1
107 1 28 MET ME 1 99 LYS HA 4.600 . 5.100 2.670 2.538 3.312 . 0 0 "[ . 1 . 2]" 1
108 1 28 MET ME 1 100 VAL H 4.790 . 5.290 3.439 3.355 3.741 . 0 0 "[ . 1 . 2]" 1
109 1 28 MET ME 1 100 VAL HA 4.550 . 5.050 3.223 3.155 3.293 . 0 0 "[ . 1 . 2]" 1
110 1 28 MET ME 1 100 VAL QG 5.200 . 5.700 3.058 2.941 3.213 . 0 0 "[ . 1 . 2]" 1
111 1 28 MET ME 1 101 ALA H 5.800 . 6.300 4.827 4.763 4.841 . 0 0 "[ . 1 . 2]" 1
112 1 28 MET HG2 1 29 PHE H 4.740 . 5.240 4.157 4.110 4.225 . 0 0 "[ . 1 . 2]" 1
113 1 28 MET HG2 1 74 PHE QD 6.170 . 6.670 5.110 4.954 5.303 . 0 0 "[ . 1 . 2]" 1
114 1 28 MET HG2 1 74 PHE QE 6.170 . 6.670 4.575 4.232 5.153 . 0 0 "[ . 1 . 2]" 1
115 1 28 MET HG2 1 80 VAL MG1 4.600 . 5.100 2.804 2.573 3.063 . 0 0 "[ . 1 . 2]" 1
116 1 28 MET HG2 1 80 VAL MG2 4.530 . 5.030 3.437 3.287 3.530 . 0 0 "[ . 1 . 2]" 1
117 1 28 MET HG2 1 100 VAL HA 3.810 . 4.310 2.530 2.364 2.776 . 0 0 "[ . 1 . 2]" 1
118 1 28 MET HG2 1 100 VAL MG1 6.020 . 6.520 4.076 3.901 4.237 . 0 0 "[ . 1 . 2]" 1
119 1 28 MET HG2 1 100 VAL QG 5.550 . 6.050 3.297 3.166 3.501 . 0 0 "[ . 1 . 2]" 1
120 1 28 MET HG2 1 100 VAL MG2 6.020 . 6.520 3.483 3.323 3.732 . 0 0 "[ . 1 . 2]" 1
121 1 28 MET HG2 1 101 ALA MB 5.840 . 6.340 4.451 4.380 4.503 . 0 0 "[ . 1 . 2]" 1
122 1 28 MET HG3 1 29 PHE H 5.450 . 5.950 5.017 4.979 5.072 . 0 0 "[ . 1 . 2]" 1
123 1 28 MET HG3 1 30 ILE MD 6.350 . 6.850 4.528 4.397 4.623 . 0 0 "[ . 1 . 2]" 1
124 1 28 MET HG3 1 74 PHE H 5.500 . 6.000 5.271 4.756 5.508 . 0 0 "[ . 1 . 2]" 1
125 1 28 MET HG3 1 74 PHE QD 4.710 . 5.210 3.432 3.272 3.657 . 0 0 "[ . 1 . 2]" 1
126 1 28 MET HG3 1 74 PHE QE 5.010 . 5.510 3.216 2.743 3.998 . 0 0 "[ . 1 . 2]" 1
127 1 28 MET HG3 1 80 VAL MG1 4.790 . 5.290 3.012 2.833 3.293 . 0 0 "[ . 1 . 2]" 1
128 1 28 MET HG3 1 80 VAL MG2 4.140 . 4.640 2.369 2.255 2.517 . 0 0 "[ . 1 . 2]" 1
129 1 28 MET HG3 1 100 VAL HA 4.430 . 4.930 4.083 3.876 4.379 . 0 0 "[ . 1 . 2]" 1
130 1 28 MET HG3 1 100 VAL MG1 6.610 . 7.110 5.025 4.745 5.296 . 0 0 "[ . 1 . 2]" 1
131 1 28 MET HG3 1 100 VAL QG 6.520 . 7.020 4.341 4.150 4.615 . 0 0 "[ . 1 . 2]" 1
132 1 28 MET HG3 1 100 VAL MG2 6.610 . 7.110 4.749 4.568 5.080 . 0 0 "[ . 1 . 2]" 1
133 1 28 MET HG3 1 101 ALA MB 5.600 . 6.100 4.698 4.689 4.706 . 0 0 "[ . 1 . 2]" 1
134 1 29 PHE H 1 29 PHE HB2 4.020 . 4.520 2.946 2.878 3.017 . 0 0 "[ . 1 . 2]" 1
135 1 29 PHE H 1 29 PHE HB3 3.670 . 4.170 2.240 2.209 2.263 . 0 0 "[ . 1 . 2]" 1
136 1 29 PHE H 1 71 PHE QD 6.170 . 6.670 4.242 4.079 4.435 . 0 0 "[ . 1 . 2]" 1
137 1 29 PHE H 1 99 LYS H 4.370 . 4.870 3.303 3.204 3.368 . 0 0 "[ . 1 . 2]" 1
138 1 29 PHE H 1 100 VAL HA 4.560 . 5.060 3.897 3.825 4.021 . 0 0 "[ . 1 . 2]" 1
139 1 29 PHE H 1 101 ALA H 4.380 . 4.880 3.590 3.517 3.706 . 0 0 "[ . 1 . 2]" 1
140 1 29 PHE H 1 101 ALA MB 5.000 . 5.500 2.852 2.652 3.093 . 0 0 "[ . 1 . 2]" 1
141 1 29 PHE HA 1 30 ILE H 3.320 . 3.820 2.229 2.196 2.267 . 0 0 "[ . 1 . 2]" 1
142 1 29 PHE HA 1 30 ILE MD 5.870 . 6.370 3.904 3.803 3.992 . 0 0 "[ . 1 . 2]" 1
143 1 29 PHE HA 1 30 ILE HG12 4.930 . 5.430 3.491 3.453 3.537 . 0 0 "[ . 1 . 2]" 1
144 1 29 PHE HA 1 71 PHE HA 3.890 . 4.390 2.552 2.479 2.629 . 0 0 "[ . 1 . 2]" 1
145 1 29 PHE HA 1 71 PHE QD 4.490 . 4.990 2.880 2.604 3.021 . 0 0 "[ . 1 . 2]" 1
146 1 29 PHE HA 1 71 PHE QE 5.460 . 5.960 3.627 3.442 3.844 . 0 0 "[ . 1 . 2]" 1
147 1 29 PHE HA 1 72 VAL H 4.890 . 5.390 3.938 3.868 4.024 . 0 0 "[ . 1 . 2]" 1
148 1 29 PHE HA 1 101 ALA MB 5.180 . 5.680 3.808 3.575 4.114 . 0 0 "[ . 1 . 2]" 1
149 1 29 PHE QB 2 3 A H1' 6.170 . 6.670 5.410 4.803 5.539 . 0 0 "[ . 1 . 2]" 1
150 1 29 PHE HB2 1 30 ILE H 4.820 . 5.320 4.094 4.037 4.137 . 0 0 "[ . 1 . 2]" 1
151 1 29 PHE HB2 1 71 PHE QD 6.060 . 6.560 3.602 3.367 3.697 . 0 0 "[ . 1 . 2]" 1
152 1 29 PHE HB2 1 71 PHE QE 5.280 . 5.780 2.686 2.425 2.849 . 0 0 "[ . 1 . 2]" 1
153 1 29 PHE HB2 1 71 PHE HZ 5.500 . 6.000 3.847 3.628 4.116 . 0 0 "[ . 1 . 2]" 1
154 1 29 PHE HB2 1 101 ALA MB 5.090 . 5.590 3.371 3.139 3.617 . 0 0 "[ . 1 . 2]" 1
155 1 29 PHE HB3 1 30 ILE H 5.060 . 5.560 4.251 4.212 4.330 . 0 0 "[ . 1 . 2]" 1
156 1 29 PHE HB3 1 99 LYS H 4.870 . 5.370 3.850 3.620 3.941 . 0 0 "[ . 1 . 2]" 1
157 1 29 PHE HB3 1 99 LYS QB 5.990 . 6.490 4.534 2.502 4.794 . 0 0 "[ . 1 . 2]" 1
158 1 29 PHE HB3 1 99 LYS QD 5.990 . 6.490 3.687 3.336 4.792 . 0 0 "[ . 1 . 2]" 1
159 1 29 PHE HB3 1 99 LYS QG 4.980 . 5.480 2.614 2.345 4.250 . 0 0 "[ . 1 . 2]" 1
160 1 29 PHE HB3 1 101 ALA MB 5.380 . 5.880 3.931 3.700 4.178 . 0 0 "[ . 1 . 2]" 1
161 1 29 PHE HZ 1 31 GLY HA2 4.710 . 5.210 3.512 3.358 3.669 . 0 0 "[ . 1 . 2]" 1
162 1 29 PHE HZ 1 31 GLY HA3 4.710 . 5.210 3.773 3.515 3.971 . 0 0 "[ . 1 . 2]" 1
163 1 29 PHE HZ 1 69 PHE HB2 4.670 . 5.170 3.033 2.863 3.199 . 0 0 "[ . 1 . 2]" 1
164 1 29 PHE HZ 1 69 PHE HB3 4.710 . 5.210 3.246 3.131 3.449 . 0 0 "[ . 1 . 2]" 1
165 1 29 PHE HZ 2 2 U H4' 4.500 . 5.000 3.775 3.481 4.478 . 0 0 "[ . 1 . 2]" 1
166 1 29 PHE HZ 2 3 A H8 4.500 . 5.000 3.858 3.628 4.127 . 0 0 "[ . 1 . 2]" 1
167 1 30 ILE H 1 30 ILE HB 3.900 . 4.400 2.786 2.723 2.837 . 0 0 "[ . 1 . 2]" 1
168 1 30 ILE H 1 30 ILE MD 5.080 . 5.580 3.487 3.388 3.562 . 0 0 "[ . 1 . 2]" 1
169 1 30 ILE H 1 30 ILE HG12 4.060 . 4.560 2.644 2.573 2.688 . 0 0 "[ . 1 . 2]" 1
170 1 30 ILE H 1 30 ILE HG13 4.350 . 4.850 4.063 4.005 4.100 . 0 0 "[ . 1 . 2]" 1
171 1 30 ILE H 1 70 GLY H 4.210 . 4.710 3.047 2.998 3.128 . 0 0 "[ . 1 . 2]" 1
172 1 30 ILE H 1 71 PHE HA 4.270 . 4.770 2.927 2.844 2.984 . 0 0 "[ . 1 . 2]" 1
173 1 30 ILE H 1 71 PHE QD 5.530 . 6.030 4.398 4.248 4.454 . 0 0 "[ . 1 . 2]" 1
174 1 30 ILE HA 1 30 ILE MD 4.200 . 4.700 2.445 2.373 2.488 . 0 0 "[ . 1 . 2]" 1
175 1 30 ILE HA 1 31 GLY H 3.540 . 4.040 2.222 2.200 2.237 . 0 0 "[ . 1 . 2]" 1
176 1 30 ILE HA 1 98 PRO HA 3.440 . 3.940 2.208 2.157 2.246 . 0 0 "[ . 1 . 2]" 1
177 1 30 ILE HA 1 98 PRO HB2 4.220 . 4.720 4.088 3.821 4.238 . 0 0 "[ . 1 . 2]" 1
178 1 30 ILE HA 1 98 PRO HB3 4.480 . 4.980 2.803 2.528 3.045 . 0 0 "[ . 1 . 2]" 1
179 1 30 ILE HA 1 99 LYS H 4.400 . 4.900 3.644 3.580 3.723 . 0 0 "[ . 1 . 2]" 1
180 1 30 ILE HB 1 33 LEU MD1 4.790 . 5.290 2.814 2.694 2.906 . 0 0 "[ . 1 . 2]" 1
181 1 30 ILE HB 1 33 LEU MD2 4.790 . 5.290 3.324 3.167 3.471 . 0 0 "[ . 1 . 2]" 1
182 1 30 ILE HB 1 42 LEU MD1 5.330 . 5.830 3.059 2.938 3.174 . 0 0 "[ . 1 . 2]" 1
183 1 30 ILE HB 1 70 GLY H 4.130 . 4.630 2.803 2.729 2.866 . 0 0 "[ . 1 . 2]" 1
184 1 30 ILE HB 1 71 PHE H 4.820 . 5.320 4.204 4.102 4.275 . 0 0 "[ . 1 . 2]" 1
185 1 30 ILE HB 1 71 PHE HA 5.220 . 5.720 4.040 3.990 4.140 . 0 0 "[ . 1 . 2]" 1
186 1 30 ILE MD 1 31 GLY H 5.270 . 5.770 4.341 4.254 4.395 . 0 0 "[ . 1 . 2]" 1
187 1 30 ILE MD 1 42 LEU MD1 6.840 . 7.340 3.866 3.785 3.935 . 0 0 "[ . 1 . 2]" 1
188 1 30 ILE MD 1 46 PHE QD 6.350 . 6.850 3.891 3.839 3.951 . 0 0 "[ . 1 . 2]" 1
189 1 30 ILE MD 1 46 PHE QE 4.890 . 5.390 2.908 2.850 2.975 . 0 0 "[ . 1 . 2]" 1
190 1 30 ILE MD 1 46 PHE HZ 4.340 . 4.840 2.569 2.508 2.620 . 0 0 "[ . 1 . 2]" 1
191 1 30 ILE MD 1 71 PHE HA 5.120 . 5.620 3.655 3.578 3.724 . 0 0 "[ . 1 . 2]" 1
192 1 30 ILE MD 1 72 VAL H 4.740 . 5.240 3.108 2.960 3.236 . 0 0 "[ . 1 . 2]" 1
193 1 30 ILE MD 1 72 VAL HB 3.660 . 4.160 2.286 2.234 2.324 . 0 0 "[ . 1 . 2]" 1
194 1 30 ILE MD 1 72 VAL MG2 4.860 . 5.360 2.796 2.689 2.886 . 0 0 "[ . 1 . 2]" 1
195 1 30 ILE MD 1 98 PRO HA 4.140 . 4.640 2.974 2.717 3.186 . 0 0 "[ . 1 . 2]" 1
196 1 30 ILE MD 1 98 PRO HB2 4.050 . 4.550 2.799 2.693 3.018 . 0 0 "[ . 1 . 2]" 1
197 1 30 ILE MD 1 98 PRO HB3 4.020 . 4.520 2.151 2.113 2.185 . 0 0 "[ . 1 . 2]" 1
198 1 30 ILE MD 1 98 PRO HG2 5.430 . 5.930 4.398 4.330 4.465 . 0 0 "[ . 1 . 2]" 1
199 1 30 ILE MD 1 98 PRO HG3 5.150 . 5.650 3.733 3.600 3.901 . 0 0 "[ . 1 . 2]" 1
200 1 30 ILE MD 1 99 LYS H 5.060 . 5.560 3.313 3.211 3.403 . 0 0 "[ . 1 . 2]" 1
201 1 30 ILE HG12 1 33 LEU QD 6.280 . 6.780 4.400 4.304 4.480 . 0 0 "[ . 1 . 2]" 1
202 1 30 ILE HG12 1 46 PHE QE 5.390 . 5.890 4.687 4.606 4.804 . 0 0 "[ . 1 . 2]" 1
203 1 30 ILE HG12 1 71 PHE H 4.570 . 5.070 3.857 3.780 3.904 . 0 0 "[ . 1 . 2]" 1
204 1 30 ILE HG12 1 71 PHE HA 4.000 . 4.500 2.342 2.280 2.442 . 0 0 "[ . 1 . 2]" 1
205 1 30 ILE HG12 1 72 VAL H 4.540 . 5.040 3.013 2.913 3.129 . 0 0 "[ . 1 . 2]" 1
206 1 30 ILE HG12 1 72 VAL MG2 4.500 . 5.000 2.909 2.734 3.001 . 0 0 "[ . 1 . 2]" 1
207 1 30 ILE HG13 1 46 PHE QD 5.100 . 5.600 4.166 4.074 4.254 . 0 0 "[ . 1 . 2]" 1
208 1 30 ILE HG13 1 46 PHE QE 3.690 . 4.190 3.097 2.985 3.245 . 0 0 "[ . 1 . 2]" 1
209 1 30 ILE HG13 1 46 PHE HZ 4.230 . 4.730 4.227 4.151 4.245 . 0 0 "[ . 1 . 2]" 1
210 1 30 ILE HG13 1 56 LEU H 5.500 . 6.000 5.515 5.464 5.536 . 0 0 "[ . 1 . 2]" 1
211 1 30 ILE HG13 1 70 GLY HA3 4.770 . 5.270 4.745 4.566 4.787 . 0 0 "[ . 1 . 2]" 1
212 1 30 ILE HG13 1 71 PHE H 4.910 . 5.410 4.391 4.323 4.449 . 0 0 "[ . 1 . 2]" 1
213 1 30 ILE HG13 1 71 PHE HA 4.430 . 4.930 3.843 3.767 3.955 . 0 0 "[ . 1 . 2]" 1
214 1 30 ILE HG13 1 72 VAL HB 4.340 . 4.840 3.472 3.350 3.551 . 0 0 "[ . 1 . 2]" 1
215 1 30 ILE HG13 1 72 VAL MG2 3.820 . 4.320 2.160 2.080 2.238 . 0 0 "[ . 1 . 2]" 1
216 1 30 ILE HG13 1 98 PRO HB3 4.870 . 5.370 4.416 4.380 4.555 . 0 0 "[ . 1 . 2]" 1
217 1 30 ILE MG 1 31 GLY H 4.700 . 5.200 3.332 3.209 3.431 . 0 0 "[ . 1 . 2]" 1
218 1 30 ILE MG 1 33 LEU QD 4.790 . 5.290 1.972 1.943 2.029 . 0 0 "[ . 1 . 2]" 1
219 1 30 ILE MG 1 33 LEU HG 4.420 . 4.920 2.945 2.737 3.039 . 0 0 "[ . 1 . 2]" 1
220 1 30 ILE MG 1 46 PHE QD 6.090 . 6.590 4.148 4.048 4.266 . 0 0 "[ . 1 . 2]" 1
221 1 30 ILE MG 1 46 PHE QE 4.110 . 4.610 2.229 2.183 2.295 . 0 0 "[ . 1 . 2]" 1
222 1 30 ILE MG 1 46 PHE HZ 4.040 . 4.540 2.496 2.426 2.588 . 0 0 "[ . 1 . 2]" 1
223 1 30 ILE MG 1 69 PHE HA 5.190 . 5.690 4.317 4.245 4.338 . 0 0 "[ . 1 . 2]" 1
224 1 30 ILE MG 1 70 GLY H 5.670 . 6.170 3.996 3.906 4.044 . 0 0 "[ . 1 . 2]" 1
225 1 30 ILE MG 1 70 GLY HA3 5.800 . 6.300 4.736 4.565 4.836 . 0 0 "[ . 1 . 2]" 1
226 1 30 ILE MG 1 72 VAL HB 5.970 . 6.470 4.964 4.888 4.986 . 0 0 "[ . 1 . 2]" 1
227 1 30 ILE MG 1 96 ILE HB 4.740 . 5.240 2.883 2.789 3.062 . 0 0 "[ . 1 . 2]" 1
228 1 30 ILE MG 1 97 ASP H 5.450 . 5.950 3.920 3.702 4.168 . 0 0 "[ . 1 . 2]" 1
229 1 30 ILE MG 1 98 PRO HA 4.580 . 5.080 3.396 3.209 3.545 . 0 0 "[ . 1 . 2]" 1
230 1 30 ILE MG 1 98 PRO HB2 5.730 . 6.230 3.906 3.833 4.132 . 0 0 "[ . 1 . 2]" 1
231 1 30 ILE MG 1 98 PRO HB3 4.050 . 4.550 2.291 2.227 2.501 . 0 0 "[ . 1 . 2]" 1
232 1 30 ILE MG 1 98 PRO HD3 4.940 . 5.440 3.782 3.394 4.064 . 0 0 "[ . 1 . 2]" 1
233 1 30 ILE MG 1 98 PRO HG3 6.040 . 6.540 3.412 3.278 3.525 . 0 0 "[ . 1 . 2]" 1
234 1 30 ILE MG 1 99 LYS H 6.610 . 7.110 4.934 4.833 5.005 . 0 0 "[ . 1 . 2]" 1
235 1 31 GLY H 1 33 LEU QD 6.440 . 6.940 4.599 4.537 4.706 . 0 0 "[ . 1 . 2]" 1
236 1 31 GLY H 1 97 ASP H 4.670 . 5.170 3.431 3.244 3.739 . 0 0 "[ . 1 . 2]" 1
237 1 31 GLY H 1 97 ASP QB 5.470 . 5.970 3.738 3.378 4.146 . 0 0 "[ . 1 . 2]" 1
238 1 31 GLY H 1 98 PRO HA 4.580 . 5.080 2.847 2.513 3.075 . 0 0 "[ . 1 . 2]" 1
239 1 31 GLY H 2 2 U H1' 5.500 . 6.000 4.961 4.853 5.170 . 0 0 "[ . 1 . 2]" 1
240 1 31 GLY QA 1 32 GLY QA 5.620 . 6.120 3.584 3.570 3.611 . 0 0 "[ . 1 . 2]" 1
241 1 31 GLY QA 1 69 PHE HA 4.970 . 5.470 2.865 2.811 2.959 . 0 0 "[ . 1 . 2]" 1
242 1 31 GLY QA 1 69 PHE HB2 5.480 . 5.980 2.580 2.375 2.792 . 0 0 "[ . 1 . 2]" 1
243 1 31 GLY QA 1 69 PHE HB3 5.570 . 6.070 2.817 2.721 3.073 . 0 0 "[ . 1 . 2]" 1
244 1 31 GLY QA 2 2 U H1' 6.170 . 6.670 2.647 2.550 2.772 . 0 0 "[ . 1 . 2]" 1
245 1 31 GLY QA 2 2 U H2' 112.250 5.500 112.750 4.907 4.881 5.050 0.619 4 19 "[ **+*************-**]" 1
246 1 32 GLY H 1 33 LEU H 3.740 . 4.240 2.684 2.608 2.737 . 0 0 "[ . 1 . 2]" 1
247 1 32 GLY H 2 2 U H1' 5.500 . 6.000 3.461 3.370 3.636 . 0 0 "[ . 1 . 2]" 1
248 1 32 GLY H 2 2 U H6 4.500 . 5.000 2.995 2.870 3.204 . 0 0 "[ . 1 . 2]" 1
249 1 32 GLY QA 1 68 GLY QA 5.830 . 6.330 4.001 3.837 4.141 . 0 0 "[ . 1 . 2]" 1
250 1 32 GLY QA 2 2 U H1' 112.250 5.500 112.750 4.954 4.885 5.102 0.615 4 14 "[- +*** **** **** *]" 1
251 1 32 GLY QA 2 2 U H2' 112.250 5.500 112.750 5.288 5.076 5.594 0.424 19 0 "[ . 1 . 2]" 1
252 1 32 GLY QA 2 2 U H5 5.050 . 5.550 3.074 2.838 3.570 . 0 0 "[ . 1 . 2]" 1
253 1 32 GLY QA 2 2 U H6 5.050 . 5.550 2.941 2.766 3.108 . 0 0 "[ . 1 . 2]" 1
254 1 33 LEU H 1 33 LEU QB 3.550 . 4.050 2.457 2.438 2.488 . 0 0 "[ . 1 . 2]" 1
255 1 33 LEU H 1 33 LEU MD1 4.670 . 5.170 3.741 3.698 3.784 . 0 0 "[ . 1 . 2]" 1
256 1 33 LEU H 1 33 LEU QD 4.480 . 4.980 3.061 3.025 3.111 . 0 0 "[ . 1 . 2]" 1
257 1 33 LEU H 1 33 LEU MD2 4.670 . 5.170 3.250 3.204 3.320 . 0 0 "[ . 1 . 2]" 1
258 1 33 LEU H 1 33 LEU HG 3.070 . 3.570 2.374 2.313 2.437 . 0 0 "[ . 1 . 2]" 1
259 1 33 LEU H 1 34 SER H 4.640 . 5.140 4.647 4.634 4.661 . 0 0 "[ . 1 . 2]" 1
260 1 33 LEU H 1 68 GLY HA2 4.560 . 5.060 3.347 3.207 3.457 . 0 0 "[ . 1 . 2]" 1
261 1 33 LEU H 1 68 GLY QA 4.430 . 4.930 3.139 2.993 3.234 . 0 0 "[ . 1 . 2]" 1
262 1 33 LEU H 1 68 GLY HA3 4.560 . 5.060 3.803 3.566 4.039 . 0 0 "[ . 1 . 2]" 1
263 1 33 LEU H 1 69 PHE HA 4.010 . 4.510 3.238 3.099 3.353 . 0 0 "[ . 1 . 2]" 1
264 1 33 LEU H 1 96 ILE MG 5.270 . 5.770 3.823 3.682 3.942 . 0 0 "[ . 1 . 2]" 1
265 1 33 LEU H 2 2 U H2' 100.000 5.500 100.500 7.132 6.981 7.247 . 0 0 "[ . 1 . 2]" 1
266 1 33 LEU HA 1 34 SER H 3.100 . 3.600 2.395 2.304 2.450 . 0 0 "[ . 1 . 2]" 1
267 1 33 LEU HA 1 37 THR MG 5.340 . 5.840 4.036 3.953 4.175 . 0 0 "[ . 1 . 2]" 1
268 1 33 LEU HA 1 94 LYS HB3 4.560 . 5.060 4.044 3.716 4.338 . 0 0 "[ . 1 . 2]" 1
269 1 33 LEU HA 1 96 ILE MG 4.070 . 4.570 2.309 2.200 2.405 . 0 0 "[ . 1 . 2]" 1
270 1 33 LEU QB 1 34 SER H 4.410 . 4.910 2.314 2.218 2.446 . 0 0 "[ . 1 . 2]" 1
271 1 33 LEU QB 1 37 THR HB 4.290 . 4.790 2.433 2.329 2.774 . 0 0 "[ . 1 . 2]" 1
272 1 33 LEU QB 1 68 GLY QA 5.000 . 5.500 2.527 2.359 2.698 . 0 0 "[ . 1 . 2]" 1
273 1 33 LEU QB 1 69 PHE HA 5.340 . 5.840 3.171 3.054 3.309 . 0 0 "[ . 1 . 2]" 1
274 1 33 LEU HB2 1 34 SER H 4.760 . 5.260 3.553 3.449 3.676 . 0 0 "[ . 1 . 2]" 1
275 1 33 LEU HB2 1 37 THR HB 4.520 . 5.020 3.769 3.642 4.033 . 0 0 "[ . 1 . 2]" 1
276 1 33 LEU HB3 1 34 SER H 4.760 . 5.260 2.345 2.245 2.483 . 0 0 "[ . 1 . 2]" 1
277 1 33 LEU HB3 1 37 THR HB 4.520 . 5.020 2.465 2.354 2.827 . 0 0 "[ . 1 . 2]" 1
278 1 33 LEU QD 1 34 SER H 5.720 . 6.220 3.228 3.154 3.291 . 0 0 "[ . 1 . 2]" 1
279 1 33 LEU QD 1 37 THR HB 5.420 . 5.920 2.754 2.602 2.883 . 0 0 "[ . 1 . 2]" 1
280 1 33 LEU QD 1 42 LEU MD2 6.100 . 6.600 1.890 1.856 1.932 . 0 0 "[ . 1 . 2]" 1
281 1 33 LEU QD 1 57 VAL HA 5.860 . 6.360 3.761 3.577 3.962 . 0 0 "[ . 1 . 2]" 1
282 1 33 LEU QD 1 69 PHE H 5.510 . 6.010 3.268 3.158 3.392 . 0 0 "[ . 1 . 2]" 1
283 1 33 LEU QD 1 69 PHE HA 4.880 . 5.380 2.533 2.428 2.630 . 0 0 "[ . 1 . 2]" 1
284 1 33 LEU QD 1 70 GLY H 5.660 . 6.160 2.792 2.735 2.833 . 0 0 "[ . 1 . 2]" 1
285 1 33 LEU QD 1 70 GLY HA2 5.970 . 6.470 3.834 3.711 3.943 . 0 0 "[ . 1 . 2]" 1
286 1 33 LEU QD 1 70 GLY HA3 5.690 . 6.190 2.794 2.678 2.932 . 0 0 "[ . 1 . 2]" 1
287 1 33 LEU QD 1 96 ILE HA 6.740 . 7.240 3.946 3.803 4.144 . 0 0 "[ . 1 . 2]" 1
288 1 33 LEU QD 1 96 ILE HB 5.490 . 5.990 2.617 2.475 2.828 . 0 0 "[ . 1 . 2]" 1
289 1 33 LEU QD 1 96 ILE MG 4.710 . 5.210 1.996 1.969 2.020 . 0 0 "[ . 1 . 2]" 1
290 1 33 LEU QD 1 97 ASP H 7.270 . 7.770 4.289 4.109 4.487 . 0 0 "[ . 1 . 2]" 1
291 1 33 LEU MD1 1 37 THR HB 6.180 . 6.680 2.840 2.649 2.990 . 0 0 "[ . 1 . 2]" 1
292 1 33 LEU MD1 1 37 THR MG 5.080 . 5.580 2.264 2.219 2.380 . 0 0 "[ . 1 . 2]" 1
293 1 33 LEU MD1 1 42 LEU MD2 6.760 . 7.260 2.110 2.073 2.169 . 0 0 "[ . 1 . 2]" 1
294 1 33 LEU MD1 1 69 PHE HA 5.540 . 6.040 2.559 2.449 2.657 . 0 0 "[ . 1 . 2]" 1
295 1 33 LEU MD2 1 37 THR HB 6.180 . 6.680 3.721 3.590 3.925 . 0 0 "[ . 1 . 2]" 1
296 1 33 LEU MD2 1 37 THR MG 5.080 . 5.580 2.184 2.153 2.241 . 0 0 "[ . 1 . 2]" 1
297 1 33 LEU MD2 1 42 LEU MD2 6.760 . 7.260 2.134 2.086 2.195 . 0 0 "[ . 1 . 2]" 1
298 1 33 LEU MD2 1 69 PHE HA 5.540 . 6.040 4.061 3.957 4.213 . 0 0 "[ . 1 . 2]" 1
299 1 33 LEU HG 1 69 PHE HA 3.740 . 4.240 2.448 2.301 2.623 . 0 0 "[ . 1 . 2]" 1
300 1 33 LEU HG 1 96 ILE MD 5.640 . 6.140 4.741 4.728 4.748 . 0 0 "[ . 1 . 2]" 1
301 1 33 LEU HG 1 96 ILE MG 5.090 . 5.590 3.897 3.826 3.970 . 0 0 "[ . 1 . 2]" 1
302 1 34 SER H 1 34 SER HB2 4.170 . 4.670 2.733 2.477 2.886 . 0 0 "[ . 1 . 2]" 1
303 1 34 SER H 1 34 SER HB3 4.170 . 4.670 2.458 2.313 2.695 . 0 0 "[ . 1 . 2]" 1
304 1 34 SER H 1 94 LYS HB2 4.690 . 5.190 3.764 3.548 3.979 . 0 0 "[ . 1 . 2]" 1
305 1 34 SER H 1 96 ILE MG 5.330 . 5.830 3.945 3.718 4.117 . 0 0 "[ . 1 . 2]" 1
306 1 34 SER H 2 1 G H8 5.500 . 6.000 4.848 4.743 4.998 . 0 0 "[ . 1 . 2]" 1
307 1 34 SER HA 1 35 TRP QB 5.190 . 5.690 4.439 4.346 4.555 . 0 0 "[ . 1 . 2]" 1
308 1 34 SER HA 1 36 GLN H 4.340 . 4.840 3.809 3.706 4.074 . 0 0 "[ . 1 . 2]" 1
309 1 34 SER HA 1 94 LYS QD 5.160 . 5.660 3.695 3.149 4.390 . 0 0 "[ . 1 . 2]" 1
310 1 34 SER HA 1 94 LYS HG3 4.660 . 5.160 2.776 2.586 3.058 . 0 0 "[ . 1 . 2]" 1
311 1 34 SER HA 2 1 G H8 4.500 . 5.000 2.570 2.391 2.817 . 0 0 "[ . 1 . 2]" 1
312 1 34 SER QB 1 36 GLN QB 6.270 . 6.770 3.616 2.939 4.986 . 0 0 "[ . 1 . 2]" 1
313 1 34 SER QB 1 37 THR H 4.890 . 5.390 2.770 2.476 3.342 . 0 0 "[ . 1 . 2]" 1
314 1 34 SER QB 1 92 ASP QB 4.810 . 5.310 2.204 2.101 2.669 . 0 0 "[ . 1 . 2]" 1
315 1 34 SER QB 1 94 LYS H 5.990 . 6.490 4.286 4.160 4.521 . 0 0 "[ . 1 . 2]" 1
316 1 34 SER QB 1 94 LYS HB2 4.550 . 5.050 2.679 2.502 2.957 . 0 0 "[ . 1 . 2]" 1
317 1 34 SER QB 1 94 LYS HB3 5.010 . 5.510 3.802 3.582 4.172 . 0 0 "[ . 1 . 2]" 1
318 1 34 SER QB 1 94 LYS HG2 4.700 . 5.200 3.522 3.107 3.825 . 0 0 "[ . 1 . 2]" 1
319 1 34 SER QB 1 94 LYS HG3 4.590 . 5.090 2.340 2.120 2.749 . 0 0 "[ . 1 . 2]" 1
320 1 34 SER HB2 1 37 THR H 5.240 . 5.740 4.458 4.186 5.033 . 0 0 "[ . 1 . 2]" 1
321 1 34 SER HB2 1 92 ASP HB2 4.950 . 5.450 4.027 2.598 4.965 . 0 0 "[ . 1 . 2]" 1
322 1 34 SER HB2 1 92 ASP HB3 4.950 . 5.450 2.512 2.277 3.270 . 0 0 "[ . 1 . 2]" 1
323 1 34 SER HB2 1 94 LYS HG3 4.930 . 5.430 2.356 2.133 2.776 . 0 0 "[ . 1 . 2]" 1
324 1 34 SER HB3 1 37 THR H 5.240 . 5.740 2.798 2.494 3.393 . 0 0 "[ . 1 . 2]" 1
325 1 34 SER HB3 1 92 ASP HB2 4.950 . 5.450 3.562 2.416 4.282 . 0 0 "[ . 1 . 2]" 1
326 1 34 SER HB3 1 92 ASP HB3 4.950 . 5.450 2.618 2.391 3.049 . 0 0 "[ . 1 . 2]" 1
327 1 34 SER HB3 1 94 LYS HG3 4.930 . 5.430 4.014 3.716 4.427 . 0 0 "[ . 1 . 2]" 1
328 1 35 TRP H 1 35 TRP HD1 4.650 . 5.150 3.185 2.907 3.697 . 0 0 "[ . 1 . 2]" 1
329 1 35 TRP H 1 35 TRP HE3 5.500 . 6.000 4.902 4.317 5.359 . 0 0 "[ . 1 . 2]" 1
330 1 35 TRP H 1 36 GLN H 4.110 . 4.610 2.774 2.658 2.921 . 0 0 "[ . 1 . 2]" 1
331 1 35 TRP H 1 94 LYS HG3 4.670 . 5.170 4.614 4.465 4.690 . 0 0 "[ . 1 . 2]" 1
332 1 35 TRP H 2 1 G H8 4.500 . 5.000 2.976 2.721 3.114 . 0 0 "[ . 1 . 2]" 1
333 1 35 TRP HA 1 35 TRP HD1 2.500 . 3.000 2.295 2.163 2.492 . 0 0 "[ . 1 . 2]" 1
334 1 35 TRP HA 1 66 SER HB2 4.700 . 5.200 4.099 4.026 4.212 . 0 0 "[ . 1 . 2]" 1
335 1 35 TRP HA 1 66 SER QB 4.490 . 4.990 2.882 2.723 3.091 . 0 0 "[ . 1 . 2]" 1
336 1 35 TRP HA 1 66 SER HB3 4.700 . 5.200 2.945 2.769 3.181 . 0 0 "[ . 1 . 2]" 1
337 1 35 TRP HA 2 1 G H8 5.500 . 6.000 4.542 3.724 5.013 . 0 0 "[ . 1 . 2]" 1
338 1 35 TRP QB 1 36 GLN H 5.260 . 5.760 3.246 3.099 3.397 . 0 0 "[ . 1 . 2]" 1
339 1 35 TRP QB 1 36 GLN HA 6.170 . 6.670 4.329 4.222 4.445 . 0 0 "[ . 1 . 2]" 1
340 1 35 TRP QB 1 66 SER QB 5.670 . 6.170 4.519 4.480 4.535 . 0 0 "[ . 1 . 2]" 1
341 1 35 TRP QB 2 1 G H8 5.050 . 5.550 4.506 4.204 4.549 . 0 0 "[ . 1 . 2]" 1
342 1 35 TRP HD1 1 66 SER HA 100.000 5.500 100.500 5.489 5.459 5.633 0.041 20 0 "[ . 1 . 2]" 1
343 1 35 TRP HD1 1 66 SER QB 6.170 . 6.670 4.181 3.986 4.466 . 0 0 "[ . 1 . 2]" 1
344 1 35 TRP HD1 1 68 GLY H 4.960 . 5.460 2.837 2.531 3.158 . 0 0 "[ . 1 . 2]" 1
345 1 35 TRP HD1 1 68 GLY QA 5.970 . 6.470 3.211 3.021 3.464 . 0 0 "[ . 1 . 2]" 1
346 1 35 TRP HD1 2 1 G H8 4.500 . 5.000 3.209 3.118 3.339 . 0 0 "[ . 1 . 2]" 1
347 1 35 TRP HE1 2 1 G H1' 4.500 . 5.000 3.010 2.757 3.217 . 0 0 "[ . 1 . 2]" 1
348 1 35 TRP HE1 2 1 G H2' 4.500 . 5.000 3.404 3.048 3.799 . 0 0 "[ . 1 . 2]" 1
349 1 35 TRP HE1 2 1 G H4' 100.000 5.000 100.500 5.744 5.358 6.012 . 0 0 "[ . 1 . 2]" 1
350 1 35 TRP HE1 2 1 G H8 4.500 . 5.000 3.940 3.578 4.249 . 0 0 "[ . 1 . 2]" 1
351 1 35 TRP HH2 2 1 G H8 100.000 5.500 100.500 7.611 6.860 8.234 . 0 0 "[ . 1 . 2]" 1
352 1 35 TRP HZ2 2 1 G H1' 4.000 . 4.500 3.489 2.864 3.960 . 0 0 "[ . 1 . 2]" 1
353 1 35 TRP HZ2 2 1 G H4' 100.000 5.500 100.500 6.451 5.598 7.316 . 0 0 "[ . 1 . 2]" 1
354 1 35 TRP HZ2 2 1 G H8 100.000 5.500 100.500 6.048 5.473 6.560 0.027 1 0 "[ . 1 . 2]" 1
355 1 35 TRP HZ3 2 1 G H4' 100.000 5.500 100.500 9.700 8.954 10.559 . 0 0 "[ . 1 . 2]" 1
356 1 35 TRP HZ3 2 1 G H8 100.000 5.500 100.500 7.741 6.896 8.394 . 0 0 "[ . 1 . 2]" 1
357 1 36 GLN H 1 36 GLN QG 4.510 . 5.010 2.667 2.089 4.002 . 0 0 "[ . 1 . 2]" 1
358 1 36 GLN H 1 37 THR H 3.730 . 4.230 2.426 2.309 2.490 . 0 0 "[ . 1 . 2]" 1
359 1 36 GLN H 1 37 THR HA 5.500 . 6.000 4.837 4.690 4.960 . 0 0 "[ . 1 . 2]" 1
360 1 36 GLN H 1 37 THR HB 4.890 . 5.390 4.802 4.634 4.918 . 0 0 "[ . 1 . 2]" 1
361 1 36 GLN HA 1 36 GLN HG2 4.130 . 4.630 3.060 2.484 3.812 . 0 0 "[ . 1 . 2]" 1
362 1 36 GLN HA 1 36 GLN HG3 4.130 . 4.630 3.391 2.581 3.817 . 0 0 "[ . 1 . 2]" 1
363 1 37 THR H 1 37 THR HB 3.200 . 3.700 2.537 2.476 2.654 . 0 0 "[ . 1 . 2]" 1
364 1 37 THR H 1 38 THR H 4.820 . 5.320 4.628 4.596 4.663 . 0 0 "[ . 1 . 2]" 1
365 1 37 THR HA 1 38 THR H 2.730 . 3.230 2.189 2.154 2.241 . 0 0 "[ . 1 . 2]" 1
366 1 37 THR HA 1 38 THR MG 4.880 . 5.380 3.655 3.588 3.717 . 0 0 "[ . 1 . 2]" 1
367 1 37 THR HA 1 57 VAL MG2 6.610 . 7.110 4.841 4.621 4.956 . 0 0 "[ . 1 . 2]" 1
368 1 37 THR HA 1 91 LEU MD2 6.610 . 7.110 4.439 4.239 5.036 . 0 0 "[ . 1 . 2]" 1
369 1 37 THR HB 1 38 THR H 4.490 . 4.990 4.019 3.882 4.162 . 0 0 "[ . 1 . 2]" 1
370 1 37 THR HB 1 57 VAL MG2 6.610 . 7.110 3.688 3.273 3.892 . 0 0 "[ . 1 . 2]" 1
371 1 37 THR MG 1 38 THR H 3.760 . 4.260 2.426 2.346 2.603 . 0 0 "[ . 1 . 2]" 1
372 1 37 THR MG 1 41 GLY H 5.640 . 6.140 4.389 4.291 4.483 . 0 0 "[ . 1 . 2]" 1
373 1 37 THR MG 1 41 GLY HA3 5.680 . 6.180 3.451 3.292 3.575 . 0 0 "[ . 1 . 2]" 1
374 1 37 THR MG 1 42 LEU H 4.800 . 5.300 3.533 3.431 3.657 . 0 0 "[ . 1 . 2]" 1
375 1 37 THR MG 1 42 LEU HA 4.950 . 5.450 4.040 3.964 4.126 . 0 0 "[ . 1 . 2]" 1
376 1 37 THR MG 1 42 LEU MD1 5.380 . 5.880 3.558 3.481 3.666 . 0 0 "[ . 1 . 2]" 1
377 1 37 THR MG 1 42 LEU MD2 4.900 . 5.400 2.064 2.029 2.130 . 0 0 "[ . 1 . 2]" 1
378 1 37 THR MG 1 42 LEU HG 3.860 . 4.360 2.911 2.831 3.043 . 0 0 "[ . 1 . 2]" 1
379 1 37 THR MG 1 57 VAL MG2 5.180 . 5.680 2.617 2.358 2.814 . 0 0 "[ . 1 . 2]" 1
380 1 37 THR MG 1 91 LEU MD2 4.100 . 4.600 2.253 2.173 2.576 . 0 0 "[ . 1 . 2]" 1
381 1 37 THR MG 1 91 LEU HG 4.310 . 4.810 3.058 2.885 3.195 . 0 0 "[ . 1 . 2]" 1
382 1 38 THR H 1 38 THR HG1 4.640 . 5.140 3.549 3.438 3.622 . 0 0 "[ . 1 . 2]" 1
383 1 38 THR H 1 38 THR MG 3.710 . 4.210 2.818 2.680 2.893 . 0 0 "[ . 1 . 2]" 1
384 1 38 THR H 1 41 GLY H 4.030 . 4.530 3.461 3.297 3.620 . 0 0 "[ . 1 . 2]" 1
385 1 38 THR H 1 57 VAL MG2 5.680 . 6.180 3.889 3.715 4.072 . 0 0 "[ . 1 . 2]" 1
386 1 38 THR HA 1 39 GLN H 2.920 . 3.420 2.365 2.327 2.409 . 0 0 "[ . 1 . 2]" 1
387 1 38 THR HA 1 39 GLN HA 4.730 . 5.230 4.370 4.359 4.387 . 0 0 "[ . 1 . 2]" 1
388 1 38 THR HA 1 40 GLU H 4.360 . 4.860 4.230 4.139 4.315 . 0 0 "[ . 1 . 2]" 1
389 1 38 THR HA 1 57 VAL MG2 4.730 . 5.230 2.652 2.535 2.812 . 0 0 "[ . 1 . 2]" 1
390 1 38 THR HB 1 39 GLN H 3.480 . 3.980 2.511 2.450 2.572 . 0 0 "[ . 1 . 2]" 1
391 1 38 THR HB 1 40 GLU H 3.660 . 4.160 2.779 2.692 2.850 . 0 0 "[ . 1 . 2]" 1
392 1 38 THR HG1 1 40 GLU H 4.260 . 4.760 3.520 3.327 3.792 . 0 0 "[ . 1 . 2]" 1
393 1 38 THR HG1 1 41 GLY H 4.550 . 5.050 2.793 2.743 2.841 . 0 0 "[ . 1 . 2]" 1
394 1 38 THR MG 1 39 GLN H 4.660 . 5.160 3.813 3.752 3.863 . 0 0 "[ . 1 . 2]" 1
395 1 38 THR MG 1 40 GLU H 5.240 . 5.740 4.307 4.240 4.371 . 0 0 "[ . 1 . 2]" 1
396 1 38 THR MG 1 40 GLU QB 6.090 . 6.590 4.242 4.156 4.315 . 0 0 "[ . 1 . 2]" 1
397 1 38 THR MG 1 41 GLY H 5.570 . 6.070 4.130 4.076 4.170 . 0 0 "[ . 1 . 2]" 1
398 1 38 THR MG 1 57 VAL MG2 6.450 . 6.950 4.380 4.308 4.474 . 0 0 "[ . 1 . 2]" 1
399 1 39 GLN H 1 39 GLN HB2 3.620 . 4.120 3.621 3.610 3.629 . 0 0 "[ . 1 . 2]" 1
400 1 39 GLN H 1 39 GLN HB3 3.050 . 3.550 2.770 2.732 2.889 . 0 0 "[ . 1 . 2]" 1
401 1 39 GLN H 1 39 GLN QG 3.890 . 4.390 1.858 1.797 1.954 0.003 20 0 "[ . 1 . 2]" 1
402 1 39 GLN H 1 40 GLU H 3.410 . 3.910 2.678 2.582 2.738 . 0 0 "[ . 1 . 2]" 1
403 1 39 GLN H 1 41 GLY H 4.550 . 5.050 4.078 3.962 4.123 . 0 0 "[ . 1 . 2]" 1
404 1 39 GLN H 1 42 LEU H 5.500 . 6.000 4.600 4.548 4.663 . 0 0 "[ . 1 . 2]" 1
405 1 39 GLN H 1 57 VAL H 5.500 . 6.000 4.625 4.494 4.936 . 0 0 "[ . 1 . 2]" 1
406 1 39 GLN H 1 57 VAL HB 4.360 . 4.860 3.180 2.929 3.366 . 0 0 "[ . 1 . 2]" 1
407 1 39 GLN H 1 57 VAL MG2 4.420 . 4.920 2.830 2.751 2.980 . 0 0 "[ . 1 . 2]" 1
408 1 39 GLN HA 1 41 GLY H 4.180 . 4.680 4.109 4.046 4.189 . 0 0 "[ . 1 . 2]" 1
409 1 39 GLN HA 1 42 LEU H 3.900 . 4.400 2.881 2.808 3.018 . 0 0 "[ . 1 . 2]" 1
410 1 39 GLN HA 1 42 LEU HB2 3.410 . 3.910 2.619 2.531 2.766 . 0 0 "[ . 1 . 2]" 1
411 1 39 GLN HA 1 42 LEU HB3 4.990 . 5.490 4.131 4.043 4.261 . 0 0 "[ . 1 . 2]" 1
412 1 39 GLN HA 1 42 LEU MD1 4.650 . 5.150 2.769 2.682 2.861 . 0 0 "[ . 1 . 2]" 1
413 1 39 GLN HA 1 42 LEU MD2 4.960 . 5.460 3.949 3.891 4.066 . 0 0 "[ . 1 . 2]" 1
414 1 39 GLN HA 1 42 LEU HG 3.710 . 4.210 2.245 2.172 2.378 . 0 0 "[ . 1 . 2]" 1
415 1 39 GLN HA 1 55 CYS QB 4.710 . 5.210 3.365 3.074 3.508 . 0 0 "[ . 1 . 2]" 1
416 1 39 GLN HA 1 56 LEU H 5.500 . 6.000 4.397 4.279 4.479 . 0 0 "[ . 1 . 2]" 1
417 1 39 GLN HA 1 57 VAL MG2 3.550 . 4.050 2.365 2.307 2.432 . 0 0 "[ . 1 . 2]" 1
418 1 39 GLN HB2 1 39 GLN HE22 4.840 . 5.340 4.363 4.310 4.403 . 0 0 "[ . 1 . 2]" 1
419 1 39 GLN HB2 1 40 GLU H 4.090 . 4.590 3.971 3.858 4.030 . 0 0 "[ . 1 . 2]" 1
420 1 39 GLN HB2 1 55 CYS QB 4.440 . 4.940 2.746 2.361 3.111 . 0 0 "[ . 1 . 2]" 1
421 1 39 GLN HB2 1 56 LEU QD 7.330 . 7.830 4.379 4.234 4.510 . 0 0 "[ . 1 . 2]" 1
422 1 39 GLN HB2 1 57 VAL H 5.150 . 5.650 4.149 3.926 4.554 . 0 0 "[ . 1 . 2]" 1
423 1 39 GLN HB2 1 57 VAL MG2 4.760 . 5.260 3.624 3.560 3.810 . 0 0 "[ . 1 . 2]" 1
424 1 39 GLN HB3 1 40 GLU H 4.270 . 4.770 4.302 4.277 4.320 . 0 0 "[ . 1 . 2]" 1
425 1 39 GLN HB3 1 55 CYS QB 4.650 . 5.150 3.908 3.596 4.144 . 0 0 "[ . 1 . 2]" 1
426 1 39 GLN HB3 1 57 VAL H 3.770 . 4.270 2.768 2.617 3.072 . 0 0 "[ . 1 . 2]" 1
427 1 39 GLN HB3 1 57 VAL MG2 4.650 . 5.150 2.284 2.215 2.536 . 0 0 "[ . 1 . 2]" 1
428 1 39 GLN QE 1 56 LEU QD 6.820 . 7.320 2.657 2.372 3.020 . 0 0 "[ . 1 . 2]" 1
429 1 39 GLN QE 1 57 VAL H 5.240 . 5.740 3.722 3.009 3.911 . 0 0 "[ . 1 . 2]" 1
430 1 39 GLN QG 1 40 GLU H 4.010 . 4.510 2.744 2.441 2.870 . 0 0 "[ . 1 . 2]" 1
431 1 39 GLN QG 1 40 GLU HA 5.110 . 5.610 4.278 4.029 4.416 . 0 0 "[ . 1 . 2]" 1
432 1 39 GLN QG 1 56 LEU HA 5.510 . 6.010 3.952 3.858 4.209 . 0 0 "[ . 1 . 2]" 1
433 1 39 GLN QG 1 56 LEU QD 8.030 . 8.530 4.511 4.325 4.829 . 0 0 "[ . 1 . 2]" 1
434 1 39 GLN QG 1 57 VAL H 4.960 . 5.460 3.890 3.744 4.306 . 0 0 "[ . 1 . 2]" 1
435 1 39 GLN QG 1 57 VAL HB 4.430 . 4.930 3.599 3.394 3.732 . 0 0 "[ . 1 . 2]" 1
436 1 39 GLN QG 1 57 VAL MG1 6.610 . 7.110 4.851 4.677 4.925 . 0 0 "[ . 1 . 2]" 1
437 1 39 GLN QG 1 57 VAL MG2 4.850 . 5.350 3.626 3.618 3.633 . 0 0 "[ . 1 . 2]" 1
438 1 40 GLU H 1 40 GLU HB2 3.680 . 4.180 2.470 2.444 2.642 . 0 0 "[ . 1 . 2]" 1
439 1 40 GLU H 1 40 GLU QB 3.180 . 3.680 2.431 2.407 2.579 . 0 0 "[ . 1 . 2]" 1
440 1 40 GLU H 1 40 GLU HB3 3.680 . 4.180 3.627 3.606 3.637 . 0 0 "[ . 1 . 2]" 1
441 1 40 GLU H 1 40 GLU HG2 4.130 . 4.630 3.556 2.410 3.801 . 0 0 "[ . 1 . 2]" 1
442 1 40 GLU H 1 40 GLU QG 4.040 . 4.540 2.446 2.383 2.751 . 0 0 "[ . 1 . 2]" 1
443 1 40 GLU H 1 40 GLU HG3 4.130 . 4.630 2.554 2.424 3.752 . 0 0 "[ . 1 . 2]" 1
444 1 40 GLU H 1 41 GLY H 3.220 . 3.720 2.537 2.487 2.687 . 0 0 "[ . 1 . 2]" 1
445 1 40 GLU HA 1 40 GLU HG2 3.780 . 4.280 2.616 2.471 3.581 . 0 0 "[ . 1 . 2]" 1
446 1 40 GLU HA 1 40 GLU QG 3.480 . 3.980 2.420 2.375 2.992 . 0 0 "[ . 1 . 2]" 1
447 1 40 GLU HA 1 40 GLU HG3 3.780 . 4.280 3.061 2.546 3.786 . 0 0 "[ . 1 . 2]" 1
448 1 40 GLU HA 1 42 LEU HB2 5.500 . 6.000 5.078 5.024 5.199 . 0 0 "[ . 1 . 2]" 1
449 1 40 GLU HA 1 43 ARG H 4.230 . 4.730 3.367 3.313 3.464 . 0 0 "[ . 1 . 2]" 1
450 1 40 GLU HA 1 43 ARG QB 4.280 . 4.780 2.701 2.590 2.892 . 0 0 "[ . 1 . 2]" 1
451 1 40 GLU HA 1 43 ARG HD2 5.200 . 5.700 4.532 4.326 4.815 . 0 0 "[ . 1 . 2]" 1
452 1 40 GLU HA 1 43 ARG HD3 5.500 . 6.000 4.054 3.720 4.405 . 0 0 "[ . 1 . 2]" 1
453 1 40 GLU QB 1 41 GLY H 3.890 . 4.390 2.700 2.619 2.739 . 0 0 "[ . 1 . 2]" 1
454 1 40 GLU HB2 1 41 GLY H 4.060 . 4.560 2.768 2.668 2.812 . 0 0 "[ . 1 . 2]" 1
455 1 40 GLU HB3 1 41 GLY H 4.060 . 4.560 3.754 3.710 3.831 . 0 0 "[ . 1 . 2]" 1
456 1 40 GLU QG 1 41 GLY H 5.170 . 5.670 4.210 4.134 4.411 . 0 0 "[ . 1 . 2]" 1
457 1 41 GLY H 1 42 LEU H 3.130 . 3.630 2.680 2.659 2.709 . 0 0 "[ . 1 . 2]" 1
458 1 41 GLY H 1 42 LEU MD2 6.000 . 6.500 4.998 4.974 5.006 . 0 0 "[ . 1 . 2]" 1
459 1 41 GLY H 1 42 LEU HG 4.860 . 5.360 4.627 4.590 4.692 . 0 0 "[ . 1 . 2]" 1
460 1 41 GLY HA2 1 44 GLU H 4.000 . 4.500 3.270 3.234 3.320 . 0 0 "[ . 1 . 2]" 1
461 1 41 GLY HA2 1 44 GLU HB2 3.650 . 4.150 2.456 2.447 2.466 . 0 0 "[ . 1 . 2]" 1
462 1 41 GLY HA2 1 44 GLU HB3 3.870 . 4.370 2.856 2.783 2.977 . 0 0 "[ . 1 . 2]" 1
463 1 41 GLY HA2 1 44 GLU HG2 5.240 . 5.740 5.012 4.955 5.084 . 0 0 "[ . 1 . 2]" 1
464 1 41 GLY HA2 1 44 GLU QG 5.040 . 5.540 4.315 4.283 4.347 . 0 0 "[ . 1 . 2]" 1
465 1 41 GLY HA2 1 44 GLU HG3 5.240 . 5.740 4.709 4.687 4.726 . 0 0 "[ . 1 . 2]" 1
466 1 41 GLY HA2 1 45 TYR H 5.110 . 5.610 4.296 4.213 4.410 . 0 0 "[ . 1 . 2]" 1
467 1 41 GLY HA2 1 91 LEU MD1 5.750 . 6.250 3.849 3.663 4.102 . 0 0 "[ . 1 . 2]" 1
468 1 41 GLY HA3 1 44 GLU H 4.650 . 5.150 4.573 4.538 4.620 . 0 0 "[ . 1 . 2]" 1
469 1 41 GLY HA3 1 44 GLU HB2 4.200 . 4.700 4.211 4.204 4.218 . 0 0 "[ . 1 . 2]" 1
470 1 41 GLY HA3 1 44 GLU HB3 5.130 . 5.630 4.356 4.286 4.460 . 0 0 "[ . 1 . 2]" 1
471 1 41 GLY HA3 1 45 TYR H 5.500 . 6.000 5.194 5.095 5.319 . 0 0 "[ . 1 . 2]" 1
472 1 42 LEU H 1 42 LEU HB2 3.460 . 3.960 2.669 2.653 2.693 . 0 0 "[ . 1 . 2]" 1
473 1 42 LEU H 1 42 LEU HB3 3.680 . 4.180 3.678 3.670 3.685 . 0 0 "[ . 1 . 2]" 1
474 1 42 LEU H 1 42 LEU MD1 5.330 . 5.830 3.923 3.899 3.954 . 0 0 "[ . 1 . 2]" 1
475 1 42 LEU H 1 42 LEU MD2 3.550 . 4.050 2.975 2.969 2.979 . 0 0 "[ . 1 . 2]" 1
476 1 42 LEU H 1 42 LEU HG 4.090 . 4.590 2.440 2.413 2.481 . 0 0 "[ . 1 . 2]" 1
477 1 42 LEU H 1 43 ARG H 3.490 . 3.990 2.903 2.855 2.940 . 0 0 "[ . 1 . 2]" 1
478 1 42 LEU H 1 43 ARG QB 5.290 . 5.790 4.580 4.509 4.639 . 0 0 "[ . 1 . 2]" 1
479 1 42 LEU H 1 57 VAL MG2 5.330 . 5.830 4.063 3.950 4.154 . 0 0 "[ . 1 . 2]" 1
480 1 42 LEU H 1 91 LEU MD2 5.980 . 6.480 3.679 3.583 3.859 . 0 0 "[ . 1 . 2]" 1
481 1 42 LEU HA 1 42 LEU MD2 4.260 . 4.760 2.163 2.142 2.185 . 0 0 "[ . 1 . 2]" 1
482 1 42 LEU HA 1 42 LEU HG 3.510 . 4.010 3.403 3.388 3.416 . 0 0 "[ . 1 . 2]" 1
483 1 42 LEU HA 1 44 GLU H 4.360 . 4.860 4.415 4.404 4.425 . 0 0 "[ . 1 . 2]" 1
484 1 42 LEU HA 1 45 TYR H 4.190 . 4.690 3.396 3.286 3.458 . 0 0 "[ . 1 . 2]" 1
485 1 42 LEU HA 1 45 TYR HB2 5.030 . 5.530 4.001 3.782 4.101 . 0 0 "[ . 1 . 2]" 1
486 1 42 LEU HA 1 45 TYR HB3 3.910 . 4.410 3.036 2.851 3.126 . 0 0 "[ . 1 . 2]" 1
487 1 42 LEU HA 1 46 PHE H 4.570 . 5.070 3.866 3.818 3.943 . 0 0 "[ . 1 . 2]" 1
488 1 42 LEU HA 1 46 PHE QD 4.380 . 4.880 2.884 2.730 3.028 . 0 0 "[ . 1 . 2]" 1
489 1 42 LEU HA 1 46 PHE QE 5.310 . 5.810 3.648 3.558 3.765 . 0 0 "[ . 1 . 2]" 1
490 1 42 LEU HA 1 91 LEU MD1 5.040 . 5.540 4.204 4.168 4.213 . 0 0 "[ . 1 . 2]" 1
491 1 42 LEU HA 1 91 LEU MD2 3.940 . 4.440 2.589 2.460 2.698 . 0 0 "[ . 1 . 2]" 1
492 1 42 LEU HB2 1 43 ARG H 3.140 . 3.640 2.509 2.472 2.572 . 0 0 "[ . 1 . 2]" 1
493 1 42 LEU HB2 1 44 GLU H 5.130 . 5.630 5.047 5.025 5.083 . 0 0 "[ . 1 . 2]" 1
494 1 42 LEU HB2 1 46 PHE QD 4.960 . 5.460 3.891 3.826 4.003 . 0 0 "[ . 1 . 2]" 1
495 1 42 LEU HB2 1 55 CYS QB 4.130 . 4.630 2.646 2.528 2.751 . 0 0 "[ . 1 . 2]" 1
496 1 42 LEU HB2 1 72 VAL MG1 5.740 . 6.240 4.789 4.781 4.799 . 0 0 "[ . 1 . 2]" 1
497 1 42 LEU HB2 1 72 VAL MG2 5.010 . 5.510 3.051 3.007 3.127 . 0 0 "[ . 1 . 2]" 1
498 1 42 LEU HB3 1 43 ARG H 3.930 . 4.430 3.552 3.509 3.590 . 0 0 "[ . 1 . 2]" 1
499 1 42 LEU HB3 1 46 PHE QD 4.120 . 4.620 2.354 2.302 2.450 . 0 0 "[ . 1 . 2]" 1
500 1 42 LEU HB3 1 55 CYS QB 4.650 . 5.150 3.653 3.451 3.925 . 0 0 "[ . 1 . 2]" 1
501 1 42 LEU HB3 1 72 VAL MG2 4.200 . 4.700 2.284 2.232 2.325 . 0 0 "[ . 1 . 2]" 1
502 1 42 LEU MD1 1 46 PHE QD 5.450 . 5.950 3.839 3.758 3.890 . 0 0 "[ . 1 . 2]" 1
503 1 42 LEU MD1 1 46 PHE QE 5.500 . 6.000 3.549 3.317 3.729 . 0 0 "[ . 1 . 2]" 1
504 1 42 LEU MD1 1 55 CYS QB 5.840 . 6.340 3.101 2.966 3.316 . 0 0 "[ . 1 . 2]" 1
505 1 42 LEU MD1 1 56 LEU H 5.280 . 5.780 2.774 2.668 2.894 . 0 0 "[ . 1 . 2]" 1
506 1 42 LEU MD1 1 70 GLY HA3 5.210 . 5.710 2.576 2.423 2.696 . 0 0 "[ . 1 . 2]" 1
507 1 42 LEU MD1 1 71 PHE H 5.240 . 5.740 2.905 2.808 3.027 . 0 0 "[ . 1 . 2]" 1
508 1 42 LEU MD1 1 72 VAL MG1 7.240 . 7.740 4.399 4.342 4.489 . 0 0 "[ . 1 . 2]" 1
509 1 42 LEU MD2 1 45 TYR HB3 6.580 . 7.080 4.093 3.888 4.201 . 0 0 "[ . 1 . 2]" 1
510 1 42 LEU MD2 1 46 PHE QD 5.780 . 6.280 3.308 3.190 3.448 . 0 0 "[ . 1 . 2]" 1
511 1 42 LEU MD2 1 55 CYS QB 7.410 . 7.910 5.009 4.884 5.176 . 0 0 "[ . 1 . 2]" 1
512 1 42 LEU MD2 1 57 VAL MG2 5.180 . 5.680 3.048 2.933 3.135 . 0 0 "[ . 1 . 2]" 1
513 1 42 LEU MD2 1 72 VAL MG2 6.070 . 6.570 3.492 3.398 3.590 . 0 0 "[ . 1 . 2]" 1
514 1 42 LEU MD2 1 91 LEU MD2 6.130 . 6.630 2.057 2.020 2.086 . 0 0 "[ . 1 . 2]" 1
515 1 42 LEU HG 1 43 ARG H 4.740 . 5.240 4.366 4.310 4.424 . 0 0 "[ . 1 . 2]" 1
516 1 42 LEU HG 1 55 CYS QB 4.940 . 5.440 4.397 4.246 4.421 . 0 0 "[ . 1 . 2]" 1
517 1 42 LEU HG 1 56 LEU H 5.500 . 6.000 5.144 5.009 5.259 . 0 0 "[ . 1 . 2]" 1
518 1 43 ARG H 1 43 ARG QB 3.100 . 3.600 2.242 2.203 2.268 . 0 0 "[ . 1 . 2]" 1
519 1 43 ARG H 1 43 ARG HD2 4.890 . 5.390 4.808 4.734 4.921 . 0 0 "[ . 1 . 2]" 1
520 1 43 ARG H 1 43 ARG HD3 5.050 . 5.550 4.962 4.761 5.039 . 0 0 "[ . 1 . 2]" 1
521 1 43 ARG H 1 43 ARG HG3 4.580 . 5.080 4.480 4.444 4.516 . 0 0 "[ . 1 . 2]" 1
522 1 43 ARG H 1 52 VAL MG2 5.440 . 5.940 4.269 4.096 4.492 . 0 0 "[ . 1 . 2]" 1
523 1 43 ARG H 1 55 CYS QB 4.770 . 5.270 3.428 3.300 3.616 . 0 0 "[ . 1 . 2]" 1
524 1 43 ARG HA 1 43 ARG HD2 4.670 . 5.170 4.267 4.233 4.378 . 0 0 "[ . 1 . 2]" 1
525 1 43 ARG HA 1 43 ARG HD3 4.700 . 5.200 4.708 4.692 4.722 . 0 0 "[ . 1 . 2]" 1
526 1 43 ARG HA 1 43 ARG HG2 3.580 . 4.080 3.210 3.161 3.280 . 0 0 "[ . 1 . 2]" 1
527 1 43 ARG HA 1 43 ARG HG3 3.380 . 3.880 2.546 2.480 2.677 . 0 0 "[ . 1 . 2]" 1
528 1 43 ARG HA 1 44 GLU H 3.510 . 4.010 3.558 3.550 3.567 . 0 0 "[ . 1 . 2]" 1
529 1 43 ARG HA 1 45 TYR H 5.500 . 6.000 4.254 4.188 4.306 . 0 0 "[ . 1 . 2]" 1
530 1 43 ARG HA 1 46 PHE H 4.940 . 5.440 3.390 3.292 3.450 . 0 0 "[ . 1 . 2]" 1
531 1 43 ARG HA 1 46 PHE HB2 4.410 . 4.910 2.916 2.875 2.988 . 0 0 "[ . 1 . 2]" 1
532 1 43 ARG HA 1 46 PHE HB3 4.230 . 4.730 4.276 4.260 4.306 . 0 0 "[ . 1 . 2]" 1
533 1 43 ARG HA 1 47 GLY H 4.440 . 4.940 3.464 3.259 3.611 . 0 0 "[ . 1 . 2]" 1
534 1 43 ARG HA 1 52 VAL MG1 3.730 . 4.230 2.695 2.530 2.802 . 0 0 "[ . 1 . 2]" 1
535 1 43 ARG HA 1 52 VAL MG2 3.960 . 4.460 2.825 2.754 2.940 . 0 0 "[ . 1 . 2]" 1
536 1 43 ARG HA 1 55 CYS QB 5.050 . 5.550 4.106 3.806 4.461 . 0 0 "[ . 1 . 2]" 1
537 1 43 ARG HA 1 72 VAL MG1 5.430 . 5.930 4.127 4.015 4.191 . 0 0 "[ . 1 . 2]" 1
538 1 43 ARG HA 1 72 VAL MG2 5.680 . 6.180 4.258 4.107 4.463 . 0 0 "[ . 1 . 2]" 1
539 1 43 ARG QB 1 43 ARG HD2 3.720 . 4.220 2.298 2.273 2.396 . 0 0 "[ . 1 . 2]" 1
540 1 43 ARG QB 1 43 ARG HD3 3.680 . 4.180 2.432 2.333 2.470 . 0 0 "[ . 1 . 2]" 1
541 1 43 ARG QB 1 44 GLU H 3.470 . 3.970 2.632 2.605 2.668 . 0 0 "[ . 1 . 2]" 1
542 1 43 ARG QB 1 52 VAL MG2 5.740 . 6.240 2.476 2.315 2.695 . 0 0 "[ . 1 . 2]" 1
543 1 43 ARG QB 1 55 CYS QB 4.620 . 5.120 3.137 2.988 3.367 . 0 0 "[ . 1 . 2]" 1
544 1 43 ARG HD2 1 44 GLU H 5.500 . 6.000 5.551 5.533 5.567 . 0 0 "[ . 1 . 2]" 1
545 1 43 ARG HD2 1 52 VAL MG1 6.320 . 6.820 4.607 4.462 4.711 . 0 0 "[ . 1 . 2]" 1
546 1 43 ARG HD2 1 52 VAL MG2 5.370 . 5.870 2.655 2.468 2.872 . 0 0 "[ . 1 . 2]" 1
547 1 43 ARG HD2 1 55 CYS QB 6.010 . 6.510 4.434 4.063 4.782 . 0 0 "[ . 1 . 2]" 1
548 1 43 ARG HD3 1 44 GLU H 4.960 . 5.460 4.841 4.640 4.906 . 0 0 "[ . 1 . 2]" 1
549 1 43 ARG HD3 1 44 GLU HA 5.500 . 6.000 5.515 5.436 5.526 . 0 0 "[ . 1 . 2]" 1
550 1 43 ARG HD3 1 52 VAL MG1 6.610 . 7.110 5.486 5.379 5.553 . 0 0 "[ . 1 . 2]" 1
551 1 43 ARG HD3 1 52 VAL MG2 5.510 . 6.010 3.863 3.733 4.087 . 0 0 "[ . 1 . 2]" 1
552 1 43 ARG HG2 1 44 GLU H 4.090 . 4.590 3.712 3.509 3.798 . 0 0 "[ . 1 . 2]" 1
553 1 43 ARG HG2 1 44 GLU HA 4.010 . 4.510 3.745 3.556 3.835 . 0 0 "[ . 1 . 2]" 1
554 1 43 ARG HG3 1 47 GLY QA 5.390 . 5.890 4.088 3.880 4.344 . 0 0 "[ . 1 . 2]" 1
555 1 43 ARG HG3 1 52 VAL MG1 4.920 . 5.420 2.976 2.870 3.086 . 0 0 "[ . 1 . 2]" 1
556 1 43 ARG HG3 1 52 VAL MG2 4.320 . 4.820 2.096 2.020 2.243 . 0 0 "[ . 1 . 2]" 1
557 1 43 ARG HG3 1 55 CYS QB 5.500 . 6.000 4.847 4.570 4.945 . 0 0 "[ . 1 . 2]" 1
558 1 44 GLU H 1 44 GLU HB2 2.740 . 3.240 2.139 2.133 2.147 . 0 0 "[ . 1 . 2]" 1
559 1 44 GLU H 1 44 GLU HB3 3.290 . 3.790 3.012 3.001 3.026 . 0 0 "[ . 1 . 2]" 1
560 1 44 GLU H 1 44 GLU HG2 4.470 . 4.970 4.479 4.476 4.481 . 0 0 "[ . 1 . 2]" 1
561 1 44 GLU H 1 44 GLU QG 4.050 . 4.550 3.680 3.675 3.687 . 0 0 "[ . 1 . 2]" 1
562 1 44 GLU H 1 44 GLU HG3 4.470 . 4.970 3.913 3.905 3.923 . 0 0 "[ . 1 . 2]" 1
563 1 44 GLU H 1 45 TYR H 3.270 . 3.770 2.876 2.856 2.894 . 0 0 "[ . 1 . 2]" 1
564 1 44 GLU H 1 45 TYR HB3 5.150 . 5.650 5.137 5.102 5.156 . 0 0 "[ . 1 . 2]" 1
565 1 44 GLU HA 1 44 GLU HG2 3.440 . 3.940 2.607 2.602 2.615 . 0 0 "[ . 1 . 2]" 1
566 1 44 GLU HA 1 44 GLU HG3 3.440 . 3.940 2.333 2.326 2.338 . 0 0 "[ . 1 . 2]" 1
567 1 44 GLU HA 1 47 GLY H 4.470 . 4.970 4.204 4.139 4.311 . 0 0 "[ . 1 . 2]" 1
568 1 44 GLU HB2 1 45 TYR H 3.680 . 4.180 3.685 3.672 3.693 . 0 0 "[ . 1 . 2]" 1
569 1 44 GLU HB3 1 45 TYR H 3.690 . 4.190 2.867 2.824 2.906 . 0 0 "[ . 1 . 2]" 1
570 1 44 GLU HB3 1 45 TYR HA 4.490 . 4.990 4.261 4.236 4.289 . 0 0 "[ . 1 . 2]" 1
571 1 44 GLU QG 1 45 TYR H 5.100 . 5.600 4.272 4.244 4.299 . 0 0 "[ . 1 . 2]" 1
572 1 44 GLU QG 1 45 TYR HA 5.990 . 6.490 4.693 4.648 4.735 . 0 0 "[ . 1 . 2]" 1
573 1 44 GLU HG2 1 45 TYR H 5.290 . 5.790 4.581 4.543 4.617 . 0 0 "[ . 1 . 2]" 1
574 1 44 GLU HG3 1 45 TYR H 5.290 . 5.790 5.110 5.091 5.125 . 0 0 "[ . 1 . 2]" 1
575 1 45 TYR H 1 45 TYR HB2 3.120 . 3.620 2.604 2.532 2.645 . 0 0 "[ . 1 . 2]" 1
576 1 45 TYR H 1 45 TYR HB3 3.150 . 3.650 2.458 2.428 2.488 . 0 0 "[ . 1 . 2]" 1
577 1 45 TYR H 1 45 TYR QD 4.880 . 5.380 4.207 4.196 4.216 . 0 0 "[ . 1 . 2]" 1
578 1 45 TYR H 1 46 PHE H 3.370 . 3.870 2.445 2.408 2.496 . 0 0 "[ . 1 . 2]" 1
579 1 45 TYR H 1 46 PHE HA 5.500 . 6.000 5.118 5.086 5.170 . 0 0 "[ . 1 . 2]" 1
580 1 45 TYR H 1 46 PHE QD 5.840 . 6.340 4.413 4.294 4.523 . 0 0 "[ . 1 . 2]" 1
581 1 45 TYR H 1 47 GLY H 4.410 . 4.910 4.034 3.944 4.105 . 0 0 "[ . 1 . 2]" 1
582 1 45 TYR H 1 91 LEU MD1 4.720 . 5.220 3.902 3.872 3.934 . 0 0 "[ . 1 . 2]" 1
583 1 45 TYR H 1 91 LEU MD2 5.120 . 5.620 3.825 3.726 3.927 . 0 0 "[ . 1 . 2]" 1
584 1 45 TYR HA 1 45 TYR QD 4.150 . 4.650 2.552 2.499 2.623 . 0 0 "[ . 1 . 2]" 1
585 1 45 TYR HA 1 45 TYR QE 5.530 . 6.030 4.440 4.342 4.499 . 0 0 "[ . 1 . 2]" 1
586 1 45 TYR HA 1 48 GLN QE 4.040 . 4.540 2.896 2.649 3.612 . 0 0 "[ . 1 . 2]" 1
587 1 45 TYR HA 1 48 GLN HG2 4.750 . 5.250 4.355 2.960 4.781 . 0 0 "[ . 1 . 2]" 1
588 1 45 TYR HA 1 48 GLN QG 4.620 . 5.120 3.173 2.815 3.513 . 0 0 "[ . 1 . 2]" 1
589 1 45 TYR HA 1 48 GLN HG3 4.750 . 5.250 3.417 3.271 4.779 . 0 0 "[ . 1 . 2]" 1
590 1 45 TYR HA 1 91 LEU HB2 5.500 . 6.000 5.531 5.514 5.543 . 0 0 "[ . 1 . 2]" 1
591 1 45 TYR HA 1 91 LEU MD1 4.940 . 5.440 4.046 3.858 4.115 . 0 0 "[ . 1 . 2]" 1
592 1 45 TYR HA 1 91 LEU MD2 6.610 . 7.110 4.750 4.618 4.830 . 0 0 "[ . 1 . 2]" 1
593 1 45 TYR HB2 1 46 PHE H 4.200 . 4.700 3.890 3.858 3.973 . 0 0 "[ . 1 . 2]" 1
594 1 45 TYR HB2 1 91 LEU MD1 3.940 . 4.440 2.148 2.083 2.181 . 0 0 "[ . 1 . 2]" 1
595 1 45 TYR HB2 1 91 LEU MD2 4.670 . 5.170 2.606 2.510 2.681 . 0 0 "[ . 1 . 2]" 1
596 1 45 TYR HB3 1 46 PHE H 3.570 . 4.070 2.635 2.570 2.825 . 0 0 "[ . 1 . 2]" 1
597 1 45 TYR HB3 1 46 PHE HB2 4.810 . 5.310 4.338 4.269 4.382 . 0 0 "[ . 1 . 2]" 1
598 1 45 TYR HB3 1 46 PHE QD 4.850 . 5.350 3.447 3.165 3.580 . 0 0 "[ . 1 . 2]" 1
599 1 45 TYR HB3 1 91 LEU MD1 4.340 . 4.840 3.448 3.387 3.485 . 0 0 "[ . 1 . 2]" 1
600 1 45 TYR HB3 1 91 LEU MD2 4.670 . 5.170 2.605 2.407 2.690 . 0 0 "[ . 1 . 2]" 1
601 1 45 TYR QD 1 46 PHE H 5.120 . 5.620 3.721 3.645 3.940 . 0 0 "[ . 1 . 2]" 1
602 1 45 TYR QD 1 46 PHE QD 5.760 . 6.260 3.415 3.308 3.496 . 0 0 "[ . 1 . 2]" 1
603 1 45 TYR QD 1 46 PHE QE 5.800 . 6.300 3.188 3.111 3.258 . 0 0 "[ . 1 . 2]" 1
604 1 45 TYR QD 1 91 LEU HB2 6.170 . 6.670 3.598 3.457 3.644 . 0 0 "[ . 1 . 2]" 1
605 1 45 TYR QD 1 91 LEU MD1 5.270 . 5.770 3.047 2.597 3.218 . 0 0 "[ . 1 . 2]" 1
606 1 45 TYR QD 1 91 LEU MD2 6.250 . 6.750 3.477 3.195 3.584 . 0 0 "[ . 1 . 2]" 1
607 1 45 TYR QD 1 96 ILE MD 6.550 . 7.050 2.949 2.810 3.142 . 0 0 "[ . 1 . 2]" 1
608 1 45 TYR QE 1 46 PHE QD 6.310 . 6.810 4.439 4.278 4.679 . 0 0 "[ . 1 . 2]" 1
609 1 45 TYR QE 1 46 PHE QE 5.440 . 5.940 3.395 3.223 3.728 . 0 0 "[ . 1 . 2]" 1
610 1 45 TYR QE 1 48 GLN QG 6.730 . 7.230 5.244 4.872 5.356 . 0 0 "[ . 1 . 2]" 1
611 1 45 TYR QE 1 49 PHE QE 5.560 . 6.060 3.082 2.980 3.238 . 0 0 "[ . 1 . 2]" 1
612 1 45 TYR QE 1 49 PHE HZ 4.650 . 5.150 3.719 3.495 4.145 . 0 0 "[ . 1 . 2]" 1
613 1 45 TYR QE 1 89 HIS HB2 5.650 . 6.150 4.004 3.893 4.093 . 0 0 "[ . 1 . 2]" 1
614 1 45 TYR QE 1 89 HIS QB 5.390 . 5.890 2.475 2.351 2.527 . 0 0 "[ . 1 . 2]" 1
615 1 45 TYR QE 1 89 HIS HB3 5.650 . 6.150 2.499 2.370 2.553 . 0 0 "[ . 1 . 2]" 1
616 1 45 TYR QE 1 90 GLU H 5.320 . 5.820 3.264 3.190 3.369 . 0 0 "[ . 1 . 2]" 1
617 1 45 TYR QE 1 91 LEU HB3 6.170 . 6.670 5.451 5.150 5.505 . 0 0 "[ . 1 . 2]" 1
618 1 45 TYR QE 1 91 LEU MD1 6.340 . 6.840 4.574 4.115 4.706 . 0 0 "[ . 1 . 2]" 1
619 1 45 TYR QE 1 96 ILE MD 5.100 . 5.600 2.644 2.541 2.730 . 0 0 "[ . 1 . 2]" 1
620 1 46 PHE H 1 46 PHE HB2 3.340 . 3.840 2.275 2.251 2.304 . 0 0 "[ . 1 . 2]" 1
621 1 46 PHE H 1 46 PHE HB3 3.680 . 4.180 3.548 3.525 3.576 . 0 0 "[ . 1 . 2]" 1
622 1 46 PHE H 1 46 PHE QD 4.070 . 4.570 3.031 2.953 3.185 . 0 0 "[ . 1 . 2]" 1
623 1 46 PHE H 1 46 PHE QE 5.890 . 6.390 4.799 4.728 4.942 . 0 0 "[ . 1 . 2]" 1
624 1 46 PHE H 1 47 GLY H 3.340 . 3.840 2.634 2.534 2.669 . 0 0 "[ . 1 . 2]" 1
625 1 46 PHE H 1 48 GLN H 4.700 . 5.200 4.310 4.217 4.453 . 0 0 "[ . 1 . 2]" 1
626 1 46 PHE H 1 52 VAL MG1 5.510 . 6.010 4.260 4.128 4.367 . 0 0 "[ . 1 . 2]" 1
627 1 46 PHE H 1 91 LEU MD1 6.490 . 6.990 5.425 5.406 5.457 . 0 0 "[ . 1 . 2]" 1
628 1 46 PHE H 1 91 LEU MD2 5.990 . 6.490 4.717 4.492 4.971 . 0 0 "[ . 1 . 2]" 1
629 1 46 PHE HA 1 46 PHE QD 3.890 . 4.390 2.345 2.294 2.444 . 0 0 "[ . 1 . 2]" 1
630 1 46 PHE HA 1 48 GLN H 3.770 . 4.270 3.387 3.262 3.522 . 0 0 "[ . 1 . 2]" 1
631 1 46 PHE HA 1 49 PHE H 4.570 . 5.070 3.548 3.511 3.642 . 0 0 "[ . 1 . 2]" 1
632 1 46 PHE HA 1 49 PHE HB2 4.800 . 5.300 3.907 3.765 4.018 . 0 0 "[ . 1 . 2]" 1
633 1 46 PHE HA 1 49 PHE QD 3.590 . 4.090 2.050 2.031 2.086 . 0 0 "[ . 1 . 2]" 1
634 1 46 PHE HA 1 49 PHE QE 5.370 . 5.870 3.088 2.965 3.170 . 0 0 "[ . 1 . 2]" 1
635 1 46 PHE HA 1 49 PHE HZ 5.500 . 6.000 5.491 5.394 5.522 . 0 0 "[ . 1 . 2]" 1
636 1 46 PHE HA 1 52 VAL MG1 5.690 . 6.190 4.464 4.317 4.568 . 0 0 "[ . 1 . 2]" 1
637 1 46 PHE HA 1 74 PHE HZ 5.500 . 6.000 4.000 3.681 4.249 . 0 0 "[ . 1 . 2]" 1
638 1 46 PHE HA 1 83 VAL MG2 6.120 . 6.620 4.058 3.928 4.222 . 0 0 "[ . 1 . 2]" 1
639 1 46 PHE HB2 1 47 GLY H 4.200 . 4.700 3.370 3.231 3.490 . 0 0 "[ . 1 . 2]" 1
640 1 46 PHE HB2 1 52 VAL MG1 4.500 . 5.000 2.709 2.628 2.808 . 0 0 "[ . 1 . 2]" 1
641 1 46 PHE HB2 1 52 VAL MG2 5.340 . 5.840 4.389 4.297 4.459 . 0 0 "[ . 1 . 2]" 1
642 1 46 PHE HB2 1 72 VAL MG1 4.520 . 5.020 2.898 2.748 3.047 . 0 0 "[ . 1 . 2]" 1
643 1 46 PHE HB2 1 72 VAL MG2 4.830 . 5.330 3.236 2.977 3.456 . 0 0 "[ . 1 . 2]" 1
644 1 46 PHE HB2 1 74 PHE QE 5.470 . 5.970 4.462 4.238 4.731 . 0 0 "[ . 1 . 2]" 1
645 1 46 PHE HB2 1 74 PHE HZ 4.470 . 4.970 4.373 4.211 4.484 . 0 0 "[ . 1 . 2]" 1
646 1 46 PHE HB3 1 47 GLY H 4.620 . 5.120 3.938 3.831 3.995 . 0 0 "[ . 1 . 2]" 1
647 1 46 PHE HB3 1 52 VAL MG1 4.420 . 4.920 2.651 2.589 2.720 . 0 0 "[ . 1 . 2]" 1
648 1 46 PHE HB3 1 52 VAL MG2 5.800 . 6.300 4.860 4.839 4.870 . 0 0 "[ . 1 . 2]" 1
649 1 46 PHE HB3 1 72 VAL MG1 4.420 . 4.920 2.569 2.326 2.772 . 0 0 "[ . 1 . 2]" 1
650 1 46 PHE HB3 1 72 VAL MG2 5.270 . 5.770 3.767 3.500 3.979 . 0 0 "[ . 1 . 2]" 1
651 1 46 PHE HB3 1 74 PHE QD 5.800 . 6.300 4.673 4.448 4.929 . 0 0 "[ . 1 . 2]" 1
652 1 46 PHE HB3 1 74 PHE QE 4.780 . 5.280 2.918 2.633 3.285 . 0 0 "[ . 1 . 2]" 1
653 1 46 PHE HB3 1 74 PHE HZ 3.740 . 4.240 2.783 2.585 2.916 . 0 0 "[ . 1 . 2]" 1
654 1 46 PHE QD 1 47 GLY H 5.590 . 6.090 4.837 4.773 4.875 . 0 0 "[ . 1 . 2]" 1
655 1 46 PHE QD 1 49 PHE H 6.170 . 6.670 4.739 4.613 4.888 . 0 0 "[ . 1 . 2]" 1
656 1 46 PHE QD 1 49 PHE HB2 5.540 . 6.040 3.698 3.500 3.885 . 0 0 "[ . 1 . 2]" 1
657 1 46 PHE QD 1 49 PHE QD 4.520 . 5.020 2.736 2.338 3.051 . 0 0 "[ . 1 . 2]" 1
658 1 46 PHE QD 1 52 VAL MG1 6.270 . 6.770 4.063 3.924 4.173 . 0 0 "[ . 1 . 2]" 1
659 1 46 PHE QD 1 72 VAL HB 5.390 . 5.890 4.284 4.201 4.362 . 0 0 "[ . 1 . 2]" 1
660 1 46 PHE QD 1 72 VAL MG1 5.240 . 5.740 3.369 3.219 3.459 . 0 0 "[ . 1 . 2]" 1
661 1 46 PHE QD 1 72 VAL MG2 4.740 . 5.240 2.353 2.310 2.407 . 0 0 "[ . 1 . 2]" 1
662 1 46 PHE QD 1 74 PHE QE 5.190 . 5.690 3.482 3.274 3.630 . 0 0 "[ . 1 . 2]" 1
663 1 46 PHE QD 1 74 PHE HZ 3.740 . 4.240 2.339 2.219 2.489 . 0 0 "[ . 1 . 2]" 1
664 1 46 PHE QD 1 83 VAL MG1 5.510 . 6.010 3.668 3.481 3.809 . 0 0 "[ . 1 . 2]" 1
665 1 46 PHE QD 1 83 VAL MG2 4.290 . 4.790 2.409 2.315 2.490 . 0 0 "[ . 1 . 2]" 1
666 1 46 PHE QD 1 91 LEU MD2 6.630 . 7.130 4.232 3.996 4.448 . 0 0 "[ . 1 . 2]" 1
667 1 46 PHE QE 1 72 VAL MG2 5.530 . 6.030 3.284 3.094 3.402 . 0 0 "[ . 1 . 2]" 1
668 1 46 PHE QE 1 83 VAL HA 6.030 . 6.530 4.599 4.513 4.699 . 0 0 "[ . 1 . 2]" 1
669 1 46 PHE QE 1 83 VAL HB 5.930 . 6.430 4.474 4.355 4.674 . 0 0 "[ . 1 . 2]" 1
670 1 46 PHE QE 1 83 VAL MG1 4.340 . 4.840 2.268 2.189 2.440 . 0 0 "[ . 1 . 2]" 1
671 1 46 PHE QE 1 83 VAL MG2 4.520 . 5.020 2.490 2.346 2.684 . 0 0 "[ . 1 . 2]" 1
672 1 46 PHE QE 1 91 LEU MD2 5.820 . 6.320 3.698 3.415 3.885 . 0 0 "[ . 1 . 2]" 1
673 1 46 PHE QE 1 96 ILE MD 4.530 . 5.030 2.878 2.740 3.045 . 0 0 "[ . 1 . 2]" 1
674 1 46 PHE QE 1 98 PRO HB3 4.800 . 5.300 3.665 3.431 3.820 . 0 0 "[ . 1 . 2]" 1
675 1 46 PHE QE 1 98 PRO HG2 4.500 . 5.000 3.712 3.450 4.002 . 0 0 "[ . 1 . 2]" 1
676 1 46 PHE QE 1 98 PRO HG3 4.680 . 5.180 3.122 2.891 3.521 . 0 0 "[ . 1 . 2]" 1
677 1 46 PHE HZ 1 83 VAL MG1 5.240 . 5.740 3.695 3.586 3.861 . 0 0 "[ . 1 . 2]" 1
678 1 46 PHE HZ 1 96 ILE MD 3.940 . 4.440 2.378 2.284 2.461 . 0 0 "[ . 1 . 2]" 1
679 1 46 PHE HZ 1 96 ILE MG 6.220 . 6.720 5.082 4.983 5.150 . 0 0 "[ . 1 . 2]" 1
680 1 46 PHE HZ 1 98 PRO HB3 4.310 . 4.810 2.698 2.441 2.970 . 0 0 "[ . 1 . 2]" 1
681 1 46 PHE HZ 1 98 PRO HG2 4.180 . 4.680 3.996 3.863 4.136 . 0 0 "[ . 1 . 2]" 1
682 1 46 PHE HZ 1 98 PRO HG3 4.240 . 4.740 2.478 2.373 2.699 . 0 0 "[ . 1 . 2]" 1
683 1 47 GLY H 1 48 GLN H 3.490 . 3.990 2.815 2.780 2.865 . 0 0 "[ . 1 . 2]" 1
684 1 47 GLY H 1 49 PHE H 4.790 . 5.290 4.456 4.385 4.535 . 0 0 "[ . 1 . 2]" 1
685 1 47 GLY H 1 52 VAL MG1 5.420 . 5.920 3.610 3.243 3.781 . 0 0 "[ . 1 . 2]" 1
686 1 47 GLY QA 1 50 GLY H 5.070 . 5.570 3.116 2.982 3.374 . 0 0 "[ . 1 . 2]" 1
687 1 47 GLY HA2 1 52 VAL MG1 4.940 . 5.440 3.215 2.825 3.398 . 0 0 "[ . 1 . 2]" 1
688 1 47 GLY HA3 1 52 VAL MG1 4.940 . 5.440 4.034 3.515 4.134 . 0 0 "[ . 1 . 2]" 1
689 1 48 GLN H 1 48 GLN QB 3.570 . 4.070 2.499 2.450 2.914 . 0 0 "[ . 1 . 2]" 1
690 1 48 GLN H 1 48 GLN HG2 3.590 . 4.090 3.076 2.028 3.423 . 0 0 "[ . 1 . 2]" 1
691 1 48 GLN H 1 48 GLN HG3 3.590 . 4.090 2.516 2.201 3.616 . 0 0 "[ . 1 . 2]" 1
692 1 48 GLN H 1 49 PHE H 3.240 . 3.740 2.530 2.506 2.555 . 0 0 "[ . 1 . 2]" 1
693 1 48 GLN H 1 49 PHE HA 5.430 . 5.930 5.247 5.209 5.267 . 0 0 "[ . 1 . 2]" 1
694 1 48 GLN H 1 49 PHE QD 4.360 . 4.860 3.462 3.367 3.904 . 0 0 "[ . 1 . 2]" 1
695 1 48 GLN H 1 50 GLY H 4.330 . 4.830 4.081 3.992 4.223 . 0 0 "[ . 1 . 2]" 1
696 1 48 GLN H 1 52 VAL MG1 6.610 . 7.110 5.294 4.999 5.452 . 0 0 "[ . 1 . 2]" 1
697 1 48 GLN HA 1 48 GLN HG2 3.980 . 4.480 2.830 2.607 3.715 . 0 0 "[ . 1 . 2]" 1
698 1 48 GLN HA 1 48 GLN QG 3.780 . 4.280 2.687 2.498 3.343 . 0 0 "[ . 1 . 2]" 1
699 1 48 GLN HA 1 48 GLN HG3 3.980 . 4.480 3.369 3.198 3.878 . 0 0 "[ . 1 . 2]" 1
700 1 48 GLN QB 1 49 PHE H 4.600 . 5.100 2.950 2.846 3.747 . 0 0 "[ . 1 . 2]" 1
701 1 48 GLN QB 1 49 PHE QD 5.720 . 6.220 3.174 3.016 4.480 . 0 0 "[ . 1 . 2]" 1
702 1 48 GLN QB 1 49 PHE HZ 5.520 . 6.020 4.232 3.959 4.946 . 0 0 "[ . 1 . 2]" 1
703 1 48 GLN QG 1 49 PHE H 4.620 . 5.120 4.076 2.863 4.149 . 0 0 "[ . 1 . 2]" 1
704 1 48 GLN QG 1 49 PHE QD 5.670 . 6.170 4.424 3.055 4.521 . 0 0 "[ . 1 . 2]" 1
705 1 49 PHE H 1 49 PHE HB2 3.420 . 3.920 2.537 2.503 2.567 . 0 0 "[ . 1 . 2]" 1
706 1 49 PHE H 1 49 PHE HB3 3.650 . 4.150 3.657 3.648 3.670 . 0 0 "[ . 1 . 2]" 1
707 1 49 PHE H 1 49 PHE QD 3.740 . 4.240 2.414 2.311 2.781 . 0 0 "[ . 1 . 2]" 1
708 1 49 PHE H 1 50 GLY H 2.980 . 3.480 2.209 2.129 2.288 . 0 0 "[ . 1 . 2]" 1
709 1 49 PHE H 1 74 PHE QE 5.190 . 5.690 3.909 3.564 4.142 . 0 0 "[ . 1 . 2]" 1
710 1 49 PHE HA 1 49 PHE QD 3.920 . 4.420 2.915 2.631 3.017 . 0 0 "[ . 1 . 2]" 1
711 1 49 PHE HA 1 50 GLY HA2 5.160 . 5.660 4.742 4.702 4.791 . 0 0 "[ . 1 . 2]" 1
712 1 49 PHE HA 1 50 GLY HA3 5.500 . 6.000 4.934 4.866 5.008 . 0 0 "[ . 1 . 2]" 1
713 1 49 PHE HA 1 82 LYS QB 4.430 . 4.930 3.591 3.331 3.727 . 0 0 "[ . 1 . 2]" 1
714 1 49 PHE HA 1 82 LYS QD 4.190 . 4.690 2.523 2.360 2.734 . 0 0 "[ . 1 . 2]" 1
715 1 49 PHE HA 1 82 LYS QE 4.850 . 5.350 4.125 3.731 4.358 . 0 0 "[ . 1 . 2]" 1
716 1 49 PHE HA 1 83 VAL MG2 6.590 . 7.090 4.768 4.633 5.190 . 0 0 "[ . 1 . 2]" 1
717 1 49 PHE HB2 1 50 GLY H 3.930 . 4.430 2.777 2.560 3.114 . 0 0 "[ . 1 . 2]" 1
718 1 49 PHE HB2 1 74 PHE QD 5.250 . 5.750 4.502 4.295 4.648 . 0 0 "[ . 1 . 2]" 1
719 1 49 PHE HB2 1 74 PHE QE 4.830 . 5.330 2.686 2.512 2.866 . 0 0 "[ . 1 . 2]" 1
720 1 49 PHE HB2 1 74 PHE HZ 4.180 . 4.680 3.651 2.663 4.181 . 0 0 "[ . 1 . 2]" 1
721 1 49 PHE HB2 1 82 LYS QB 4.390 . 4.890 3.891 3.667 3.933 . 0 0 "[ . 1 . 2]" 1
722 1 49 PHE HB2 1 83 VAL MG2 4.360 . 4.860 2.926 2.764 3.191 . 0 0 "[ . 1 . 2]" 1
723 1 49 PHE HB3 1 50 GLY H 4.300 . 4.800 3.868 3.703 4.095 . 0 0 "[ . 1 . 2]" 1
724 1 49 PHE HB3 1 74 PHE QE 5.040 . 5.540 4.084 3.887 4.278 . 0 0 "[ . 1 . 2]" 1
725 1 49 PHE HB3 1 82 LYS QB 3.960 . 4.460 2.331 2.227 2.381 . 0 0 "[ . 1 . 2]" 1
726 1 49 PHE HB3 1 82 LYS QD 5.030 . 5.530 2.643 2.521 3.097 . 0 0 "[ . 1 . 2]" 1
727 1 49 PHE HB3 1 83 VAL H 4.620 . 5.120 3.976 3.715 4.377 . 0 0 "[ . 1 . 2]" 1
728 1 49 PHE HB3 1 83 VAL MG2 4.280 . 4.780 2.821 2.664 3.287 . 0 0 "[ . 1 . 2]" 1
729 1 49 PHE QD 1 82 LYS HA 5.230 . 5.730 4.465 4.355 4.588 . 0 0 "[ . 1 . 2]" 1
730 1 49 PHE QD 1 82 LYS QB 4.200 . 4.700 2.049 2.012 2.161 . 0 0 "[ . 1 . 2]" 1
731 1 49 PHE QD 1 82 LYS QD 4.860 . 5.360 2.881 2.778 3.280 . 0 0 "[ . 1 . 2]" 1
732 1 49 PHE QD 1 82 LYS QE 6.100 . 6.600 4.840 4.712 4.878 . 0 0 "[ . 1 . 2]" 1
733 1 49 PHE QD 1 82 LYS HG2 4.930 . 5.430 4.229 4.103 4.392 . 0 0 "[ . 1 . 2]" 1
734 1 49 PHE QD 1 82 LYS HG3 5.630 . 6.130 4.684 4.543 5.034 . 0 0 "[ . 1 . 2]" 1
735 1 49 PHE QD 1 83 VAL HA 4.590 . 5.090 4.116 4.100 4.127 . 0 0 "[ . 1 . 2]" 1
736 1 49 PHE QD 1 83 VAL MG2 5.150 . 5.650 2.985 2.715 3.227 . 0 0 "[ . 1 . 2]" 1
737 1 49 PHE QE 1 82 LYS QB 6.310 . 6.810 3.618 3.513 3.995 . 0 0 "[ . 1 . 2]" 1
738 1 49 PHE QE 1 83 VAL HA 5.200 . 5.700 3.956 3.857 4.171 . 0 0 "[ . 1 . 2]" 1
739 1 49 PHE QE 1 83 VAL MG1 6.780 . 7.280 4.585 4.457 4.657 . 0 0 "[ . 1 . 2]" 1
740 1 49 PHE QE 1 86 GLN QB 6.390 . 6.890 3.371 3.251 3.608 . 0 0 "[ . 1 . 2]" 1
741 1 49 PHE QE 1 86 GLN QG 6.730 . 7.230 4.508 4.352 4.690 . 0 0 "[ . 1 . 2]" 1
742 1 49 PHE HZ 1 83 VAL HA 4.830 . 5.330 4.828 4.736 4.847 . 0 0 "[ . 1 . 2]" 1
743 1 49 PHE HZ 1 83 VAL MG2 5.790 . 6.290 4.173 4.084 4.375 . 0 0 "[ . 1 . 2]" 1
744 1 49 PHE HZ 1 86 GLN QB 5.080 . 5.580 4.494 4.251 4.538 . 0 0 "[ . 1 . 2]" 1
745 1 49 PHE HZ 1 86 GLN QG 5.990 . 6.490 4.988 4.814 5.044 . 0 0 "[ . 1 . 2]" 1
746 1 49 PHE HZ 1 89 HIS HE1 4.240 . 4.740 2.647 2.574 2.869 . 0 0 "[ . 1 . 2]" 1
747 1 50 GLY H 1 51 GLU H 4.560 . 5.060 4.322 4.251 4.390 . 0 0 "[ . 1 . 2]" 1
748 1 50 GLY H 1 52 VAL MG1 5.490 . 5.990 4.435 4.283 4.572 . 0 0 "[ . 1 . 2]" 1
749 1 50 GLY H 1 74 PHE QE 4.370 . 4.870 2.955 2.648 3.284 . 0 0 "[ . 1 . 2]" 1
750 1 50 GLY HA2 1 51 GLU H 3.490 . 3.990 2.391 2.326 2.558 . 0 0 "[ . 1 . 2]" 1
751 1 50 GLY HA2 1 51 GLU HA 5.410 . 5.910 4.391 4.332 4.414 . 0 0 "[ . 1 . 2]" 1
752 1 50 GLY HA2 1 74 PHE QD 5.770 . 6.270 4.374 4.171 4.589 . 0 0 "[ . 1 . 2]" 1
753 1 50 GLY HA2 1 79 GLY HA2 5.340 . 5.840 4.870 4.421 5.267 . 0 0 "[ . 1 . 2]" 1
754 1 50 GLY HA3 1 51 GLU H 3.080 . 3.580 2.855 2.656 2.972 . 0 0 "[ . 1 . 2]" 1
755 1 50 GLY HA3 1 51 GLU HA 5.500 . 6.000 4.745 4.656 4.786 . 0 0 "[ . 1 . 2]" 1
756 1 50 GLY HA3 1 74 PHE QD 4.220 . 4.720 2.884 2.627 3.190 . 0 0 "[ . 1 . 2]" 1
757 1 50 GLY HA3 1 74 PHE QE 4.690 . 5.190 3.868 3.424 4.184 . 0 0 "[ . 1 . 2]" 1
758 1 50 GLY HA3 1 78 ALA MB 6.450 . 6.950 5.064 4.773 5.339 . 0 0 "[ . 1 . 2]" 1
759 1 50 GLY HA3 1 79 GLY HA2 4.320 . 4.820 3.720 3.429 3.991 . 0 0 "[ . 1 . 2]" 1
760 1 50 GLY HA3 1 79 GLY HA3 4.440 . 4.940 2.897 2.434 3.560 . 0 0 "[ . 1 . 2]" 1
761 1 51 GLU H 1 51 GLU HB2 3.130 . 3.630 2.555 2.489 2.680 . 0 0 "[ . 1 . 2]" 1
762 1 51 GLU H 1 51 GLU HB3 3.130 . 3.630 2.510 2.475 2.539 . 0 0 "[ . 1 . 2]" 1
763 1 51 GLU H 1 51 GLU HG2 4.600 . 5.100 4.567 4.490 4.627 . 0 0 "[ . 1 . 2]" 1
764 1 51 GLU H 1 51 GLU HG3 4.600 . 5.100 4.495 4.444 4.533 . 0 0 "[ . 1 . 2]" 1
765 1 51 GLU H 1 52 VAL H 4.680 . 5.180 4.643 4.524 4.686 . 0 0 "[ . 1 . 2]" 1
766 1 51 GLU H 1 74 PHE QD 5.830 . 6.330 4.323 3.656 4.709 . 0 0 "[ . 1 . 2]" 1
767 1 51 GLU HA 1 51 GLU HG2 3.950 . 4.450 3.519 3.189 3.806 . 0 0 "[ . 1 . 2]" 1
768 1 51 GLU HA 1 51 GLU HG3 3.950 . 4.450 2.877 2.420 3.278 . 0 0 "[ . 1 . 2]" 1
769 1 51 GLU HA 1 52 VAL H 2.920 . 3.420 2.247 2.188 2.308 . 0 0 "[ . 1 . 2]" 1
770 1 51 GLU HA 1 52 VAL HA 4.570 . 5.070 4.376 4.339 4.415 . 0 0 "[ . 1 . 2]" 1
771 1 51 GLU HA 1 52 VAL MG1 4.680 . 5.180 3.416 3.178 3.690 . 0 0 "[ . 1 . 2]" 1
772 1 51 GLU HA 1 52 VAL MG2 5.380 . 5.880 4.134 3.912 4.419 . 0 0 "[ . 1 . 2]" 1
773 1 51 GLU QB 1 52 VAL H 4.380 . 4.880 3.663 3.513 3.907 . 0 0 "[ . 1 . 2]" 1
774 1 51 GLU QB 1 75 MET HG3 4.490 . 4.990 2.841 2.546 3.304 . 0 0 "[ . 1 . 2]" 1
775 1 51 GLU HB2 1 52 VAL H 4.480 . 4.980 4.150 3.988 4.406 . 0 0 "[ . 1 . 2]" 1
776 1 51 GLU HB2 1 75 MET HG3 4.810 . 5.310 4.418 4.174 4.832 . 0 0 "[ . 1 . 2]" 1
777 1 51 GLU HB3 1 52 VAL H 4.480 . 4.980 4.076 3.891 4.366 . 0 0 "[ . 1 . 2]" 1
778 1 51 GLU HB3 1 75 MET HG3 4.810 . 5.310 2.877 2.568 3.364 . 0 0 "[ . 1 . 2]" 1
779 1 51 GLU QG 1 52 VAL H 4.220 . 4.720 2.680 2.531 2.988 . 0 0 "[ . 1 . 2]" 1
780 1 51 GLU QG 1 52 VAL HA 5.140 . 5.640 4.291 4.208 4.418 . 0 0 "[ . 1 . 2]" 1
781 1 51 GLU QG 1 75 MET HG3 3.180 . 3.680 2.569 2.458 2.794 . 0 0 "[ . 1 . 2]" 1
782 1 51 GLU HG2 1 52 VAL H 4.300 . 4.800 3.656 3.124 4.140 . 0 0 "[ . 1 . 2]" 1
783 1 51 GLU HG3 1 52 VAL H 4.300 . 4.800 2.806 2.562 3.240 . 0 0 "[ . 1 . 2]" 1
784 1 52 VAL H 1 52 VAL HB 3.670 . 4.170 3.739 3.713 3.769 . 0 0 "[ . 1 . 2]" 1
785 1 52 VAL H 1 52 VAL MG1 3.890 . 4.390 2.438 2.199 2.596 . 0 0 "[ . 1 . 2]" 1
786 1 52 VAL HA 1 53 LYS H 3.070 . 3.570 2.097 2.050 2.193 . 0 0 "[ . 1 . 2]" 1
787 1 52 VAL HA 1 54 GLU H 4.430 . 4.930 3.750 3.640 3.992 . 0 0 "[ . 1 . 2]" 1
788 1 52 VAL HA 1 72 VAL MG1 5.910 . 6.410 3.719 3.539 3.997 . 0 0 "[ . 1 . 2]" 1
789 1 52 VAL HA 1 74 PHE HA 3.790 . 4.290 2.067 2.020 2.116 . 0 0 "[ . 1 . 2]" 1
790 1 52 VAL HA 1 74 PHE QD 4.950 . 5.450 3.691 3.449 3.888 . 0 0 "[ . 1 . 2]" 1
791 1 52 VAL HA 1 75 MET H 4.750 . 5.250 3.028 2.832 3.251 . 0 0 "[ . 1 . 2]" 1
792 1 52 VAL HB 1 53 LYS H 3.140 . 3.640 2.955 2.709 3.082 . 0 0 "[ . 1 . 2]" 1
793 1 52 VAL HB 1 54 GLU H 4.010 . 4.510 2.892 2.755 3.169 . 0 0 "[ . 1 . 2]" 1
794 1 52 VAL HB 1 72 VAL MG1 5.280 . 5.780 2.411 2.283 2.650 . 0 0 "[ . 1 . 2]" 1
795 1 52 VAL HB 1 74 PHE QD 6.170 . 6.670 4.979 4.815 5.066 . 0 0 "[ . 1 . 2]" 1
796 1 52 VAL HB 1 74 PHE QE 6.170 . 6.670 5.374 5.149 5.509 . 0 0 "[ . 1 . 2]" 1
797 1 52 VAL MG1 1 55 CYS QB 6.170 . 6.670 3.878 3.495 4.596 . 0 0 "[ . 1 . 2]" 1
798 1 52 VAL MG1 1 72 VAL MG1 4.760 . 5.260 2.185 2.060 2.356 . 0 0 "[ . 1 . 2]" 1
799 1 52 VAL MG1 1 72 VAL MG2 5.930 . 6.430 3.495 3.307 3.786 . 0 0 "[ . 1 . 2]" 1
800 1 52 VAL MG1 1 74 PHE QD 4.950 . 5.450 3.257 3.128 3.431 . 0 0 "[ . 1 . 2]" 1
801 1 52 VAL MG1 1 74 PHE QE 4.890 . 5.390 3.149 2.988 3.248 . 0 0 "[ . 1 . 2]" 1
802 1 52 VAL MG1 1 74 PHE HZ 5.300 . 5.800 4.041 3.912 4.154 . 0 0 "[ . 1 . 2]" 1
803 1 52 VAL MG2 1 53 LYS H 4.550 . 5.050 3.727 3.410 3.806 . 0 0 "[ . 1 . 2]" 1
804 1 52 VAL MG2 1 53 LYS HA 5.740 . 6.240 4.374 4.023 4.522 . 0 0 "[ . 1 . 2]" 1
805 1 52 VAL MG2 1 54 GLU H 4.300 . 4.800 3.248 2.898 3.358 . 0 0 "[ . 1 . 2]" 1
806 1 52 VAL MG2 1 54 GLU HA 5.440 . 5.940 4.072 3.775 4.544 . 0 0 "[ . 1 . 2]" 1
807 1 52 VAL MG2 1 55 CYS HA 5.400 . 5.900 4.517 4.438 4.562 . 0 0 "[ . 1 . 2]" 1
808 1 52 VAL MG2 1 55 CYS QB 4.740 . 5.240 2.830 2.550 3.481 . 0 0 "[ . 1 . 2]" 1
809 1 52 VAL MG2 1 72 VAL HA 6.350 . 6.850 5.000 4.863 5.217 . 0 0 "[ . 1 . 2]" 1
810 1 52 VAL MG2 1 72 VAL MG1 5.090 . 5.590 3.253 3.137 3.444 . 0 0 "[ . 1 . 2]" 1
811 1 52 VAL MG2 1 73 THR H 5.660 . 6.160 4.621 4.458 4.733 . 0 0 "[ . 1 . 2]" 1
812 1 52 VAL MG2 1 74 PHE QD 7.410 . 7.910 5.482 5.410 5.521 . 0 0 "[ . 1 . 2]" 1
813 1 53 LYS H 1 53 LYS HB2 3.950 . 4.450 2.561 2.465 2.788 . 0 0 "[ . 1 . 2]" 1
814 1 53 LYS H 1 53 LYS HB3 3.950 . 4.450 2.400 2.333 2.438 . 0 0 "[ . 1 . 2]" 1
815 1 53 LYS H 1 54 GLU H 3.410 . 3.910 2.314 2.178 2.375 . 0 0 "[ . 1 . 2]" 1
816 1 53 LYS H 1 73 THR HB 4.740 . 5.240 3.477 3.191 3.710 . 0 0 "[ . 1 . 2]" 1
817 1 53 LYS H 1 74 PHE HA 4.230 . 4.730 2.542 2.311 2.654 . 0 0 "[ . 1 . 2]" 1
818 1 53 LYS H 1 75 MET H 4.700 . 5.200 3.419 3.207 3.807 . 0 0 "[ . 1 . 2]" 1
819 1 53 LYS HA 1 53 LYS HE2 5.500 . 6.000 4.808 4.075 5.372 . 0 0 "[ . 1 . 2]" 1
820 1 53 LYS HA 1 53 LYS HE3 5.500 . 6.000 4.733 4.372 5.545 . 0 0 "[ . 1 . 2]" 1
821 1 53 LYS HA 1 53 LYS HG2 3.990 . 4.490 3.134 2.457 3.237 . 0 0 "[ . 1 . 2]" 1
822 1 53 LYS HA 1 53 LYS QG 3.810 . 4.310 2.417 2.340 2.484 . 0 0 "[ . 1 . 2]" 1
823 1 53 LYS HA 1 53 LYS HG3 3.990 . 4.490 2.559 2.407 3.524 . 0 0 "[ . 1 . 2]" 1
824 1 53 LYS HA 1 75 MET ME 4.580 . 5.080 2.594 2.153 3.862 . 0 0 "[ . 1 . 2]" 1
825 1 53 LYS QB 1 54 GLU H 3.700 . 4.200 2.921 2.832 3.086 . 0 0 "[ . 1 . 2]" 1
826 1 53 LYS QB 1 73 THR HB 4.120 . 4.620 2.427 2.364 2.565 . 0 0 "[ . 1 . 2]" 1
827 1 53 LYS HB2 1 54 GLU H 4.040 . 4.540 4.046 3.974 4.111 . 0 0 "[ . 1 . 2]" 1
828 1 53 LYS HB2 1 73 THR HB 4.360 . 4.860 4.164 4.086 4.338 . 0 0 "[ . 1 . 2]" 1
829 1 53 LYS HB2 1 73 THR MG 4.970 . 5.470 3.479 3.385 3.689 . 0 0 "[ . 1 . 2]" 1
830 1 53 LYS HB3 1 54 GLU H 4.040 . 4.540 2.996 2.899 3.190 . 0 0 "[ . 1 . 2]" 1
831 1 53 LYS HB3 1 73 THR HB 4.360 . 4.860 2.444 2.379 2.584 . 0 0 "[ . 1 . 2]" 1
832 1 53 LYS HB3 1 73 THR MG 4.970 . 5.470 2.385 2.329 2.503 . 0 0 "[ . 1 . 2]" 1
833 1 53 LYS QD 1 73 THR HB 4.700 . 5.200 3.845 2.797 4.142 . 0 0 "[ . 1 . 2]" 1
834 1 53 LYS QD 1 73 THR MG 5.370 . 5.870 2.446 2.299 2.769 . 0 0 "[ . 1 . 2]" 1
835 1 53 LYS QE 1 73 THR MG 6.320 . 6.820 3.677 3.121 4.336 . 0 0 "[ . 1 . 2]" 1
836 1 53 LYS QE 1 75 MET ME 5.590 . 6.090 4.016 3.390 4.163 . 0 0 "[ . 1 . 2]" 1
837 1 53 LYS QG 1 54 GLU QB 5.750 . 6.250 3.316 3.029 3.742 . 0 0 "[ . 1 . 2]" 1
838 1 53 LYS HG2 1 73 THR HB 5.120 . 5.620 3.917 3.769 4.870 . 0 0 "[ . 1 . 2]" 1
839 1 53 LYS HG3 1 73 THR HB 5.120 . 5.620 5.126 4.817 5.171 . 0 0 "[ . 1 . 2]" 1
840 1 54 GLU H 1 54 GLU HG2 5.290 . 5.790 4.584 4.264 5.231 . 0 0 "[ . 1 . 2]" 1
841 1 54 GLU H 1 54 GLU HG3 5.290 . 5.790 4.874 4.688 4.983 . 0 0 "[ . 1 . 2]" 1
842 1 54 GLU H 1 73 THR H 3.980 . 4.480 3.011 2.907 3.329 . 0 0 "[ . 1 . 2]" 1
843 1 54 GLU H 1 73 THR HB 3.530 . 4.030 2.696 2.442 2.992 . 0 0 "[ . 1 . 2]" 1
844 1 54 GLU H 1 73 THR MG 5.480 . 5.980 4.119 4.028 4.400 . 0 0 "[ . 1 . 2]" 1
845 1 54 GLU HA 1 54 GLU HG2 4.050 . 4.550 3.286 2.848 3.809 . 0 0 "[ . 1 . 2]" 1
846 1 54 GLU HA 1 54 GLU HG3 4.050 . 4.550 2.711 2.440 3.201 . 0 0 "[ . 1 . 2]" 1
847 1 54 GLU HA 1 55 CYS H 3.460 . 3.960 2.323 2.161 3.504 . 0 0 "[ . 1 . 2]" 1
848 1 54 GLU QB 1 55 CYS HA 6.080 . 6.580 4.510 4.029 5.027 . 0 0 "[ . 1 . 2]" 1
849 1 54 GLU QB 1 56 LEU QD 8.230 . 8.730 4.467 4.214 4.834 . 0 0 "[ . 1 . 2]" 1
850 1 54 GLU QB 1 73 THR H 4.930 . 5.430 3.243 2.813 3.708 . 0 0 "[ . 1 . 2]" 1
851 1 54 GLU QB 1 73 THR HB 4.070 . 4.570 2.161 2.027 2.296 . 0 0 "[ . 1 . 2]" 1
852 1 54 GLU QB 1 73 THR MG 6.250 . 6.750 3.332 2.979 3.474 . 0 0 "[ . 1 . 2]" 1
853 1 54 GLU QG 1 55 CYS H 4.430 . 4.930 2.604 2.356 3.704 . 0 0 "[ . 1 . 2]" 1
854 1 54 GLU QG 1 55 CYS HA 5.990 . 6.490 3.584 3.383 4.255 . 0 0 "[ . 1 . 2]" 1
855 1 54 GLU QG 1 56 LEU QD 5.900 . 6.400 3.023 2.801 3.347 . 0 0 "[ . 1 . 2]" 1
856 1 54 GLU QG 1 73 THR HB 5.990 . 6.490 4.163 3.582 4.355 . 0 0 "[ . 1 . 2]" 1
857 1 54 GLU HG2 1 55 CYS H 4.740 . 5.240 2.985 2.410 4.214 . 0 0 "[ . 1 . 2]" 1
858 1 54 GLU HG2 1 56 LEU MD1 6.610 . 7.110 3.506 3.194 3.944 . 0 0 "[ . 1 . 2]" 1
859 1 54 GLU HG2 1 56 LEU MD2 6.610 . 7.110 4.055 3.659 4.952 . 0 0 "[ . 1 . 2]" 1
860 1 54 GLU HG2 1 56 LEU HG 4.380 . 4.880 2.832 2.403 3.884 . 0 0 "[ . 1 . 2]" 1
861 1 54 GLU HG3 1 55 CYS H 4.740 . 5.240 2.977 2.506 4.106 . 0 0 "[ . 1 . 2]" 1
862 1 54 GLU HG3 1 56 LEU MD1 6.610 . 7.110 4.044 3.538 4.547 . 0 0 "[ . 1 . 2]" 1
863 1 54 GLU HG3 1 56 LEU MD2 6.610 . 7.110 3.967 3.461 4.898 . 0 0 "[ . 1 . 2]" 1
864 1 54 GLU HG3 1 56 LEU HG 4.380 . 4.880 3.462 2.731 4.137 . 0 0 "[ . 1 . 2]" 1
865 1 55 CYS HA 1 56 LEU H 2.890 . 3.390 2.215 2.156 2.268 . 0 0 "[ . 1 . 2]" 1
866 1 55 CYS HA 1 56 LEU QB 5.190 . 5.690 4.071 3.779 4.288 . 0 0 "[ . 1 . 2]" 1
867 1 55 CYS HA 1 56 LEU MD1 6.610 . 7.110 4.949 4.786 5.244 . 0 0 "[ . 1 . 2]" 1
868 1 55 CYS HA 1 56 LEU MD2 6.610 . 7.110 4.991 4.778 5.509 . 0 0 "[ . 1 . 2]" 1
869 1 55 CYS HA 1 56 LEU HG 5.490 . 5.990 3.996 3.754 4.645 . 0 0 "[ . 1 . 2]" 1
870 1 55 CYS HA 1 71 PHE H 5.350 . 5.850 4.706 4.642 4.839 . 0 0 "[ . 1 . 2]" 1
871 1 55 CYS HA 1 72 VAL HA 3.390 . 3.890 2.345 2.298 2.443 . 0 0 "[ . 1 . 2]" 1
872 1 55 CYS HA 1 72 VAL HB 5.460 . 5.960 4.998 4.933 5.098 . 0 0 "[ . 1 . 2]" 1
873 1 55 CYS HA 1 72 VAL MG1 5.250 . 5.750 3.562 3.440 3.698 . 0 0 "[ . 1 . 2]" 1
874 1 55 CYS HA 1 72 VAL MG2 4.830 . 5.330 2.716 2.554 2.938 . 0 0 "[ . 1 . 2]" 1
875 1 55 CYS HA 1 73 THR H 4.140 . 4.640 3.569 3.408 3.676 . 0 0 "[ . 1 . 2]" 1
876 1 55 CYS QB 1 56 LEU H 4.210 . 4.710 2.957 2.836 3.143 . 0 0 "[ . 1 . 2]" 1
877 1 55 CYS QB 1 72 VAL HA 4.860 . 5.360 3.682 3.246 4.344 . 0 0 "[ . 1 . 2]" 1
878 1 55 CYS QB 1 72 VAL MG1 5.570 . 6.070 3.311 2.896 4.145 . 0 0 "[ . 1 . 2]" 1
879 1 55 CYS QB 1 72 VAL MG2 5.110 . 5.610 2.646 2.337 3.304 . 0 0 "[ . 1 . 2]" 1
880 1 56 LEU H 1 56 LEU HG 4.460 . 4.960 3.520 3.291 4.021 . 0 0 "[ . 1 . 2]" 1
881 1 56 LEU H 1 57 VAL H 4.660 . 5.160 4.369 4.332 4.422 . 0 0 "[ . 1 . 2]" 1
882 1 56 LEU H 1 57 VAL HA 5.500 . 6.000 4.977 4.916 5.015 . 0 0 "[ . 1 . 2]" 1
883 1 56 LEU H 1 71 PHE H 3.500 . 4.000 2.914 2.878 2.963 . 0 0 "[ . 1 . 2]" 1
884 1 56 LEU H 1 71 PHE HB2 4.680 . 5.180 3.862 3.660 3.978 . 0 0 "[ . 1 . 2]" 1
885 1 56 LEU H 1 71 PHE QD 6.170 . 6.670 5.415 5.233 5.517 . 0 0 "[ . 1 . 2]" 1
886 1 56 LEU H 1 72 VAL HA 4.060 . 4.560 3.680 3.583 3.733 . 0 0 "[ . 1 . 2]" 1
887 1 56 LEU H 1 72 VAL MG2 5.700 . 6.200 3.292 3.199 3.383 . 0 0 "[ . 1 . 2]" 1
888 1 56 LEU HA 1 56 LEU HG 4.240 . 4.740 3.075 2.794 3.185 . 0 0 "[ . 1 . 2]" 1
889 1 56 LEU HA 1 57 VAL H 3.180 . 3.680 2.198 2.172 2.264 . 0 0 "[ . 1 . 2]" 1
890 1 56 LEU QB 1 57 VAL H 4.280 . 4.780 2.887 2.636 3.182 . 0 0 "[ . 1 . 2]" 1
891 1 56 LEU QB 1 70 GLY HA2 5.400 . 5.900 3.934 3.710 4.084 . 0 0 "[ . 1 . 2]" 1
892 1 56 LEU QB 1 70 GLY HA3 5.580 . 6.080 4.266 4.094 4.446 . 0 0 "[ . 1 . 2]" 1
893 1 56 LEU QB 1 71 PHE H 4.140 . 4.640 2.763 2.600 2.962 . 0 0 "[ . 1 . 2]" 1
894 1 56 LEU QB 1 71 PHE HA 5.500 . 6.000 4.509 4.406 4.613 . 0 0 "[ . 1 . 2]" 1
895 1 56 LEU QB 1 71 PHE HB2 4.300 . 4.800 2.150 2.106 2.199 . 0 0 "[ . 1 . 2]" 1
896 1 56 LEU QB 1 71 PHE HB3 4.760 . 5.260 3.592 3.329 3.710 . 0 0 "[ . 1 . 2]" 1
897 1 56 LEU QB 1 71 PHE QD 5.050 . 5.550 3.312 3.152 3.394 . 0 0 "[ . 1 . 2]" 1
898 1 56 LEU QD 1 57 VAL H 4.830 . 5.330 3.260 2.749 3.399 . 0 0 "[ . 1 . 2]" 1
899 1 56 LEU QD 1 58 MET ME 5.210 . 5.710 2.195 2.005 3.056 . 0 0 "[ . 1 . 2]" 1
900 1 56 LEU QD 1 58 MET HG2 5.580 . 6.080 4.131 3.960 4.162 . 0 0 "[ . 1 . 2]" 1
901 1 56 LEU QD 1 71 PHE H 6.820 . 7.320 4.260 4.122 4.452 . 0 0 "[ . 1 . 2]" 1
902 1 56 LEU QD 1 71 PHE HB2 5.370 . 5.870 2.581 2.366 2.960 . 0 0 "[ . 1 . 2]" 1
903 1 56 LEU QD 1 71 PHE HB3 5.930 . 6.430 3.470 3.243 3.702 . 0 0 "[ . 1 . 2]" 1
904 1 56 LEU QD 1 71 PHE QD 6.260 . 6.760 3.508 3.338 3.676 . 0 0 "[ . 1 . 2]" 1
905 1 56 LEU MD1 1 57 VAL H 5.740 . 6.240 4.741 4.553 4.797 . 0 0 "[ . 1 . 2]" 1
906 1 56 LEU MD1 1 58 MET ME 5.410 . 5.910 2.322 2.124 3.235 . 0 0 "[ . 1 . 2]" 1
907 1 56 LEU MD1 1 58 MET HG2 6.610 . 7.110 4.393 4.213 4.611 . 0 0 "[ . 1 . 2]" 1
908 1 56 LEU MD1 1 71 PHE HB2 6.610 . 7.110 2.593 2.373 2.993 . 0 0 "[ . 1 . 2]" 1
909 1 56 LEU MD1 1 71 PHE QD 7.210 . 7.710 3.560 3.376 3.755 . 0 0 "[ . 1 . 2]" 1
910 1 56 LEU MD1 2 4 G H1' 4.200 . 4.700 3.546 3.503 3.590 . 0 0 "[ . 1 . 2]" 1
911 1 56 LEU MD1 2 4 G H8 4.200 . 4.700 2.064 1.993 2.243 . 0 0 "[ . 1 . 2]" 1
912 1 56 LEU MD2 1 57 VAL H 5.740 . 6.240 3.323 2.769 3.478 . 0 0 "[ . 1 . 2]" 1
913 1 56 LEU MD2 1 58 MET ME 5.410 . 5.910 2.713 2.461 3.757 . 0 0 "[ . 1 . 2]" 1
914 1 56 LEU MD2 1 58 MET HG2 6.610 . 7.110 5.044 4.730 5.265 . 0 0 "[ . 1 . 2]" 1
915 1 56 LEU MD2 1 71 PHE HB2 6.610 . 7.110 4.767 4.671 4.855 . 0 0 "[ . 1 . 2]" 1
916 1 56 LEU MD2 1 71 PHE QD 7.210 . 7.710 5.326 5.055 5.364 . 0 0 "[ . 1 . 2]" 1
917 1 56 LEU MD2 2 4 G H8 5.400 . 5.900 4.313 4.216 4.505 . 0 0 "[ . 1 . 2]" 1
918 1 56 LEU HG 1 57 VAL H 4.990 . 5.490 4.950 4.617 5.006 . 0 0 "[ . 1 . 2]" 1
919 1 56 LEU HG 1 71 PHE HB2 5.330 . 5.830 4.028 3.781 4.559 . 0 0 "[ . 1 . 2]" 1
920 1 57 VAL H 1 57 VAL HB 3.010 . 3.510 2.773 2.709 2.857 . 0 0 "[ . 1 . 2]" 1
921 1 57 VAL H 1 57 VAL MG2 4.140 . 4.640 3.213 3.164 3.284 . 0 0 "[ . 1 . 2]" 1
922 1 57 VAL HA 1 58 MET H 3.150 . 3.650 2.129 2.098 2.165 . 0 0 "[ . 1 . 2]" 1
923 1 57 VAL HA 1 58 MET HB2 5.320 . 5.820 4.369 4.232 4.532 . 0 0 "[ . 1 . 2]" 1
924 1 57 VAL HA 1 71 PHE H 4.680 . 5.180 3.708 3.654 3.812 . 0 0 "[ . 1 . 2]" 1
925 1 57 VAL HA 1 71 PHE QD 6.170 . 6.670 5.067 4.854 5.314 . 0 0 "[ . 1 . 2]" 1
926 1 57 VAL MG1 1 58 MET H 4.640 . 5.140 2.669 2.601 2.779 . 0 0 "[ . 1 . 2]" 1
927 1 57 VAL MG1 1 59 ARG QB 5.410 . 5.910 2.306 2.154 3.494 . 0 0 "[ . 1 . 2]" 1
928 1 57 VAL MG1 1 59 ARG HG2 5.500 . 6.000 3.437 3.027 3.707 . 0 0 "[ . 1 . 2]" 1
929 1 57 VAL MG1 1 59 ARG QG 5.270 . 5.770 3.275 2.208 3.419 . 0 0 "[ . 1 . 2]" 1
930 1 57 VAL MG1 1 59 ARG HG3 5.500 . 6.000 4.459 2.225 4.605 . 0 0 "[ . 1 . 2]" 1
931 1 57 VAL MG1 1 66 SER HB2 5.740 . 6.240 2.183 2.094 2.335 . 0 0 "[ . 1 . 2]" 1
932 1 57 VAL MG1 1 66 SER QB 5.310 . 5.810 2.128 2.029 2.278 . 0 0 "[ . 1 . 2]" 1
933 1 57 VAL MG1 1 66 SER HB3 5.740 . 6.240 2.952 2.722 3.169 . 0 0 "[ . 1 . 2]" 1
934 1 57 VAL MG1 1 66 SER HG 5.180 . 5.680 4.014 3.412 4.147 . 0 0 "[ . 1 . 2]" 1
935 1 57 VAL MG1 1 67 ARG H 6.610 . 7.110 5.176 4.847 5.522 . 0 0 "[ . 1 . 2]" 1
936 1 57 VAL MG1 1 68 GLY H 6.610 . 7.110 4.719 4.471 4.961 . 0 0 "[ . 1 . 2]" 1
937 1 57 VAL MG1 1 69 PHE H 5.380 . 5.880 3.962 3.777 4.147 . 0 0 "[ . 1 . 2]" 1
938 1 57 VAL MG1 1 71 PHE H 6.610 . 7.110 5.489 5.374 5.522 . 0 0 "[ . 1 . 2]" 1
939 1 57 VAL MG2 1 58 MET H 5.500 . 6.000 3.866 3.779 3.946 . 0 0 "[ . 1 . 2]" 1
940 1 57 VAL MG2 1 66 SER QB 6.070 . 6.570 3.711 3.461 4.053 . 0 0 "[ . 1 . 2]" 1
941 1 57 VAL MG2 1 70 GLY HA2 5.640 . 6.140 3.901 3.776 4.033 . 0 0 "[ . 1 . 2]" 1
942 1 57 VAL MG2 1 70 GLY HA3 5.090 . 5.590 2.852 2.731 3.019 . 0 0 "[ . 1 . 2]" 1
943 1 57 VAL MG2 1 71 PHE H 5.720 . 6.220 4.016 3.938 4.168 . 0 0 "[ . 1 . 2]" 1
944 1 58 MET H 1 58 MET HB2 4.050 . 4.550 2.348 2.271 2.506 . 0 0 "[ . 1 . 2]" 1
945 1 58 MET H 1 58 MET ME 5.570 . 6.070 3.711 3.572 4.384 . 0 0 "[ . 1 . 2]" 1
946 1 58 MET H 1 58 MET HG2 4.020 . 4.520 2.588 2.355 2.731 . 0 0 "[ . 1 . 2]" 1
947 1 58 MET H 1 58 MET HG3 4.460 . 4.960 3.728 3.630 3.812 . 0 0 "[ . 1 . 2]" 1
948 1 58 MET H 1 70 GLY HA3 4.450 . 4.950 3.716 3.626 3.878 . 0 0 "[ . 1 . 2]" 1
949 1 58 MET HA 1 58 MET ME 3.980 . 4.480 2.287 2.196 2.408 . 0 0 "[ . 1 . 2]" 1
950 1 58 MET HA 1 59 ARG H 3.110 . 3.610 2.630 2.499 2.738 . 0 0 "[ . 1 . 2]" 1
951 1 58 MET QB 1 67 ARG HE 112.250 4.500 112.750 5.124 3.939 5.827 0.561 16 3 "[ - * 1 .+ 2]" 1
952 1 58 MET HB2 1 59 ARG H 4.700 . 5.200 4.410 4.331 4.502 . 0 0 "[ . 1 . 2]" 1
953 1 58 MET HB2 1 67 ARG QB 4.830 . 5.330 3.721 3.259 4.323 . 0 0 "[ . 1 . 2]" 1
954 1 58 MET HB2 1 69 PHE QE 5.470 . 5.970 3.122 2.955 3.442 . 0 0 "[ . 1 . 2]" 1
955 1 58 MET HB2 1 69 PHE HZ 5.400 . 5.900 3.061 2.867 3.653 . 0 0 "[ . 1 . 2]" 1
956 1 58 MET HB2 1 70 GLY HA3 5.500 . 6.000 5.272 5.080 5.501 . 0 0 "[ . 1 . 2]" 1
957 1 58 MET HB3 1 58 MET ME 4.420 . 4.920 3.572 2.308 3.730 . 0 0 "[ . 1 . 2]" 1
958 1 58 MET HB3 1 69 PHE QE 5.610 . 6.110 3.554 3.280 3.885 . 0 0 "[ . 1 . 2]" 1
959 1 58 MET HB3 1 69 PHE HZ 5.500 . 6.000 2.970 2.601 3.639 . 0 0 "[ . 1 . 2]" 1
960 1 58 MET ME 1 59 ARG H 5.200 . 5.700 4.198 4.017 4.362 . 0 0 "[ . 1 . 2]" 1
961 1 58 MET ME 1 69 PHE QE 6.890 . 7.390 4.662 4.076 4.954 . 0 0 "[ . 1 . 2]" 1
962 1 58 MET ME 1 69 PHE HZ 6.580 . 7.080 5.176 4.078 5.481 . 0 0 "[ . 1 . 2]" 1
963 1 58 MET ME 1 71 PHE QD 5.570 . 6.070 3.380 3.165 4.155 . 0 0 "[ . 1 . 2]" 1
964 1 58 MET ME 1 71 PHE QE 5.880 . 6.380 4.356 4.195 4.382 . 0 0 "[ . 1 . 2]" 1
965 1 58 MET ME 2 4 G H1' 4.200 . 4.700 2.761 2.043 3.132 . 0 0 "[ . 1 . 2]" 1
966 1 58 MET ME 2 4 G H2' 6.610 . 7.110 4.832 3.930 5.360 . 0 0 "[ . 1 . 2]" 1
967 1 58 MET ME 2 4 G H3' 120.090 4.500 120.590 5.891 4.729 6.359 . 0 0 "[ . 1 . 2]" 1
968 1 58 MET ME 2 4 G H8 4.200 . 4.700 3.055 2.735 3.520 . 0 0 "[ . 1 . 2]" 1
969 1 58 MET ME 2 5 U H6 6.610 . 7.110 4.975 4.150 5.507 . 0 0 "[ . 1 . 2]" 1
970 1 58 MET HG2 1 69 PHE QE 5.040 . 5.540 3.584 3.288 3.864 . 0 0 "[ . 1 . 2]" 1
971 1 58 MET HG2 1 69 PHE HZ 5.110 . 5.610 4.329 4.202 4.593 . 0 0 "[ . 1 . 2]" 1
972 1 58 MET HG2 1 70 GLY HA2 4.150 . 4.650 2.792 2.190 3.085 . 0 0 "[ . 1 . 2]" 1
973 1 58 MET HG2 1 70 GLY HA3 5.020 . 5.520 4.374 3.917 4.543 . 0 0 "[ . 1 . 2]" 1
974 1 58 MET HG2 1 71 PHE H 4.990 . 5.490 4.650 4.103 4.884 . 0 0 "[ . 1 . 2]" 1
975 1 58 MET HG2 1 71 PHE QD 5.250 . 5.750 3.063 2.687 3.593 . 0 0 "[ . 1 . 2]" 1
976 1 58 MET HG2 1 71 PHE QE 5.260 . 5.760 4.003 3.741 4.554 . 0 0 "[ . 1 . 2]" 1
977 1 58 MET HG3 1 69 PHE QE 4.270 . 4.770 2.298 2.189 2.476 . 0 0 "[ . 1 . 2]" 1
978 1 58 MET HG3 1 69 PHE HZ 4.270 . 4.770 2.793 2.602 3.249 . 0 0 "[ . 1 . 2]" 1
979 1 58 MET HG3 1 70 GLY HA2 4.440 . 4.940 3.782 3.703 3.843 . 0 0 "[ . 1 . 2]" 1
980 1 58 MET HG3 1 70 GLY HA3 5.500 . 6.000 5.521 5.458 5.545 . 0 0 "[ . 1 . 2]" 1
981 1 58 MET HG3 1 71 PHE QD 5.220 . 5.720 3.306 2.767 3.932 . 0 0 "[ . 1 . 2]" 1
982 1 58 MET HG3 1 71 PHE QE 4.840 . 5.340 3.036 2.478 3.853 . 0 0 "[ . 1 . 2]" 1
983 1 59 ARG H 1 59 ARG QG 3.870 . 4.370 2.250 2.008 2.990 . 0 0 "[ . 1 . 2]" 1
984 1 59 ARG H 1 60 ASP H 4.910 . 5.410 4.640 4.520 4.662 . 0 0 "[ . 1 . 2]" 1
985 1 59 ARG QB 1 60 ASP H 3.870 . 4.370 2.677 2.433 3.319 . 0 0 "[ . 1 . 2]" 1
986 1 59 ARG QB 1 64 LYS HA 4.400 . 4.900 3.208 2.984 3.513 . 0 0 "[ . 1 . 2]" 1
987 1 59 ARG QB 1 66 SER QB 5.030 . 5.530 3.395 3.059 4.054 . 0 0 "[ . 1 . 2]" 1
988 1 59 ARG HD2 1 60 ASP H 5.360 . 5.860 4.988 4.604 5.372 . 0 0 "[ . 1 . 2]" 1
989 1 59 ARG HD2 1 64 LYS HA 4.960 . 5.460 3.204 2.552 3.852 . 0 0 "[ . 1 . 2]" 1
990 1 59 ARG HD2 1 64 LYS QB 4.860 . 5.360 3.721 3.006 4.308 . 0 0 "[ . 1 . 2]" 1
991 1 59 ARG HD2 1 66 SER QB 5.980 . 6.480 5.233 4.322 5.359 . 0 0 "[ . 1 . 2]" 1
992 1 59 ARG HD3 1 66 SER QB 5.990 . 6.490 4.723 3.194 5.155 . 0 0 "[ . 1 . 2]" 1
993 1 59 ARG QG 1 60 ASP H 5.420 . 5.920 3.772 3.551 3.971 . 0 0 "[ . 1 . 2]" 1
994 1 59 ARG QG 1 64 LYS HA 4.400 . 4.900 3.799 3.253 3.964 . 0 0 "[ . 1 . 2]" 1
995 1 60 ASP H 1 60 ASP HB2 3.680 . 4.180 2.560 2.311 2.719 . 0 0 "[ . 1 . 2]" 1
996 1 60 ASP H 1 60 ASP QB 3.470 . 3.970 2.223 2.168 2.347 . 0 0 "[ . 1 . 2]" 1
997 1 60 ASP H 1 60 ASP HB3 3.680 . 4.180 2.658 2.306 3.626 . 0 0 "[ . 1 . 2]" 1
998 1 60 ASP H 1 61 PRO QD 5.840 . 6.340 4.411 4.359 4.463 . 0 0 "[ . 1 . 2]" 1
999 1 60 ASP H 1 63 THR H 5.190 . 5.690 5.185 5.014 5.240 . 0 0 "[ . 1 . 2]" 1
1000 1 60 ASP H 1 64 LYS H 5.440 . 5.940 4.466 4.398 4.549 . 0 0 "[ . 1 . 2]" 1
1001 1 60 ASP H 1 64 LYS HA 4.440 . 4.940 4.166 4.064 4.267 . 0 0 "[ . 1 . 2]" 1
1002 1 60 ASP H 1 65 ARG H 4.250 . 4.750 3.899 3.812 3.980 . 0 0 "[ . 1 . 2]" 1
1003 1 60 ASP H 1 65 ARG HA 5.500 . 6.000 4.888 4.825 4.978 . 0 0 "[ . 1 . 2]" 1
1004 1 60 ASP HA 1 61 PRO HD2 3.390 . 3.890 2.371 2.205 2.446 . 0 0 "[ . 1 . 2]" 1
1005 1 60 ASP HA 1 61 PRO HD3 3.390 . 3.890 2.360 2.312 2.572 . 0 0 "[ . 1 . 2]" 1
1006 1 60 ASP HA 1 61 PRO HG3 4.600 . 5.100 4.545 4.522 4.604 . 0 0 "[ . 1 . 2]" 1
1007 1 60 ASP QB 1 61 PRO QD 4.660 . 5.160 3.439 2.842 3.699 . 0 0 "[ . 1 . 2]" 1
1008 1 60 ASP QB 1 62 LEU H 4.860 . 5.360 3.596 2.724 3.916 . 0 0 "[ . 1 . 2]" 1
1009 1 60 ASP QB 1 63 THR H 4.330 . 4.830 3.145 2.566 3.287 . 0 0 "[ . 1 . 2]" 1
1010 1 60 ASP QB 1 63 THR MG 6.350 . 6.850 3.958 3.626 4.178 . 0 0 "[ . 1 . 2]" 1
1011 1 60 ASP QB 1 65 ARG H 4.650 . 5.150 3.078 2.790 3.434 . 0 0 "[ . 1 . 2]" 1
1012 1 60 ASP QB 1 65 ARG QB 6.730 . 7.230 2.902 2.468 4.042 . 0 0 "[ . 1 . 2]" 1
1013 1 60 ASP HB2 1 63 THR H 4.630 . 5.130 4.309 3.151 4.654 . 0 0 "[ . 1 . 2]" 1
1014 1 60 ASP HB2 1 63 THR MG 6.610 . 7.110 4.847 4.181 5.178 . 0 0 "[ . 1 . 2]" 1
1015 1 60 ASP HB2 1 64 LYS H 5.070 . 5.570 4.705 3.149 5.092 . 0 0 "[ . 1 . 2]" 1
1016 1 60 ASP HB2 1 65 ARG H 4.820 . 5.320 4.331 2.824 4.795 . 0 0 "[ . 1 . 2]" 1
1017 1 60 ASP HB3 1 63 THR H 4.630 . 5.130 3.260 2.718 3.401 . 0 0 "[ . 1 . 2]" 1
1018 1 60 ASP HB3 1 63 THR MG 6.610 . 7.110 4.212 3.977 4.677 . 0 0 "[ . 1 . 2]" 1
1019 1 60 ASP HB3 1 64 LYS H 5.070 . 5.570 3.574 3.222 4.379 . 0 0 "[ . 1 . 2]" 1
1020 1 60 ASP HB3 1 65 ARG H 4.820 . 5.320 3.474 2.933 4.853 . 0 0 "[ . 1 . 2]" 1
1021 1 61 PRO HA 1 64 LYS H 4.330 . 4.830 3.816 3.522 3.980 . 0 0 "[ . 1 . 2]" 1
1022 1 61 PRO HA 1 64 LYS HA 3.880 . 4.380 3.881 3.732 3.918 . 0 0 "[ . 1 . 2]" 1
1023 1 61 PRO HA 1 64 LYS QD 4.700 . 5.200 3.352 3.050 3.720 . 0 0 "[ . 1 . 2]" 1
1024 1 61 PRO HB2 1 62 LEU H 4.040 . 4.540 3.941 3.837 4.010 . 0 0 "[ . 1 . 2]" 1
1025 1 61 PRO HB2 1 62 LEU QD 5.810 . 6.310 3.403 3.083 4.060 . 0 0 "[ . 1 . 2]" 1
1026 1 61 PRO HB3 1 62 LEU H 4.560 . 5.060 4.499 4.416 4.565 . 0 0 "[ . 1 . 2]" 1
1027 1 61 PRO QD 1 62 LEU H 3.820 . 4.320 2.800 2.698 2.859 . 0 0 "[ . 1 . 2]" 1
1028 1 61 PRO HG2 1 62 LEU H 3.430 . 3.930 2.984 2.808 3.146 . 0 0 "[ . 1 . 2]" 1
1029 1 61 PRO HG2 1 62 LEU QD 6.230 . 6.730 2.518 2.144 3.298 . 0 0 "[ . 1 . 2]" 1
1030 1 61 PRO HG3 1 62 LEU H 4.610 . 5.110 4.421 4.280 4.546 . 0 0 "[ . 1 . 2]" 1
1031 1 62 LEU H 1 62 LEU HB2 3.520 . 4.020 2.337 2.251 2.491 . 0 0 "[ . 1 . 2]" 1
1032 1 62 LEU H 1 62 LEU QB 3.220 . 3.720 2.306 2.226 2.448 . 0 0 "[ . 1 . 2]" 1
1033 1 62 LEU H 1 62 LEU HB3 3.520 . 4.020 3.548 3.524 3.597 . 0 0 "[ . 1 . 2]" 1
1034 1 62 LEU H 1 62 LEU MD1 5.220 . 5.720 3.428 2.573 4.038 . 0 0 "[ . 1 . 2]" 1
1035 1 62 LEU H 1 62 LEU MD2 5.220 . 5.720 3.242 2.092 4.079 . 0 0 "[ . 1 . 2]" 1
1036 1 62 LEU H 1 62 LEU HG 4.310 . 4.810 3.513 2.326 4.194 . 0 0 "[ . 1 . 2]" 1
1037 1 62 LEU H 1 63 THR H 3.060 . 3.560 2.367 2.247 2.583 . 0 0 "[ . 1 . 2]" 1
1038 1 62 LEU H 1 63 THR MG 5.660 . 6.160 4.097 3.936 4.491 . 0 0 "[ . 1 . 2]" 1
1039 1 62 LEU H 1 64 LYS H 4.880 . 5.380 3.598 3.418 3.849 . 0 0 "[ . 1 . 2]" 1
1040 1 62 LEU HA 1 62 LEU QD 4.000 . 4.500 2.276 2.076 2.634 . 0 0 "[ . 1 . 2]" 1
1041 1 62 LEU HA 1 62 LEU HG 3.960 . 4.460 3.193 2.466 3.773 . 0 0 "[ . 1 . 2]" 1
1042 1 62 LEU QB 1 63 THR HB 5.560 . 6.060 4.967 4.903 4.994 . 0 0 "[ . 1 . 2]" 1
1043 1 62 LEU HB2 1 63 THR H 3.690 . 4.190 2.740 2.531 3.057 . 0 0 "[ . 1 . 2]" 1
1044 1 62 LEU HB2 1 63 THR MG 4.460 . 4.960 2.783 2.582 2.922 . 0 0 "[ . 1 . 2]" 1
1045 1 62 LEU HB3 1 63 THR H 3.690 . 4.190 3.541 3.301 3.736 . 0 0 "[ . 1 . 2]" 1
1046 1 62 LEU HB3 1 63 THR MG 4.460 . 4.960 2.981 2.685 3.401 . 0 0 "[ . 1 . 2]" 1
1047 1 63 THR H 1 63 THR HB 4.170 . 4.670 3.730 3.651 3.858 . 0 0 "[ . 1 . 2]" 1
1048 1 63 THR H 1 63 THR MG 3.750 . 4.250 2.639 2.448 3.031 . 0 0 "[ . 1 . 2]" 1
1049 1 63 THR H 1 64 LYS HA 4.400 . 4.900 4.338 4.087 4.431 . 0 0 "[ . 1 . 2]" 1
1050 1 63 THR H 1 65 ARG H 4.740 . 5.240 3.892 3.623 4.030 . 0 0 "[ . 1 . 2]" 1
1051 1 63 THR HB 1 64 LYS QD 5.990 . 6.490 5.084 4.936 5.387 . 0 0 "[ . 1 . 2]" 1
1052 1 63 THR HB 1 65 ARG H 4.670 . 5.170 3.379 3.123 3.625 . 0 0 "[ . 1 . 2]" 1
1053 1 63 THR HB 1 65 ARG QB 5.160 . 5.660 4.019 3.778 4.291 . 0 0 "[ . 1 . 2]" 1
1054 1 63 THR HB 1 65 ARG QG 4.850 . 5.350 2.750 2.406 4.263 . 0 0 "[ . 1 . 2]" 1
1055 1 63 THR MG 1 64 LYS H 5.180 . 5.680 4.157 4.092 4.291 . 0 0 "[ . 1 . 2]" 1
1056 1 63 THR MG 1 65 ARG H 5.360 . 5.860 4.375 4.212 4.497 . 0 0 "[ . 1 . 2]" 1
1057 1 64 LYS H 1 64 LYS QD 4.960 . 5.460 2.299 2.262 2.364 . 0 0 "[ . 1 . 2]" 1
1058 1 64 LYS H 1 64 LYS QE 5.350 . 5.850 4.360 3.569 4.474 . 0 0 "[ . 1 . 2]" 1
1059 1 64 LYS H 1 64 LYS HG2 4.540 . 5.040 4.507 3.450 4.578 . 0 0 "[ . 1 . 2]" 1
1060 1 64 LYS H 1 64 LYS QG 4.390 . 4.890 3.612 3.350 3.656 . 0 0 "[ . 1 . 2]" 1
1061 1 64 LYS H 1 64 LYS HG3 4.540 . 5.040 3.842 3.748 4.540 . 0 0 "[ . 1 . 2]" 1
1062 1 64 LYS H 1 65 ARG H 4.050 . 4.550 2.830 2.777 2.902 . 0 0 "[ . 1 . 2]" 1
1063 1 64 LYS HA 1 64 LYS HD2 4.310 . 4.810 2.823 2.767 2.898 . 0 0 "[ . 1 . 2]" 1
1064 1 64 LYS HA 1 64 LYS QD 4.100 . 4.600 2.750 2.701 2.853 . 0 0 "[ . 1 . 2]" 1
1065 1 64 LYS HA 1 64 LYS HD3 4.310 . 4.810 3.799 3.723 4.259 . 0 0 "[ . 1 . 2]" 1
1066 1 64 LYS HA 1 64 LYS QE 6.040 . 6.540 4.151 2.397 4.309 . 0 0 "[ . 1 . 2]" 1
1067 1 64 LYS HA 1 64 LYS HG2 3.940 . 4.440 3.675 3.649 3.700 . 0 0 "[ . 1 . 2]" 1
1068 1 64 LYS HA 1 64 LYS QG 3.770 . 4.270 2.506 2.421 3.369 . 0 0 "[ . 1 . 2]" 1
1069 1 64 LYS HA 1 64 LYS HG3 3.940 . 4.440 2.570 2.457 3.920 . 0 0 "[ . 1 . 2]" 1
1070 1 65 ARG H 1 65 ARG QB 3.590 . 4.090 2.402 2.253 2.537 . 0 0 "[ . 1 . 2]" 1
1071 1 65 ARG H 1 65 ARG QG 4.240 . 4.740 2.355 2.088 3.550 . 0 0 "[ . 1 . 2]" 1
1072 1 65 ARG HA 1 66 SER H 3.460 . 3.960 2.140 2.065 2.231 . 0 0 "[ . 1 . 2]" 1
1073 1 65 ARG HA 1 66 SER QB 5.070 . 5.570 4.218 4.152 4.358 . 0 0 "[ . 1 . 2]" 1
1074 1 65 ARG HA 1 67 ARG H 3.680 . 4.180 3.726 3.667 3.756 . 0 0 "[ . 1 . 2]" 1
1075 1 65 ARG QB 1 66 SER H 4.830 . 5.330 3.189 2.931 3.359 . 0 0 "[ . 1 . 2]" 1
1076 1 65 ARG QB 1 67 ARG H 4.650 . 5.150 2.559 2.295 2.819 . 0 0 "[ . 1 . 2]" 1
1077 1 65 ARG QB 1 67 ARG QG 4.650 . 5.150 3.675 3.443 3.751 . 0 0 "[ . 1 . 2]" 1
1078 1 65 ARG QG 1 66 SER H 5.060 . 5.560 4.143 3.766 4.587 . 0 0 "[ . 1 . 2]" 1
1079 1 66 SER H 1 66 SER HB2 4.130 . 4.630 3.563 3.531 3.622 . 0 0 "[ . 1 . 2]" 1
1080 1 66 SER H 1 66 SER HB3 4.130 . 4.630 2.410 2.264 2.636 . 0 0 "[ . 1 . 2]" 1
1081 1 66 SER H 1 66 SER HG 5.190 . 5.690 3.257 3.153 3.389 . 0 0 "[ . 1 . 2]" 1
1082 1 66 SER QB 1 68 GLY H 5.140 . 5.640 3.202 3.116 3.320 . 0 0 "[ . 1 . 2]" 1
1083 1 66 SER HG 1 68 GLY H 4.060 . 4.560 2.866 2.808 2.939 . 0 0 "[ . 1 . 2]" 1
1084 1 67 ARG H 1 67 ARG HG2 4.730 . 5.230 3.598 3.044 4.048 . 0 0 "[ . 1 . 2]" 1
1085 1 67 ARG H 1 67 ARG QG 4.530 . 5.030 2.988 2.892 3.762 . 0 0 "[ . 1 . 2]" 1
1086 1 67 ARG H 1 67 ARG HG3 4.730 . 5.230 3.261 3.006 4.468 . 0 0 "[ . 1 . 2]" 1
1087 1 67 ARG H 1 68 GLY H 3.600 . 4.100 2.721 2.653 2.778 . 0 0 "[ . 1 . 2]" 1
1088 1 67 ARG H 1 69 PHE H 5.120 . 5.620 4.700 4.620 4.768 . 0 0 "[ . 1 . 2]" 1
1089 1 67 ARG HA 1 67 ARG QG 3.370 . 3.870 2.399 2.070 2.585 . 0 0 "[ . 1 . 2]" 1
1090 1 67 ARG HA 1 68 GLY QA 5.560 . 6.060 4.198 4.101 4.278 . 0 0 "[ . 1 . 2]" 1
1091 1 67 ARG HA 1 69 PHE H 5.350 . 5.850 4.730 4.680 4.820 . 0 0 "[ . 1 . 2]" 1
1092 1 67 ARG QB 1 69 PHE H 5.120 . 5.620 3.410 3.203 3.630 . 0 0 "[ . 1 . 2]" 1
1093 1 67 ARG QB 1 69 PHE HZ 5.790 . 6.290 4.428 4.182 4.890 . 0 0 "[ . 1 . 2]" 1
1094 1 67 ARG HB2 1 67 ARG HE 5.260 . 5.760 3.689 2.936 4.722 . 0 0 "[ . 1 . 2]" 1
1095 1 67 ARG HB2 1 69 PHE QE 4.740 . 5.240 2.721 2.407 4.243 . 0 0 "[ . 1 . 2]" 1
1096 1 67 ARG HB3 1 67 ARG HE 5.260 . 5.760 2.963 2.288 4.473 . 0 0 "[ . 1 . 2]" 1
1097 1 67 ARG HB3 1 69 PHE QE 4.740 . 5.240 2.821 2.306 3.608 . 0 0 "[ . 1 . 2]" 1
1098 1 67 ARG HD2 1 69 PHE QE 4.850 . 5.350 3.890 2.103 4.336 . 0 0 "[ . 1 . 2]" 1
1099 1 67 ARG HD3 1 69 PHE QE 4.850 . 5.350 3.160 2.228 4.403 . 0 0 "[ . 1 . 2]" 1
1100 1 67 ARG HE 1 69 PHE QE 4.800 . 5.300 3.496 2.660 4.337 . 0 0 "[ . 1 . 2]" 1
1101 1 67 ARG QG 1 69 PHE QE 6.270 . 6.770 3.974 2.999 4.262 . 0 0 "[ . 1 . 2]" 1
1102 1 68 GLY H 1 69 PHE H 3.480 . 3.980 2.688 2.645 2.743 . 0 0 "[ . 1 . 2]" 1
1103 1 69 PHE HA 2 4 G H2' 100.000 5.500 100.500 12.662 12.346 12.917 . 0 0 "[ . 1 . 2]" 1
1104 1 69 PHE QB 2 2 U H1' 5.050 . 5.550 3.465 3.090 3.716 . 0 0 "[ . 1 . 2]" 1
1105 1 69 PHE QB 2 2 U H4' 5.050 . 5.550 2.212 2.083 2.336 . 0 0 "[ . 1 . 2]" 1
1106 1 69 PHE HB2 1 70 GLY H 4.450 . 4.950 2.477 2.429 2.523 . 0 0 "[ . 1 . 2]" 1
1107 1 69 PHE HB2 1 70 GLY HA3 5.500 . 6.000 4.994 4.945 5.047 . 0 0 "[ . 1 . 2]" 1
1108 1 69 PHE HB3 1 70 GLY H 4.170 . 4.670 3.854 3.818 3.883 . 0 0 "[ . 1 . 2]" 1
1109 1 69 PHE QE 1 70 GLY HA2 5.370 . 5.870 4.186 3.819 4.503 . 0 0 "[ . 1 . 2]" 1
1110 1 69 PHE QE 1 71 PHE QD 6.210 . 6.710 3.532 3.403 3.773 . 0 0 "[ . 1 . 2]" 1
1111 1 69 PHE QE 1 71 PHE QE 5.140 . 5.640 2.162 2.118 2.207 . 0 0 "[ . 1 . 2]" 1
1112 1 69 PHE QE 1 71 PHE HZ 4.970 . 5.470 4.012 3.783 4.154 . 0 0 "[ . 1 . 2]" 1
1113 1 69 PHE QE 2 3 A H1' 6.170 . 6.670 4.682 3.849 5.056 . 0 0 "[ . 1 . 2]" 1
1114 1 69 PHE QE 2 3 A H4' 5.050 . 5.550 2.878 2.639 3.077 . 0 0 "[ . 1 . 2]" 1
1115 1 69 PHE HZ 1 71 PHE QD 6.170 . 6.670 5.544 5.531 5.581 . 0 0 "[ . 1 . 2]" 1
1116 1 69 PHE HZ 1 71 PHE QE 5.700 . 6.200 4.228 4.159 4.325 . 0 0 "[ . 1 . 2]" 1
1117 1 69 PHE HZ 2 3 A H4' 4.500 . 5.000 2.567 2.434 2.921 . 0 0 "[ . 1 . 2]" 1
1118 1 70 GLY HA3 1 71 PHE H 3.200 . 3.700 2.297 2.269 2.328 . 0 0 "[ . 1 . 2]" 1
1119 1 70 GLY HA3 1 71 PHE HA 4.980 . 5.480 4.438 4.398 4.459 . 0 0 "[ . 1 . 2]" 1
1120 1 70 GLY HA3 1 71 PHE QD 5.800 . 6.300 4.377 4.250 4.594 . 0 0 "[ . 1 . 2]" 1
1121 1 71 PHE H 1 71 PHE HB2 3.870 . 4.370 2.788 2.745 2.815 . 0 0 "[ . 1 . 2]" 1
1122 1 71 PHE H 1 71 PHE QD 4.730 . 5.230 3.477 3.358 3.611 . 0 0 "[ . 1 . 2]" 1
1123 1 71 PHE H 1 72 VAL MG2 5.000 . 5.500 3.808 3.705 3.911 . 0 0 "[ . 1 . 2]" 1
1124 1 71 PHE HA 1 71 PHE QD 4.220 . 4.720 3.015 2.849 3.087 . 0 0 "[ . 1 . 2]" 1
1125 1 71 PHE HA 1 72 VAL H 2.980 . 3.480 2.255 2.239 2.275 . 0 0 "[ . 1 . 2]" 1
1126 1 71 PHE HA 1 72 VAL HB 4.820 . 5.320 4.594 4.515 4.693 . 0 0 "[ . 1 . 2]" 1
1127 1 71 PHE HA 1 72 VAL MG2 5.540 . 6.040 3.802 3.679 3.860 . 0 0 "[ . 1 . 2]" 1
1128 1 71 PHE HB2 1 72 VAL H 4.490 . 4.990 4.044 3.999 4.158 . 0 0 "[ . 1 . 2]" 1
1129 1 71 PHE HB3 1 72 VAL H 3.820 . 4.320 2.845 2.776 2.980 . 0 0 "[ . 1 . 2]" 1
1130 1 71 PHE QD 1 72 VAL H 4.800 . 5.300 3.613 3.515 3.718 . 0 0 "[ . 1 . 2]" 1
1131 1 71 PHE QD 1 101 ALA MB 4.930 . 5.430 2.707 2.527 3.008 . 0 0 "[ . 1 . 2]" 1
1132 1 71 PHE QD 2 3 A H2 6.170 . 6.670 4.652 4.450 4.798 . 0 0 "[ . 1 . 2]" 1
1133 1 71 PHE QD 2 4 G H2' 112.250 5.500 112.750 6.002 5.833 6.155 . 0 0 "[ . 1 . 2]" 1
1134 1 71 PHE QD 2 4 G H8 5.050 . 5.550 3.336 3.019 3.633 . 0 0 "[ . 1 . 2]" 1
1135 1 71 PHE QD 2 5 U H1' 112.250 5.500 112.750 8.749 8.250 9.572 . 0 0 "[ . 1 . 2]" 1
1136 1 71 PHE QD 2 5 U H2' 112.250 5.500 112.750 6.731 6.057 7.150 . 0 0 "[ . 1 . 2]" 1
1137 1 71 PHE QE 1 101 ALA MB 5.220 . 5.720 2.534 2.307 3.050 . 0 0 "[ . 1 . 2]" 1
1138 1 71 PHE QE 1 105 ARG QD 125.990 5.500 126.490 11.187 8.289 15.240 . 0 0 "[ . 1 . 2]" 1
1139 1 71 PHE QE 2 3 A H1' 5.050 . 5.550 4.338 3.776 4.532 . 0 0 "[ . 1 . 2]" 1
1140 1 71 PHE QE 2 3 A H2 5.050 . 5.550 2.330 2.139 2.496 . 0 0 "[ . 1 . 2]" 1
1141 1 71 PHE QE 2 4 G H2' 112.250 5.500 112.750 5.144 5.072 5.293 0.428 18 0 "[ . 1 . 2]" 1
1142 1 71 PHE QE 2 4 G H8 5.050 . 5.550 4.052 3.718 4.321 . 0 0 "[ . 1 . 2]" 1
1143 1 71 PHE QE 2 5 U H1' 112.250 5.500 112.750 8.430 7.968 9.398 . 0 0 "[ . 1 . 2]" 1
1144 1 71 PHE QE 2 5 U H2' 112.250 5.500 112.750 6.110 5.692 6.785 . 0 0 "[ . 1 . 2]" 1
1145 1 71 PHE HZ 1 101 ALA MB 6.610 . 7.110 4.664 4.407 5.138 . 0 0 "[ . 1 . 2]" 1
1146 1 71 PHE HZ 2 3 A H1' 4.500 . 5.000 3.365 2.480 3.684 . 0 0 "[ . 1 . 2]" 1
1147 1 71 PHE HZ 2 3 A H2 4.500 . 5.000 3.005 2.700 3.773 . 0 0 "[ . 1 . 2]" 1
1148 1 71 PHE HZ 2 3 A H4' 5.500 . 6.000 5.027 4.193 5.508 . 0 0 "[ . 1 . 2]" 1
1149 1 71 PHE HZ 2 4 G H2' 100.000 5.500 100.500 5.766 5.547 6.108 . 0 0 "[ . 1 . 2]" 1
1150 1 71 PHE HZ 2 4 G H8 5.500 . 6.000 5.324 5.002 5.523 . 0 0 "[ . 1 . 2]" 1
1151 1 71 PHE HZ 2 5 U H1' 100.000 5.500 100.500 9.269 8.577 10.460 . 0 0 "[ . 1 . 2]" 1
1152 1 71 PHE HZ 2 5 U H2' 100.000 5.500 100.500 6.557 6.051 7.454 . 0 0 "[ . 1 . 2]" 1
1153 1 72 VAL H 1 72 VAL HB 3.510 . 4.010 2.880 2.842 2.914 . 0 0 "[ . 1 . 2]" 1
1154 1 72 VAL HA 1 73 THR H 2.990 . 3.490 2.134 2.061 2.187 . 0 0 "[ . 1 . 2]" 1
1155 1 72 VAL HA 1 73 THR HB 4.870 . 5.370 4.740 4.644 4.824 . 0 0 "[ . 1 . 2]" 1
1156 1 72 VAL HB 1 73 THR H 4.650 . 5.150 4.152 4.083 4.251 . 0 0 "[ . 1 . 2]" 1
1157 1 72 VAL HB 1 74 PHE QD 6.120 . 6.620 4.841 4.601 5.164 . 0 0 "[ . 1 . 2]" 1
1158 1 72 VAL HB 1 74 PHE QE 5.510 . 6.010 3.560 3.195 4.285 . 0 0 "[ . 1 . 2]" 1
1159 1 72 VAL MG1 1 73 THR H 4.480 . 4.980 2.556 2.436 2.737 . 0 0 "[ . 1 . 2]" 1
1160 1 72 VAL MG1 1 74 PHE H 5.900 . 6.400 4.204 3.926 4.414 . 0 0 "[ . 1 . 2]" 1
1161 1 72 VAL MG1 1 74 PHE QD 5.780 . 6.280 3.357 3.170 3.605 . 0 0 "[ . 1 . 2]" 1
1162 1 72 VAL MG1 1 74 PHE QE 5.300 . 5.800 2.994 2.842 3.357 . 0 0 "[ . 1 . 2]" 1
1163 1 72 VAL MG1 1 74 PHE HZ 5.240 . 5.740 3.303 3.089 3.742 . 0 0 "[ . 1 . 2]" 1
1164 1 72 VAL MG2 1 73 THR H 5.140 . 5.640 3.883 3.814 3.946 . 0 0 "[ . 1 . 2]" 1
1165 1 72 VAL MG2 1 74 PHE HZ 6.610 . 7.110 4.768 4.467 5.357 . 0 0 "[ . 1 . 2]" 1
1166 1 72 VAL MG2 1 98 PRO HB3 6.610 . 7.110 5.488 5.380 5.522 . 0 0 "[ . 1 . 2]" 1
1167 1 73 THR H 1 73 THR HB 3.460 . 3.960 2.734 2.673 2.804 . 0 0 "[ . 1 . 2]" 1
1168 1 73 THR HA 1 74 PHE H 3.250 . 3.750 2.222 2.177 2.256 . 0 0 "[ . 1 . 2]" 1
1169 1 73 THR HA 1 74 PHE HB2 4.450 . 4.950 4.445 4.372 4.462 . 0 0 "[ . 1 . 2]" 1
1170 1 73 THR HA 1 74 PHE QD 4.930 . 5.430 3.352 3.148 3.785 . 0 0 "[ . 1 . 2]" 1
1171 1 73 THR MG 1 74 PHE H 4.590 . 5.090 2.477 2.315 2.641 . 0 0 "[ . 1 . 2]" 1
1172 1 73 THR MG 1 74 PHE QD 7.410 . 7.910 4.465 4.345 4.703 . 0 0 "[ . 1 . 2]" 1
1173 1 74 PHE H 1 74 PHE HB2 3.690 . 4.190 2.426 2.346 2.528 . 0 0 "[ . 1 . 2]" 1
1174 1 74 PHE H 1 74 PHE HB3 3.970 . 4.470 3.648 3.595 3.715 . 0 0 "[ . 1 . 2]" 1
1175 1 74 PHE H 1 74 PHE QD 4.680 . 5.180 2.642 2.426 2.897 . 0 0 "[ . 1 . 2]" 1
1176 1 74 PHE H 1 74 PHE QE 6.010 . 6.510 4.826 4.611 5.009 . 0 0 "[ . 1 . 2]" 1
1177 1 74 PHE H 1 75 MET H 4.820 . 5.320 4.582 4.511 4.635 . 0 0 "[ . 1 . 2]" 1
1178 1 74 PHE H 1 80 VAL MG2 5.420 . 5.920 3.551 3.361 3.741 . 0 0 "[ . 1 . 2]" 1
1179 1 74 PHE HA 1 75 MET H 3.440 . 3.940 2.258 2.226 2.290 . 0 0 "[ . 1 . 2]" 1
1180 1 74 PHE HB2 1 75 MET H 4.460 . 4.960 3.981 3.939 4.021 . 0 0 "[ . 1 . 2]" 1
1181 1 74 PHE HB2 1 76 ASP H 4.600 . 5.100 3.203 3.001 3.299 . 0 0 "[ . 1 . 2]" 1
1182 1 74 PHE HB2 1 79 GLY H 4.960 . 5.460 4.450 3.857 4.951 . 0 0 "[ . 1 . 2]" 1
1183 1 74 PHE HB2 1 80 VAL MG2 4.660 . 5.160 2.464 2.340 2.667 . 0 0 "[ . 1 . 2]" 1
1184 1 74 PHE HB3 1 75 MET H 3.700 . 4.200 2.780 2.724 2.860 . 0 0 "[ . 1 . 2]" 1
1185 1 74 PHE HB3 1 76 ASP H 3.460 . 3.960 2.313 2.168 2.434 . 0 0 "[ . 1 . 2]" 1
1186 1 74 PHE HB3 1 79 GLY H 4.220 . 4.720 3.884 3.465 4.226 . 0 0 "[ . 1 . 2]" 1
1187 1 74 PHE HB3 1 79 GLY HA3 4.600 . 5.100 3.601 2.749 4.106 . 0 0 "[ . 1 . 2]" 1
1188 1 74 PHE HB3 1 80 VAL MG2 5.340 . 5.840 3.667 3.383 4.025 . 0 0 "[ . 1 . 2]" 1
1189 1 74 PHE QD 1 75 MET H 4.870 . 5.370 3.684 3.434 3.868 . 0 0 "[ . 1 . 2]" 1
1190 1 74 PHE QD 1 76 ASP H 5.210 . 5.710 4.217 4.003 4.368 . 0 0 "[ . 1 . 2]" 1
1191 1 74 PHE QD 1 79 GLY H 4.990 . 5.490 4.427 4.265 4.460 . 0 0 "[ . 1 . 2]" 1
1192 1 74 PHE QD 1 79 GLY HA2 5.310 . 5.810 4.512 4.067 4.744 . 0 0 "[ . 1 . 2]" 1
1193 1 74 PHE QD 1 79 GLY HA3 5.220 . 5.720 2.971 2.724 3.118 . 0 0 "[ . 1 . 2]" 1
1194 1 74 PHE QD 1 80 VAL HA 5.280 . 5.780 3.967 3.472 4.297 . 0 0 "[ . 1 . 2]" 1
1195 1 74 PHE QD 1 80 VAL MG2 4.380 . 4.880 2.231 2.133 2.367 . 0 0 "[ . 1 . 2]" 1
1196 1 74 PHE QE 1 79 GLY HA2 5.500 . 6.000 4.523 4.296 4.697 . 0 0 "[ . 1 . 2]" 1
1197 1 74 PHE QE 1 80 VAL HA 5.130 . 5.630 3.609 3.241 3.905 . 0 0 "[ . 1 . 2]" 1
1198 1 74 PHE QE 1 80 VAL MG2 5.270 . 5.770 3.120 2.968 3.344 . 0 0 "[ . 1 . 2]" 1
1199 1 74 PHE QE 1 83 VAL MG1 5.920 . 6.420 4.104 3.781 4.293 . 0 0 "[ . 1 . 2]" 1
1200 1 74 PHE QE 1 83 VAL MG2 4.530 . 5.030 3.127 2.570 3.344 . 0 0 "[ . 1 . 2]" 1
1201 1 74 PHE HZ 1 83 VAL MG1 6.440 . 6.940 4.040 3.717 4.421 . 0 0 "[ . 1 . 2]" 1
1202 1 74 PHE HZ 1 83 VAL MG2 3.890 . 4.390 2.401 2.239 2.516 . 0 0 "[ . 1 . 2]" 1
1203 1 75 MET H 1 75 MET HB2 3.780 . 4.280 2.417 2.366 2.487 . 0 0 "[ . 1 . 2]" 1
1204 1 75 MET H 1 75 MET QB 3.550 . 4.050 2.382 2.335 2.446 . 0 0 "[ . 1 . 2]" 1
1205 1 75 MET H 1 75 MET HB3 3.780 . 4.280 3.599 3.577 3.621 . 0 0 "[ . 1 . 2]" 1
1206 1 75 MET H 1 75 MET HG2 3.890 . 4.390 2.617 2.338 3.360 . 0 0 "[ . 1 . 2]" 1
1207 1 75 MET H 1 75 MET HG3 4.130 . 4.630 3.368 2.377 3.706 . 0 0 "[ . 1 . 2]" 1
1208 1 75 MET H 1 76 ASP H 3.540 . 4.040 2.672 2.584 2.750 . 0 0 "[ . 1 . 2]" 1
1209 1 75 MET HA 1 75 MET HG2 3.990 . 4.490 2.861 2.326 3.092 . 0 0 "[ . 1 . 2]" 1
1210 1 75 MET HA 1 75 MET HG3 3.970 . 4.470 3.621 3.241 3.792 . 0 0 "[ . 1 . 2]" 1
1211 1 75 MET HB2 1 76 ASP H 4.150 . 4.650 3.332 3.180 3.471 . 0 0 "[ . 1 . 2]" 1
1212 1 75 MET HB3 1 76 ASP H 4.150 . 4.650 4.092 4.002 4.182 . 0 0 "[ . 1 . 2]" 1
1213 1 75 MET HG2 1 76 ASP H 5.010 . 5.510 4.786 4.625 5.035 . 0 0 "[ . 1 . 2]" 1
1214 1 76 ASP H 1 80 VAL MG2 6.610 . 7.110 4.841 4.571 5.119 . 0 0 "[ . 1 . 2]" 1
1215 1 76 ASP HA 1 77 GLN H 3.300 . 3.800 2.304 2.221 2.350 . 0 0 "[ . 1 . 2]" 1
1216 1 76 ASP HA 1 78 ALA H 4.640 . 5.140 4.109 3.933 4.231 . 0 0 "[ . 1 . 2]" 1
1217 1 76 ASP QB 1 77 GLN H 3.770 . 4.270 3.150 2.569 3.381 . 0 0 "[ . 1 . 2]" 1
1218 1 76 ASP QB 1 77 GLN HB3 5.620 . 6.120 4.886 4.485 5.048 . 0 0 "[ . 1 . 2]" 1
1219 1 76 ASP QB 1 78 ALA H 4.190 . 4.690 2.848 2.392 3.061 . 0 0 "[ . 1 . 2]" 1
1220 1 76 ASP QB 1 78 ALA MB 5.510 . 6.010 2.986 2.665 3.357 . 0 0 "[ . 1 . 2]" 1
1221 1 76 ASP QB 1 79 GLY H 5.680 . 6.180 3.637 3.329 3.938 . 0 0 "[ . 1 . 2]" 1
1222 1 77 GLN H 1 77 GLN HB2 3.280 . 3.780 2.377 2.300 2.469 . 0 0 "[ . 1 . 2]" 1
1223 1 77 GLN H 1 77 GLN HB3 3.390 . 3.890 2.493 2.400 2.532 . 0 0 "[ . 1 . 2]" 1
1224 1 77 GLN H 1 77 GLN QG 4.650 . 5.150 4.026 3.998 4.065 . 0 0 "[ . 1 . 2]" 1
1225 1 77 GLN H 1 80 VAL MG2 6.610 . 7.110 5.065 4.910 5.280 . 0 0 "[ . 1 . 2]" 1
1226 1 77 GLN HA 1 77 GLN QE 5.420 . 5.920 3.931 3.796 4.056 . 0 0 "[ . 1 . 2]" 1
1227 1 77 GLN HA 1 78 ALA MB 6.610 . 7.110 4.988 4.951 5.018 . 0 0 "[ . 1 . 2]" 1
1228 1 77 GLN HA 1 79 GLY H 4.710 . 5.210 3.932 3.741 4.195 . 0 0 "[ . 1 . 2]" 1
1229 1 77 GLN HA 1 80 VAL H 3.960 . 4.460 3.177 3.059 3.278 . 0 0 "[ . 1 . 2]" 1
1230 1 77 GLN HA 1 80 VAL HB 3.500 . 4.000 2.787 2.608 3.046 . 0 0 "[ . 1 . 2]" 1
1231 1 77 GLN HA 1 80 VAL MG1 5.460 . 5.960 4.174 4.008 4.404 . 0 0 "[ . 1 . 2]" 1
1232 1 77 GLN HA 1 80 VAL MG2 4.190 . 4.690 2.842 2.724 2.998 . 0 0 "[ . 1 . 2]" 1
1233 1 77 GLN HB2 1 78 ALA H 4.010 . 4.510 4.060 4.043 4.080 . 0 0 "[ . 1 . 2]" 1
1234 1 77 GLN HB3 1 78 ALA H 3.770 . 4.270 2.978 2.872 3.083 . 0 0 "[ . 1 . 2]" 1
1235 1 77 GLN HB3 1 78 ALA HA 4.980 . 5.480 4.333 4.279 4.416 . 0 0 "[ . 1 . 2]" 1
1236 1 77 GLN HB3 1 78 ALA MB 5.360 . 5.860 4.262 4.144 4.346 . 0 0 "[ . 1 . 2]" 1
1237 1 77 GLN QE 1 80 VAL HB 4.440 . 4.940 3.034 2.735 3.174 . 0 0 "[ . 1 . 2]" 1
1238 1 77 GLN QE 1 80 VAL MG1 4.680 . 5.180 2.283 2.142 2.395 . 0 0 "[ . 1 . 2]" 1
1239 1 77 GLN HE21 1 80 VAL HB 4.640 . 5.140 3.577 3.360 3.771 . 0 0 "[ . 1 . 2]" 1
1240 1 77 GLN HE21 1 80 VAL MG1 4.740 . 5.240 3.148 3.061 3.238 . 0 0 "[ . 1 . 2]" 1
1241 1 77 GLN HE22 1 80 VAL HB 4.640 . 5.140 3.283 2.871 3.415 . 0 0 "[ . 1 . 2]" 1
1242 1 77 GLN HE22 1 80 VAL MG1 4.740 . 5.240 2.345 2.174 2.482 . 0 0 "[ . 1 . 2]" 1
1243 1 77 GLN QG 1 78 ALA H 4.930 . 5.430 4.082 3.827 4.185 . 0 0 "[ . 1 . 2]" 1
1244 1 77 GLN QG 1 78 ALA HA 5.050 . 5.550 4.093 3.680 4.221 . 0 0 "[ . 1 . 2]" 1
1245 1 77 GLN QG 1 80 VAL MG1 6.160 . 6.660 4.006 3.860 4.301 . 0 0 "[ . 1 . 2]" 1
1246 1 77 GLN QG 1 80 VAL MG2 6.340 . 6.840 4.363 4.263 4.705 . 0 0 "[ . 1 . 2]" 1
1247 1 77 GLN QG 1 81 ASP H 6.120 . 6.620 3.615 3.469 3.787 . 0 0 "[ . 1 . 2]" 1
1248 1 78 ALA H 1 78 ALA MB 3.330 . 3.830 2.204 2.182 2.230 . 0 0 "[ . 1 . 2]" 1
1249 1 78 ALA H 1 79 GLY H 3.290 . 3.790 2.906 2.858 2.943 . 0 0 "[ . 1 . 2]" 1
1250 1 78 ALA H 1 79 GLY HA2 5.500 . 6.000 5.529 5.501 5.555 . 0 0 "[ . 1 . 2]" 1
1251 1 78 ALA H 1 80 VAL H 4.770 . 5.270 4.287 4.228 4.345 . 0 0 "[ . 1 . 2]" 1
1252 1 78 ALA H 1 80 VAL MG2 6.610 . 7.110 5.298 5.176 5.390 . 0 0 "[ . 1 . 2]" 1
1253 1 78 ALA H 1 81 ASP QB 5.990 . 6.490 4.691 4.618 4.748 . 0 0 "[ . 1 . 2]" 1
1254 1 78 ALA HA 1 80 VAL H 4.980 . 5.480 4.289 4.085 4.449 . 0 0 "[ . 1 . 2]" 1
1255 1 78 ALA HA 1 81 ASP H 3.750 . 4.250 3.441 3.192 3.553 . 0 0 "[ . 1 . 2]" 1
1256 1 78 ALA HA 1 81 ASP HB2 3.620 . 4.120 3.040 2.490 3.234 . 0 0 "[ . 1 . 2]" 1
1257 1 78 ALA HA 1 81 ASP QB 3.410 . 3.910 2.545 2.386 2.631 . 0 0 "[ . 1 . 2]" 1
1258 1 78 ALA HA 1 81 ASP HB3 3.620 . 4.120 2.775 2.541 3.631 . 0 0 "[ . 1 . 2]" 1
1259 1 78 ALA HA 1 82 LYS H 4.440 . 4.940 4.273 3.962 4.390 . 0 0 "[ . 1 . 2]" 1
1260 1 78 ALA HA 1 82 LYS HG3 5.270 . 5.770 4.414 4.201 4.593 . 0 0 "[ . 1 . 2]" 1
1261 1 78 ALA MB 1 79 GLY H 3.950 . 4.450 2.915 2.767 3.017 . 0 0 "[ . 1 . 2]" 1
1262 1 78 ALA MB 1 79 GLY HA2 5.090 . 5.590 4.142 4.103 4.183 . 0 0 "[ . 1 . 2]" 1
1263 1 78 ALA MB 1 79 GLY HA3 5.380 . 5.880 4.491 4.475 4.516 . 0 0 "[ . 1 . 2]" 1
1264 1 78 ALA MB 1 80 VAL H 5.640 . 6.140 4.653 4.563 4.702 . 0 0 "[ . 1 . 2]" 1
1265 1 78 ALA MB 1 81 ASP HB2 5.930 . 6.430 4.602 4.144 4.776 . 0 0 "[ . 1 . 2]" 1
1266 1 78 ALA MB 1 81 ASP QB 5.740 . 6.240 3.824 3.606 3.935 . 0 0 "[ . 1 . 2]" 1
1267 1 78 ALA MB 1 81 ASP HB3 5.930 . 6.430 4.107 3.812 4.820 . 0 0 "[ . 1 . 2]" 1
1268 1 78 ALA MB 1 82 LYS H 5.930 . 6.430 4.897 4.521 4.970 . 0 0 "[ . 1 . 2]" 1
1269 1 78 ALA MB 1 82 LYS QE 5.650 . 6.150 3.413 2.635 4.192 . 0 0 "[ . 1 . 2]" 1
1270 1 79 GLY H 1 80 VAL H 3.330 . 3.830 2.470 2.332 2.730 . 0 0 "[ . 1 . 2]" 1
1271 1 79 GLY H 1 80 VAL MG2 5.280 . 5.780 4.130 3.983 4.404 . 0 0 "[ . 1 . 2]" 1
1272 1 79 GLY HA2 1 82 LYS QB 5.170 . 5.670 2.993 2.751 3.060 . 0 0 "[ . 1 . 2]" 1
1273 1 79 GLY HA2 1 83 VAL H 4.420 . 4.920 4.439 4.398 4.456 . 0 0 "[ . 1 . 2]" 1
1274 1 79 GLY HA3 1 82 LYS H 4.780 . 5.280 4.788 4.729 4.823 . 0 0 "[ . 1 . 2]" 1
1275 1 79 GLY HA3 1 82 LYS QB 5.010 . 5.510 4.469 4.299 4.492 . 0 0 "[ . 1 . 2]" 1
1276 1 79 GLY HA3 1 82 LYS QD 5.010 . 5.510 4.193 3.967 4.487 . 0 0 "[ . 1 . 2]" 1
1277 1 80 VAL H 1 80 VAL HB 3.190 . 3.690 2.472 2.419 2.507 . 0 0 "[ . 1 . 2]" 1
1278 1 80 VAL H 1 80 VAL MG2 3.720 . 4.220 2.390 2.288 2.487 . 0 0 "[ . 1 . 2]" 1
1279 1 80 VAL H 1 81 ASP H 3.550 . 4.050 2.585 2.414 2.719 . 0 0 "[ . 1 . 2]" 1
1280 1 80 VAL H 1 82 LYS H 4.690 . 5.190 4.236 4.069 4.355 . 0 0 "[ . 1 . 2]" 1
1281 1 80 VAL HA 1 83 VAL H 4.360 . 4.860 3.563 3.433 3.659 . 0 0 "[ . 1 . 2]" 1
1282 1 80 VAL HA 1 83 VAL HB 3.830 . 4.330 3.007 2.810 3.142 . 0 0 "[ . 1 . 2]" 1
1283 1 80 VAL HA 1 83 VAL MG1 5.580 . 6.080 4.341 4.181 4.448 . 0 0 "[ . 1 . 2]" 1
1284 1 80 VAL HA 1 83 VAL MG2 4.860 . 5.360 3.434 3.299 3.544 . 0 0 "[ . 1 . 2]" 1
1285 1 80 VAL HA 1 84 LEU H 4.900 . 5.400 4.432 4.307 4.571 . 0 0 "[ . 1 . 2]" 1
1286 1 80 VAL HB 1 81 ASP H 3.420 . 3.920 2.582 2.539 2.636 . 0 0 "[ . 1 . 2]" 1
1287 1 80 VAL MG1 1 81 ASP H 4.710 . 5.210 3.298 3.258 3.365 . 0 0 "[ . 1 . 2]" 1
1288 1 80 VAL MG1 1 81 ASP HA 4.720 . 5.220 3.456 3.369 3.537 . 0 0 "[ . 1 . 2]" 1
1289 1 80 VAL MG1 1 83 VAL HB 4.880 . 5.380 3.999 3.773 4.069 . 0 0 "[ . 1 . 2]" 1
1290 1 80 VAL MG1 1 84 LEU H 5.500 . 6.000 4.169 3.992 4.292 . 0 0 "[ . 1 . 2]" 1
1291 1 80 VAL MG1 1 100 VAL HA 5.080 . 5.580 3.920 3.751 4.134 . 0 0 "[ . 1 . 2]" 1
1292 1 80 VAL MG1 1 100 VAL QG 5.200 . 5.700 2.789 2.585 2.983 . 0 0 "[ . 1 . 2]" 1
1293 1 80 VAL MG2 1 81 ASP H 4.920 . 5.420 3.927 3.901 3.950 . 0 0 "[ . 1 . 2]" 1
1294 1 81 ASP H 1 81 ASP HB2 3.740 . 4.240 2.309 2.047 2.358 . 0 0 "[ . 1 . 2]" 1
1295 1 81 ASP H 1 81 ASP QB 3.670 . 4.170 2.166 2.029 2.184 . 0 0 "[ . 1 . 2]" 1
1296 1 81 ASP H 1 81 ASP HB3 3.740 . 4.240 2.653 2.546 3.323 . 0 0 "[ . 1 . 2]" 1
1297 1 81 ASP H 1 82 LYS HG3 4.780 . 5.280 4.788 4.773 4.811 . 0 0 "[ . 1 . 2]" 1
1298 1 81 ASP H 1 84 LEU MD1 5.150 . 5.650 4.147 4.103 4.196 . 0 0 "[ . 1 . 2]" 1
1299 1 81 ASP HA 1 83 VAL H 4.600 . 5.100 4.488 4.386 4.540 . 0 0 "[ . 1 . 2]" 1
1300 1 81 ASP HA 1 84 LEU H 3.880 . 4.380 3.727 3.585 3.755 . 0 0 "[ . 1 . 2]" 1
1301 1 81 ASP HA 1 84 LEU HB2 3.610 . 4.110 3.168 3.048 3.215 . 0 0 "[ . 1 . 2]" 1
1302 1 81 ASP HA 1 84 LEU MD1 4.110 . 4.610 2.380 2.308 2.425 . 0 0 "[ . 1 . 2]" 1
1303 1 81 ASP HA 1 84 LEU HG 3.840 . 4.340 3.845 3.718 3.858 . 0 0 "[ . 1 . 2]" 1
1304 1 81 ASP HA 1 85 ALA H 4.780 . 5.280 4.158 4.057 4.217 . 0 0 "[ . 1 . 2]" 1
1305 1 81 ASP QB 1 82 LYS H 3.730 . 4.230 2.449 2.377 2.744 . 0 0 "[ . 1 . 2]" 1
1306 1 81 ASP QB 1 82 LYS HG3 4.830 . 5.330 3.202 3.153 3.658 . 0 0 "[ . 1 . 2]" 1
1307 1 81 ASP QB 1 84 LEU MD1 6.500 . 7.000 4.161 4.105 4.290 . 0 0 "[ . 1 . 2]" 1
1308 1 81 ASP HB2 1 82 LYS H 3.870 . 4.370 3.757 3.199 3.822 . 0 0 "[ . 1 . 2]" 1
1309 1 81 ASP HB2 1 82 LYS HG3 4.910 . 5.410 4.925 4.415 4.967 . 0 0 "[ . 1 . 2]" 1
1310 1 81 ASP HB3 1 82 LYS H 3.870 . 4.370 2.489 2.403 2.987 . 0 0 "[ . 1 . 2]" 1
1311 1 81 ASP HB3 1 82 LYS HG3 4.910 . 5.410 3.251 3.190 3.904 . 0 0 "[ . 1 . 2]" 1
1312 1 82 LYS H 1 82 LYS QB 3.480 . 3.980 2.403 2.279 2.471 . 0 0 "[ . 1 . 2]" 1
1313 1 82 LYS H 1 82 LYS QD 4.730 . 5.230 3.604 3.439 3.879 . 0 0 "[ . 1 . 2]" 1
1314 1 82 LYS H 1 82 LYS HG2 4.040 . 4.540 3.581 3.407 3.729 . 0 0 "[ . 1 . 2]" 1
1315 1 82 LYS H 1 82 LYS HG3 3.590 . 4.090 2.266 2.184 2.399 . 0 0 "[ . 1 . 2]" 1
1316 1 82 LYS H 1 83 VAL H 2.770 . 3.270 2.768 2.747 2.789 . 0 0 "[ . 1 . 2]" 1
1317 1 82 LYS H 1 83 VAL MG2 5.430 . 5.930 4.334 4.292 4.433 . 0 0 "[ . 1 . 2]" 1
1318 1 82 LYS HA 1 82 LYS QD 4.830 . 5.330 4.032 3.967 4.069 . 0 0 "[ . 1 . 2]" 1
1319 1 82 LYS HA 1 82 LYS QE 5.600 . 6.100 4.789 4.567 5.001 . 0 0 "[ . 1 . 2]" 1
1320 1 82 LYS HA 1 82 LYS HG2 3.280 . 3.780 2.648 2.561 2.733 . 0 0 "[ . 1 . 2]" 1
1321 1 82 LYS HA 1 82 LYS HG3 3.540 . 4.040 2.967 2.802 3.135 . 0 0 "[ . 1 . 2]" 1
1322 1 82 LYS HA 1 85 ALA H 3.800 . 4.300 3.424 3.335 3.650 . 0 0 "[ . 1 . 2]" 1
1323 1 82 LYS HA 1 85 ALA MB 3.660 . 4.160 2.432 2.346 2.567 . 0 0 "[ . 1 . 2]" 1
1324 1 82 LYS QB 1 83 VAL H 3.930 . 4.430 2.678 2.607 2.775 . 0 0 "[ . 1 . 2]" 1
1325 1 82 LYS QB 1 83 VAL HA 4.440 . 4.940 3.924 3.870 3.984 . 0 0 "[ . 1 . 2]" 1
1326 1 82 LYS QB 1 83 VAL MG2 5.320 . 5.820 3.148 3.062 3.348 . 0 0 "[ . 1 . 2]" 1
1327 1 83 VAL H 1 83 VAL HB 3.170 . 3.670 2.492 2.464 2.514 . 0 0 "[ . 1 . 2]" 1
1328 1 83 VAL H 1 83 VAL MG2 3.710 . 4.210 2.346 2.313 2.430 . 0 0 "[ . 1 . 2]" 1
1329 1 83 VAL H 1 84 LEU H 3.320 . 3.820 2.641 2.627 2.651 . 0 0 "[ . 1 . 2]" 1
1330 1 83 VAL H 1 84 LEU HG 4.170 . 4.670 4.199 4.185 4.207 . 0 0 "[ . 1 . 2]" 1
1331 1 83 VAL HA 1 84 LEU HG 5.240 . 5.740 5.284 5.261 5.319 . 0 0 "[ . 1 . 2]" 1
1332 1 83 VAL HA 1 85 ALA H 4.980 . 5.480 4.535 4.457 4.562 . 0 0 "[ . 1 . 2]" 1
1333 1 83 VAL HA 1 85 ALA MB 6.170 . 6.670 5.118 4.938 5.147 . 0 0 "[ . 1 . 2]" 1
1334 1 83 VAL HA 1 86 GLN H 4.470 . 4.970 3.756 3.692 3.867 . 0 0 "[ . 1 . 2]" 1
1335 1 83 VAL HA 1 86 GLN QB 4.790 . 5.290 3.245 3.158 3.370 . 0 0 "[ . 1 . 2]" 1
1336 1 83 VAL HA 1 89 HIS HE1 3.510 . 4.010 2.646 2.367 2.791 . 0 0 "[ . 1 . 2]" 1
1337 1 83 VAL HB 1 84 LEU H 3.290 . 3.790 2.947 2.764 3.026 . 0 0 "[ . 1 . 2]" 1
1338 1 83 VAL HB 1 84 LEU MD2 4.980 . 5.480 4.178 4.162 4.188 . 0 0 "[ . 1 . 2]" 1
1339 1 83 VAL HB 1 84 LEU HG 4.890 . 5.390 3.492 3.409 3.521 . 0 0 "[ . 1 . 2]" 1
1340 1 83 VAL HB 1 85 ALA H 5.500 . 6.000 5.264 5.139 5.306 . 0 0 "[ . 1 . 2]" 1
1341 1 83 VAL MG1 1 84 LEU H 4.640 . 5.140 3.661 3.417 3.764 . 0 0 "[ . 1 . 2]" 1
1342 1 83 VAL MG1 1 84 LEU HA 4.680 . 5.180 3.770 3.539 3.866 . 0 0 "[ . 1 . 2]" 1
1343 1 83 VAL MG1 1 84 LEU HG 5.430 . 5.930 3.968 3.825 4.036 . 0 0 "[ . 1 . 2]" 1
1344 1 83 VAL MG1 1 89 HIS HD2 5.440 . 5.940 3.770 3.624 4.049 . 0 0 "[ . 1 . 2]" 1
1345 1 83 VAL MG1 1 89 HIS HE1 4.400 . 4.900 3.325 3.036 3.447 . 0 0 "[ . 1 . 2]" 1
1346 1 83 VAL MG1 1 98 PRO HB2 3.570 . 4.070 2.284 2.138 2.407 . 0 0 "[ . 1 . 2]" 1
1347 1 83 VAL MG1 1 98 PRO HD2 5.250 . 5.750 3.957 3.869 4.068 . 0 0 "[ . 1 . 2]" 1
1348 1 83 VAL MG1 1 98 PRO HG2 3.880 . 4.380 2.188 2.157 2.239 . 0 0 "[ . 1 . 2]" 1
1349 1 83 VAL MG1 1 98 PRO HG3 3.880 . 4.380 2.959 2.745 3.184 . 0 0 "[ . 1 . 2]" 1
1350 1 83 VAL MG1 1 99 LYS H 6.610 . 7.110 4.597 4.512 4.712 . 0 0 "[ . 1 . 2]" 1
1351 1 83 VAL MG2 1 84 LEU H 4.940 . 5.440 4.108 4.055 4.122 . 0 0 "[ . 1 . 2]" 1
1352 1 83 VAL MG2 1 86 GLN H 6.610 . 7.110 5.459 5.401 5.527 . 0 0 "[ . 1 . 2]" 1
1353 1 83 VAL MG2 1 89 HIS HE1 5.300 . 5.800 3.235 3.040 3.386 . 0 0 "[ . 1 . 2]" 1
1354 1 83 VAL MG2 1 98 PRO HB2 5.880 . 6.380 4.355 4.173 4.461 . 0 0 "[ . 1 . 2]" 1
1355 1 83 VAL MG2 1 98 PRO HG3 5.720 . 6.220 4.642 4.356 4.767 . 0 0 "[ . 1 . 2]" 1
1356 1 84 LEU H 1 84 LEU HB2 3.530 . 4.030 2.460 2.445 2.494 . 0 0 "[ . 1 . 2]" 1
1357 1 84 LEU H 1 84 LEU HB3 3.810 . 4.310 3.578 3.572 3.588 . 0 0 "[ . 1 . 2]" 1
1358 1 84 LEU H 1 84 LEU MD1 3.940 . 4.440 3.314 3.292 3.323 . 0 0 "[ . 1 . 2]" 1
1359 1 84 LEU H 1 84 LEU MD2 4.580 . 5.080 3.443 3.365 3.480 . 0 0 "[ . 1 . 2]" 1
1360 1 84 LEU H 1 84 LEU HG 2.910 . 3.410 2.155 2.047 2.198 . 0 0 "[ . 1 . 2]" 1
1361 1 84 LEU H 1 85 ALA H 3.430 . 3.930 2.530 2.465 2.645 . 0 0 "[ . 1 . 2]" 1
1362 1 84 LEU H 1 85 ALA HA 5.390 . 5.890 5.167 5.114 5.266 . 0 0 "[ . 1 . 2]" 1
1363 1 84 LEU H 1 85 ALA MB 5.180 . 5.680 4.163 4.094 4.266 . 0 0 "[ . 1 . 2]" 1
1364 1 84 LEU H 1 86 GLN H 4.380 . 4.880 4.175 4.128 4.270 . 0 0 "[ . 1 . 2]" 1
1365 1 84 LEU HA 1 84 LEU MD2 3.300 . 3.800 2.263 2.247 2.273 . 0 0 "[ . 1 . 2]" 1
1366 1 84 LEU HA 1 84 LEU HG 3.930 . 4.430 3.103 3.082 3.114 . 0 0 "[ . 1 . 2]" 1
1367 1 84 LEU HA 1 86 GLN H 4.530 . 5.030 4.165 3.782 4.366 . 0 0 "[ . 1 . 2]" 1
1368 1 84 LEU HB2 1 85 ALA H 4.380 . 4.880 2.504 2.493 2.527 . 0 0 "[ . 1 . 2]" 1
1369 1 84 LEU HB3 1 85 ALA H 4.140 . 4.640 3.658 3.650 3.675 . 0 0 "[ . 1 . 2]" 1
1370 1 84 LEU MD1 1 85 ALA H 4.980 . 5.480 4.180 4.174 4.195 . 0 0 "[ . 1 . 2]" 1
1371 1 84 LEU MD1 1 85 ALA HA 6.610 . 7.110 5.554 5.548 5.566 . 0 0 "[ . 1 . 2]" 1
1372 1 84 LEU MD1 1 100 VAL QG 5.830 . 6.330 2.490 2.282 2.687 . 0 0 "[ . 1 . 2]" 1
1373 1 84 LEU MD2 1 99 LYS HA 4.670 . 5.170 2.727 2.507 3.340 . 0 0 "[ . 1 . 2]" 1
1374 1 84 LEU MD2 1 100 VAL H 5.160 . 5.660 2.999 2.824 3.301 . 0 0 "[ . 1 . 2]" 1
1375 1 84 LEU MD2 1 100 VAL QG 4.450 . 4.950 2.165 2.057 2.245 . 0 0 "[ . 1 . 2]" 1
1376 1 84 LEU HG 1 85 ALA H 4.760 . 5.260 4.192 4.179 4.206 . 0 0 "[ . 1 . 2]" 1
1377 1 85 ALA H 1 85 ALA MB 3.240 . 3.740 2.195 2.184 2.202 . 0 0 "[ . 1 . 2]" 1
1378 1 85 ALA H 1 86 GLN QB 5.990 . 6.490 4.557 4.531 4.615 . 0 0 "[ . 1 . 2]" 1
1379 1 85 ALA HA 1 86 GLN H 3.570 . 4.070 3.491 3.414 3.534 . 0 0 "[ . 1 . 2]" 1
1380 1 85 ALA MB 1 86 GLN H 4.020 . 4.520 3.018 2.888 3.263 . 0 0 "[ . 1 . 2]" 1
1381 1 85 ALA MB 1 86 GLN HA 5.510 . 6.010 4.138 4.031 4.266 . 0 0 "[ . 1 . 2]" 1
1382 1 86 GLN H 1 86 GLN HB2 3.140 . 3.640 2.729 2.612 2.936 . 0 0 "[ . 1 . 2]" 1
1383 1 86 GLN H 1 86 GLN QB 3.040 . 3.540 2.288 2.253 2.398 . 0 0 "[ . 1 . 2]" 1
1384 1 86 GLN H 1 86 GLN HB3 3.140 . 3.640 2.458 2.420 2.543 . 0 0 "[ . 1 . 2]" 1
1385 1 86 GLN H 1 87 SER H 4.740 . 5.240 4.603 4.506 4.671 . 0 0 "[ . 1 . 2]" 1
1386 1 86 GLN H 1 89 HIS HE1 4.740 . 5.240 4.702 4.554 4.748 . 0 0 "[ . 1 . 2]" 1
1387 1 86 GLN HA 1 86 GLN HG2 3.930 . 4.430 3.193 3.165 3.232 . 0 0 "[ . 1 . 2]" 1
1388 1 86 GLN HA 1 86 GLN QG 3.770 . 4.270 2.401 2.376 2.422 . 0 0 "[ . 1 . 2]" 1
1389 1 86 GLN HA 1 86 GLN HG3 3.930 . 4.430 2.483 2.451 2.502 . 0 0 "[ . 1 . 2]" 1
1390 1 86 GLN HA 1 87 SER H 2.730 . 3.230 2.220 2.205 2.254 . 0 0 "[ . 1 . 2]" 1
1391 1 86 GLN HA 1 87 SER QB 5.220 . 5.720 4.413 3.890 4.523 . 0 0 "[ . 1 . 2]" 1
1392 1 86 GLN HA 1 88 ARG H 4.190 . 4.690 4.178 4.090 4.239 . 0 0 "[ . 1 . 2]" 1
1393 1 86 GLN QB 1 89 HIS HD2 5.940 . 6.440 4.424 4.275 4.529 . 0 0 "[ . 1 . 2]" 1
1394 1 86 GLN QB 1 89 HIS HE1 4.400 . 4.900 2.699 2.634 2.756 . 0 0 "[ . 1 . 2]" 1
1395 1 86 GLN HB2 1 89 HIS HE1 4.600 . 5.100 3.822 3.708 3.908 . 0 0 "[ . 1 . 2]" 1
1396 1 86 GLN HB3 1 89 HIS HE1 4.600 . 5.100 2.760 2.684 2.824 . 0 0 "[ . 1 . 2]" 1
1397 1 86 GLN QE 1 89 HIS HA 4.240 . 4.740 2.997 2.941 3.067 . 0 0 "[ . 1 . 2]" 1
1398 1 86 GLN QE 1 90 GLU H 5.330 . 5.830 4.717 4.620 4.759 . 0 0 "[ . 1 . 2]" 1
1399 1 86 GLN HE21 1 89 HIS HA 4.490 . 4.990 3.113 3.050 3.182 . 0 0 "[ . 1 . 2]" 1
1400 1 86 GLN HE22 1 86 GLN HG2 4.060 . 4.560 3.540 3.537 3.546 . 0 0 "[ . 1 . 2]" 1
1401 1 86 GLN HE22 1 86 GLN HG3 4.060 . 4.560 3.940 3.913 4.000 . 0 0 "[ . 1 . 2]" 1
1402 1 86 GLN HE22 1 89 HIS HA 4.490 . 4.990 3.907 3.829 4.014 . 0 0 "[ . 1 . 2]" 1
1403 1 86 GLN QG 1 87 SER H 3.860 . 4.360 2.608 2.405 2.751 . 0 0 "[ . 1 . 2]" 1
1404 1 86 GLN QG 1 87 SER HA 5.340 . 5.840 4.425 4.388 4.455 . 0 0 "[ . 1 . 2]" 1
1405 1 86 GLN QG 1 89 HIS HD2 5.990 . 6.490 4.478 4.125 4.778 . 0 0 "[ . 1 . 2]" 1
1406 1 86 GLN QG 1 89 HIS HE1 4.740 . 5.240 3.849 3.710 3.969 . 0 0 "[ . 1 . 2]" 1
1407 1 86 GLN HG2 1 87 SER H 4.250 . 4.750 3.029 2.809 3.201 . 0 0 "[ . 1 . 2]" 1
1408 1 86 GLN HG2 1 88 ARG H 3.540 . 4.040 2.133 2.091 2.189 . 0 0 "[ . 1 . 2]" 1
1409 1 86 GLN HG2 1 89 HIS HE1 5.020 . 5.520 4.016 3.848 4.158 . 0 0 "[ . 1 . 2]" 1
1410 1 86 GLN HG3 1 87 SER H 4.250 . 4.750 2.846 2.610 2.998 . 0 0 "[ . 1 . 2]" 1
1411 1 86 GLN HG3 1 88 ARG H 3.540 . 4.040 3.406 3.306 3.539 . 0 0 "[ . 1 . 2]" 1
1412 1 86 GLN HG3 1 89 HIS HE1 5.020 . 5.520 4.942 4.864 5.026 . 0 0 "[ . 1 . 2]" 1
1413 1 87 SER H 1 87 SER QB 3.390 . 3.890 2.487 2.204 2.597 . 0 0 "[ . 1 . 2]" 1
1414 1 87 SER H 1 88 ARG H 3.220 . 3.720 2.811 2.617 2.890 . 0 0 "[ . 1 . 2]" 1
1415 1 87 SER QB 1 88 ARG H 3.870 . 4.370 3.352 3.234 3.515 . 0 0 "[ . 1 . 2]" 1
1416 1 87 SER QB 1 88 ARG QB 6.040 . 6.540 3.379 3.234 3.606 . 0 0 "[ . 1 . 2]" 1
1417 1 88 ARG H 1 88 ARG HB2 3.770 . 4.270 3.404 3.189 3.530 . 0 0 "[ . 1 . 2]" 1
1418 1 88 ARG H 1 88 ARG QB 3.400 . 3.900 2.827 2.653 2.887 . 0 0 "[ . 1 . 2]" 1
1419 1 88 ARG H 1 88 ARG HB3 3.770 . 4.270 3.025 2.788 3.130 . 0 0 "[ . 1 . 2]" 1
1420 1 88 ARG H 1 88 ARG QD 5.880 . 6.380 5.146 4.658 5.271 . 0 0 "[ . 1 . 2]" 1
1421 1 88 ARG H 1 88 ARG HG2 4.930 . 5.430 4.668 4.552 4.979 . 0 0 "[ . 1 . 2]" 1
1422 1 88 ARG H 1 88 ARG HG3 4.930 . 5.430 4.822 4.522 4.855 . 0 0 "[ . 1 . 2]" 1
1423 1 88 ARG H 1 89 HIS H 4.370 . 4.870 4.322 4.255 4.386 . 0 0 "[ . 1 . 2]" 1
1424 1 88 ARG HA 1 88 ARG HG2 4.170 . 4.670 3.195 2.778 3.851 . 0 0 "[ . 1 . 2]" 1
1425 1 88 ARG HA 1 88 ARG HG3 4.170 . 4.670 2.539 2.462 3.255 . 0 0 "[ . 1 . 2]" 1
1426 1 88 ARG HA 1 89 HIS H 3.010 . 3.510 2.237 2.186 2.258 . 0 0 "[ . 1 . 2]" 1
1427 1 88 ARG HA 1 89 HIS HD2 5.330 . 5.830 3.748 3.250 4.008 . 0 0 "[ . 1 . 2]" 1
1428 1 88 ARG QB 1 89 HIS H 4.490 . 4.990 3.560 3.414 3.751 . 0 0 "[ . 1 . 2]" 1
1429 1 88 ARG HB2 1 89 HIS H 4.710 . 5.210 4.069 3.998 4.221 . 0 0 "[ . 1 . 2]" 1
1430 1 88 ARG HB3 1 89 HIS H 4.710 . 5.210 3.936 3.638 4.200 . 0 0 "[ . 1 . 2]" 1
1431 1 88 ARG QD 1 95 THR MG 5.040 . 5.540 3.107 2.290 3.768 . 0 0 "[ . 1 . 2]" 1
1432 1 88 ARG QG 1 89 HIS H 4.120 . 4.620 2.354 2.135 3.080 . 0 0 "[ . 1 . 2]" 1
1433 1 88 ARG HG2 1 89 HIS H 4.520 . 5.020 2.701 2.175 4.507 . 0 0 "[ . 1 . 2]" 1
1434 1 88 ARG HG3 1 89 HIS H 4.520 . 5.020 2.658 2.474 3.136 . 0 0 "[ . 1 . 2]" 1
1435 1 89 HIS H 1 89 HIS HB2 3.900 . 4.400 2.697 2.666 2.749 . 0 0 "[ . 1 . 2]" 1
1436 1 89 HIS H 1 89 HIS HB3 3.900 . 4.400 3.817 3.801 3.844 . 0 0 "[ . 1 . 2]" 1
1437 1 89 HIS H 1 89 HIS HD2 4.000 . 4.500 3.586 3.282 3.687 . 0 0 "[ . 1 . 2]" 1
1438 1 89 HIS H 1 90 GLU H 4.900 . 5.400 4.447 4.421 4.473 . 0 0 "[ . 1 . 2]" 1
1439 1 89 HIS H 1 95 THR MG 4.940 . 5.440 3.161 3.019 3.291 . 0 0 "[ . 1 . 2]" 1
1440 1 89 HIS HA 1 90 GLU H 2.980 . 3.480 2.364 2.312 2.410 . 0 0 "[ . 1 . 2]" 1
1441 1 89 HIS HA 1 96 ILE MD 6.160 . 6.660 4.695 4.589 4.774 . 0 0 "[ . 1 . 2]" 1
1442 1 89 HIS QB 1 90 GLU H 4.130 . 4.630 2.708 2.555 2.812 . 0 0 "[ . 1 . 2]" 1
1443 1 89 HIS QB 1 90 GLU HA 5.490 . 5.990 4.163 4.066 4.200 . 0 0 "[ . 1 . 2]" 1
1444 1 89 HIS QB 1 96 ILE H 4.410 . 4.910 3.428 3.365 3.478 . 0 0 "[ . 1 . 2]" 1
1445 1 89 HIS QB 1 96 ILE MD 4.570 . 5.070 2.494 2.413 2.565 . 0 0 "[ . 1 . 2]" 1
1446 1 89 HIS QB 1 96 ILE QG 3.880 . 4.380 1.976 1.950 2.013 . 0 0 "[ . 1 . 2]" 1
1447 1 89 HIS QB 1 96 ILE MG 6.500 . 7.000 4.063 3.959 4.192 . 0 0 "[ . 1 . 2]" 1
1448 1 89 HIS QB 1 98 PRO HD3 4.800 . 5.300 2.910 2.677 3.247 . 0 0 "[ . 1 . 2]" 1
1449 1 89 HIS HB2 1 90 GLU H 4.300 . 4.800 3.929 3.805 3.994 . 0 0 "[ . 1 . 2]" 1
1450 1 89 HIS HB2 1 96 ILE H 4.480 . 4.980 3.627 3.552 3.677 . 0 0 "[ . 1 . 2]" 1
1451 1 89 HIS HB2 1 96 ILE MD 4.700 . 5.200 3.342 3.101 3.489 . 0 0 "[ . 1 . 2]" 1
1452 1 89 HIS HB2 1 96 ILE HG12 4.070 . 4.570 2.739 2.483 3.017 . 0 0 "[ . 1 . 2]" 1
1453 1 89 HIS HB2 1 96 ILE HG13 4.070 . 4.570 2.244 2.190 2.313 . 0 0 "[ . 1 . 2]" 1
1454 1 89 HIS HB2 1 98 PRO HG3 4.860 . 5.360 3.391 3.124 3.670 . 0 0 "[ . 1 . 2]" 1
1455 1 89 HIS HB3 1 90 GLU H 4.300 . 4.800 2.759 2.596 2.877 . 0 0 "[ . 1 . 2]" 1
1456 1 89 HIS HB3 1 96 ILE H 4.480 . 4.980 4.219 4.131 4.309 . 0 0 "[ . 1 . 2]" 1
1457 1 89 HIS HB3 1 96 ILE MD 4.700 . 5.200 2.575 2.502 2.653 . 0 0 "[ . 1 . 2]" 1
1458 1 89 HIS HB3 1 96 ILE HG12 4.070 . 4.570 2.537 2.409 2.686 . 0 0 "[ . 1 . 2]" 1
1459 1 89 HIS HB3 1 96 ILE HG13 4.070 . 4.570 2.712 2.500 2.990 . 0 0 "[ . 1 . 2]" 1
1460 1 89 HIS HB3 1 98 PRO HG3 4.860 . 5.360 3.732 3.430 4.012 . 0 0 "[ . 1 . 2]" 1
1461 1 89 HIS HD2 1 96 ILE QG 5.720 . 6.220 4.182 4.066 4.339 . 0 0 "[ . 1 . 2]" 1
1462 1 89 HIS HD2 1 98 PRO HD2 4.150 . 4.650 2.736 2.586 3.160 . 0 0 "[ . 1 . 2]" 1
1463 1 89 HIS HD2 1 98 PRO HD3 4.440 . 4.940 3.653 3.255 4.266 . 0 0 "[ . 1 . 2]" 1
1464 1 89 HIS HD2 1 98 PRO HG2 4.390 . 4.890 3.010 2.824 3.301 . 0 0 "[ . 1 . 2]" 1
1465 1 89 HIS HD2 1 98 PRO HG3 3.930 . 4.430 3.692 3.491 3.935 . 0 0 "[ . 1 . 2]" 1
1466 1 90 GLU H 1 90 GLU HB2 3.920 . 4.420 3.265 3.195 3.425 . 0 0 "[ . 1 . 2]" 1
1467 1 90 GLU H 1 90 GLU QB 3.670 . 4.170 2.749 2.720 2.843 . 0 0 "[ . 1 . 2]" 1
1468 1 90 GLU H 1 90 GLU HB3 3.920 . 4.420 2.962 2.855 3.185 . 0 0 "[ . 1 . 2]" 1
1469 1 90 GLU H 1 90 GLU QG 4.800 . 5.300 4.206 4.117 4.246 . 0 0 "[ . 1 . 2]" 1
1470 1 90 GLU H 1 96 ILE MD 5.630 . 6.130 3.877 3.780 4.051 . 0 0 "[ . 1 . 2]" 1
1471 1 90 GLU HA 1 91 LEU H 2.870 . 3.370 2.136 2.102 2.159 . 0 0 "[ . 1 . 2]" 1
1472 1 90 GLU HA 1 94 LYS H 4.180 . 4.680 4.247 4.232 4.287 . 0 0 "[ . 1 . 2]" 1
1473 1 90 GLU HA 1 95 THR H 4.970 . 5.470 4.729 4.646 4.858 . 0 0 "[ . 1 . 2]" 1
1474 1 90 GLU HA 1 95 THR HA 3.980 . 4.480 2.585 2.399 2.759 . 0 0 "[ . 1 . 2]" 1
1475 1 90 GLU HA 1 95 THR MG 5.140 . 5.640 4.168 4.003 4.287 . 0 0 "[ . 1 . 2]" 1
1476 1 90 GLU HA 1 96 ILE H 3.590 . 4.090 2.696 2.584 2.799 . 0 0 "[ . 1 . 2]" 1
1477 1 90 GLU HA 1 96 ILE MD 5.480 . 5.980 4.156 4.090 4.235 . 0 0 "[ . 1 . 2]" 1
1478 1 90 GLU HA 1 96 ILE QG 5.160 . 5.660 3.070 2.947 3.196 . 0 0 "[ . 1 . 2]" 1
1479 1 90 GLU HA 1 96 ILE MG 5.420 . 5.920 2.931 2.777 3.193 . 0 0 "[ . 1 . 2]" 1
1480 1 90 GLU QB 1 91 LEU H 4.430 . 4.930 3.730 3.647 3.776 . 0 0 "[ . 1 . 2]" 1
1481 1 90 GLU HB2 1 91 LEU H 4.550 . 5.050 4.282 4.153 4.337 . 0 0 "[ . 1 . 2]" 1
1482 1 90 GLU HB3 1 91 LEU H 4.550 . 5.050 4.109 3.922 4.274 . 0 0 "[ . 1 . 2]" 1
1483 1 90 GLU QG 1 91 LEU H 4.100 . 4.600 2.675 2.616 2.747 . 0 0 "[ . 1 . 2]" 1
1484 1 90 GLU QG 1 93 SER H 4.440 . 4.940 3.187 3.016 3.754 . 0 0 "[ . 1 . 2]" 1
1485 1 90 GLU QG 1 93 SER HA 4.400 . 4.900 2.833 2.521 3.788 . 0 0 "[ . 1 . 2]" 1
1486 1 90 GLU QG 1 94 LYS H 4.230 . 4.730 2.922 2.786 3.169 . 0 0 "[ . 1 . 2]" 1
1487 1 90 GLU QG 1 95 THR HA 4.830 . 5.330 2.890 2.615 3.532 . 0 0 "[ . 1 . 2]" 1
1488 1 90 GLU QG 1 96 ILE H 5.520 . 6.020 4.289 3.907 4.613 . 0 0 "[ . 1 . 2]" 1
1489 1 91 LEU H 1 91 LEU HB2 3.670 . 4.170 3.386 3.300 3.445 . 0 0 "[ . 1 . 2]" 1
1490 1 91 LEU H 1 91 LEU HB3 3.670 . 4.170 2.785 2.717 2.831 . 0 0 "[ . 1 . 2]" 1
1491 1 91 LEU H 1 92 ASP H 4.690 . 5.190 4.215 4.183 4.247 . 0 0 "[ . 1 . 2]" 1
1492 1 91 LEU H 1 94 LYS H 3.180 . 3.680 2.867 2.784 2.980 . 0 0 "[ . 1 . 2]" 1
1493 1 91 LEU H 1 94 LYS HB2 4.370 . 4.870 3.948 3.777 4.242 . 0 0 "[ . 1 . 2]" 1
1494 1 91 LEU H 1 96 ILE H 4.260 . 4.760 4.099 3.928 4.200 . 0 0 "[ . 1 . 2]" 1
1495 1 91 LEU H 1 96 ILE MD 5.090 . 5.590 3.971 3.844 4.131 . 0 0 "[ . 1 . 2]" 1
1496 1 91 LEU H 1 96 ILE MG 4.310 . 4.810 2.588 2.406 2.802 . 0 0 "[ . 1 . 2]" 1
1497 1 91 LEU HA 1 91 LEU MD1 3.580 . 4.080 2.276 2.261 2.293 . 0 0 "[ . 1 . 2]" 1
1498 1 91 LEU HA 1 92 ASP H 2.650 . 3.150 2.172 2.120 2.204 . 0 0 "[ . 1 . 2]" 1
1499 1 91 LEU HA 1 93 SER H 4.530 . 5.030 3.582 3.411 3.930 . 0 0 "[ . 1 . 2]" 1
1500 1 91 LEU HA 1 94 LYS H 4.670 . 5.170 4.419 4.328 4.514 . 0 0 "[ . 1 . 2]" 1
1501 1 91 LEU HB2 1 92 ASP H 4.570 . 5.070 4.211 4.177 4.291 . 0 0 "[ . 1 . 2]" 1
1502 1 91 LEU HB2 1 96 ILE MG 4.760 . 5.260 3.574 3.426 3.942 . 0 0 "[ . 1 . 2]" 1
1503 1 91 LEU HB3 1 94 LYS H 5.190 . 5.690 4.875 4.755 5.019 . 0 0 "[ . 1 . 2]" 1
1504 1 91 LEU HB3 1 96 ILE MD 4.060 . 4.560 2.579 2.306 2.786 . 0 0 "[ . 1 . 2]" 1
1505 1 91 LEU HB3 1 96 ILE MG 4.040 . 4.540 2.428 2.277 2.637 . 0 0 "[ . 1 . 2]" 1
1506 1 91 LEU MD1 1 92 ASP H 3.810 . 4.310 2.205 2.106 2.452 . 0 0 "[ . 1 . 2]" 1
1507 1 91 LEU MD1 1 93 SER H 5.790 . 6.290 4.603 4.453 4.777 . 0 0 "[ . 1 . 2]" 1
1508 1 91 LEU MD2 1 92 ASP H 5.790 . 6.290 4.555 4.478 4.662 . 0 0 "[ . 1 . 2]" 1
1509 1 91 LEU HG 1 92 ASP H 3.900 . 4.400 3.248 3.149 3.406 . 0 0 "[ . 1 . 2]" 1
1510 1 91 LEU HG 1 92 ASP HB2 4.800 . 5.300 3.195 2.522 3.497 . 0 0 "[ . 1 . 2]" 1
1511 1 91 LEU HG 1 92 ASP QB 4.690 . 5.190 3.042 2.427 3.417 . 0 0 "[ . 1 . 2]" 1
1512 1 91 LEU HG 1 92 ASP HB3 4.800 . 5.300 3.836 3.158 4.800 . 0 0 "[ . 1 . 2]" 1
1513 1 92 ASP H 1 92 ASP HA 2.900 . 3.400 2.246 2.239 2.260 . 0 0 "[ . 1 . 2]" 1
1514 1 92 ASP H 1 93 SER H 3.370 . 3.870 2.730 2.679 2.802 . 0 0 "[ . 1 . 2]" 1
1515 1 92 ASP H 1 93 SER HA 5.110 . 5.610 4.970 4.917 5.039 . 0 0 "[ . 1 . 2]" 1
1516 1 92 ASP H 1 94 LYS H 4.780 . 5.280 4.282 4.225 4.346 . 0 0 "[ . 1 . 2]" 1
1517 1 92 ASP HA 1 93 SER H 3.070 . 3.570 2.785 2.683 2.861 . 0 0 "[ . 1 . 2]" 1
1518 1 92 ASP HA 1 93 SER HA 4.850 . 5.350 4.797 4.699 4.862 . 0 0 "[ . 1 . 2]" 1
1519 1 92 ASP HA 1 94 LYS H 5.100 . 5.600 4.479 4.415 4.648 . 0 0 "[ . 1 . 2]" 1
1520 1 92 ASP QB 1 93 SER QB 6.530 . 7.030 4.870 4.406 4.937 . 0 0 "[ . 1 . 2]" 1
1521 1 93 SER H 1 93 SER HA 2.720 . 3.220 2.266 2.260 2.275 . 0 0 "[ . 1 . 2]" 1
1522 1 93 SER H 1 93 SER HB2 4.040 . 4.540 3.687 3.660 3.719 . 0 0 "[ . 1 . 2]" 1
1523 1 93 SER H 1 93 SER HB3 4.040 . 4.540 4.061 4.054 4.068 . 0 0 "[ . 1 . 2]" 1
1524 1 93 SER H 1 94 LYS H 3.250 . 3.750 2.773 2.743 2.797 . 0 0 "[ . 1 . 2]" 1
1525 1 93 SER HA 1 94 LYS H 3.360 . 3.860 3.057 2.996 3.100 . 0 0 "[ . 1 . 2]" 1
1526 1 93 SER QB 1 94 LYS H 4.480 . 4.980 3.827 3.788 3.919 . 0 0 "[ . 1 . 2]" 1
1527 1 93 SER QB 1 94 LYS HG2 4.890 . 5.390 3.947 3.703 4.238 . 0 0 "[ . 1 . 2]" 1
1528 1 93 SER HB2 1 94 LYS H 4.700 . 5.200 4.128 4.074 4.268 . 0 0 "[ . 1 . 2]" 1
1529 1 93 SER HB3 1 94 LYS H 4.700 . 5.200 4.527 4.503 4.563 . 0 0 "[ . 1 . 2]" 1
1530 1 94 LYS H 1 94 LYS HB2 3.130 . 3.630 2.438 2.339 2.642 . 0 0 "[ . 1 . 2]" 1
1531 1 94 LYS H 1 94 LYS HB3 3.640 . 4.140 3.606 3.504 3.674 . 0 0 "[ . 1 . 2]" 1
1532 1 94 LYS H 1 94 LYS HG2 3.880 . 4.380 3.468 3.098 3.886 . 0 0 "[ . 1 . 2]" 1
1533 1 94 LYS H 1 94 LYS HG3 4.820 . 5.320 4.178 3.825 4.680 . 0 0 "[ . 1 . 2]" 1
1534 1 94 LYS H 1 95 THR H 4.650 . 5.150 4.394 4.316 4.458 . 0 0 "[ . 1 . 2]" 1
1535 1 94 LYS H 1 96 ILE MG 5.760 . 6.260 4.249 4.170 4.329 . 0 0 "[ . 1 . 2]" 1
1536 1 94 LYS HA 1 94 LYS HD2 4.100 . 4.600 3.614 3.300 3.885 . 0 0 "[ . 1 . 2]" 1
1537 1 94 LYS HA 1 94 LYS HD3 4.100 . 4.600 2.442 2.182 2.639 . 0 0 "[ . 1 . 2]" 1
1538 1 94 LYS HA 1 95 THR H 2.930 . 3.430 2.156 2.114 2.184 . 0 0 "[ . 1 . 2]" 1
1539 1 94 LYS HA 1 95 THR HB 5.250 . 5.750 4.728 4.584 4.825 . 0 0 "[ . 1 . 2]" 1
1540 1 94 LYS HB2 1 96 ILE MG 4.830 . 5.330 3.681 3.452 3.908 . 0 0 "[ . 1 . 2]" 1
1541 1 94 LYS HB3 1 95 THR H 3.690 . 4.190 3.285 3.067 3.497 . 0 0 "[ . 1 . 2]" 1
1542 1 94 LYS HB3 1 96 ILE MG 4.940 . 5.440 3.496 3.056 3.784 . 0 0 "[ . 1 . 2]" 1
1543 1 94 LYS QD 1 95 THR H 3.950 . 4.450 3.292 2.863 3.570 . 0 0 "[ . 1 . 2]" 1
1544 1 94 LYS QD 2 1 G H8 7.300 . 7.800 3.968 3.315 4.894 . 0 0 "[ . 1 . 2]" 1
1545 1 94 LYS QE 2 1 G H1' 112.250 6.000 112.750 5.856 5.317 6.593 0.683 12 4 "[* . * + . -]" 1
1546 1 94 LYS QE 2 1 G H2' 112.250 6.000 112.750 5.601 5.290 6.455 0.710 10 13 "[* *****+-* . ****]" 1
1547 1 94 LYS HG2 1 95 THR H 4.570 . 5.070 4.574 4.378 4.652 . 0 0 "[ . 1 . 2]" 1
1548 1 94 LYS HG3 1 95 THR H 5.330 . 5.830 5.289 5.088 5.343 . 0 0 "[ . 1 . 2]" 1
1549 1 94 LYS HG3 1 96 ILE MG 6.460 . 6.960 5.254 4.809 5.385 . 0 0 "[ . 1 . 2]" 1
1550 1 95 THR H 1 95 THR HB 3.120 . 3.620 2.592 2.450 2.673 . 0 0 "[ . 1 . 2]" 1
1551 1 95 THR H 1 96 ILE H 4.530 . 5.030 4.525 4.446 4.546 . 0 0 "[ . 1 . 2]" 1
1552 1 95 THR HA 1 96 ILE H 3.260 . 3.760 2.169 2.141 2.191 . 0 0 "[ . 1 . 2]" 1
1553 1 95 THR HA 1 96 ILE MG 5.360 . 5.860 3.661 3.542 3.779 . 0 0 "[ . 1 . 2]" 1
1554 1 95 THR HB 1 96 ILE H 4.610 . 5.110 4.271 4.202 4.412 . 0 0 "[ . 1 . 2]" 1
1555 1 95 THR HB 1 96 ILE HA 5.500 . 6.000 4.930 4.798 5.134 . 0 0 "[ . 1 . 2]" 1
1556 1 95 THR MG 1 96 ILE H 4.360 . 4.860 2.909 2.827 3.108 . 0 0 "[ . 1 . 2]" 1
1557 1 96 ILE H 1 96 ILE MD 4.730 . 5.230 3.971 3.959 3.983 . 0 0 "[ . 1 . 2]" 1
1558 1 96 ILE H 1 96 ILE HG12 3.620 . 4.120 2.369 2.342 2.405 . 0 0 "[ . 1 . 2]" 1
1559 1 96 ILE H 1 96 ILE QG 3.460 . 3.960 2.317 2.277 2.356 . 0 0 "[ . 1 . 2]" 1
1560 1 96 ILE H 1 96 ILE HG13 3.620 . 4.120 3.275 3.105 3.375 . 0 0 "[ . 1 . 2]" 1
1561 1 96 ILE H 1 96 ILE MG 4.280 . 4.780 2.635 2.466 2.751 . 0 0 "[ . 1 . 2]" 1
1562 1 96 ILE HA 1 97 ASP H 3.550 . 4.050 2.262 2.204 2.305 . 0 0 "[ . 1 . 2]" 1
1563 1 96 ILE HB 1 97 ASP H 3.590 . 4.090 2.549 2.471 2.685 . 0 0 "[ . 1 . 2]" 1
1564 1 96 ILE HB 1 98 PRO HG3 4.410 . 4.910 4.480 4.460 4.494 . 0 0 "[ . 1 . 2]" 1
1565 1 96 ILE MD 1 97 ASP H 6.410 . 6.910 4.280 4.149 4.462 . 0 0 "[ . 1 . 2]" 1
1566 1 96 ILE MD 1 98 PRO HD2 5.790 . 6.290 4.712 4.323 4.844 . 0 0 "[ . 1 . 2]" 1
1567 1 96 ILE MD 1 98 PRO HD3 4.960 . 5.460 3.431 3.103 3.561 . 0 0 "[ . 1 . 2]" 1
1568 1 96 ILE MD 1 98 PRO HG2 5.910 . 6.410 4.480 4.312 4.655 . 0 0 "[ . 1 . 2]" 1
1569 1 96 ILE MD 1 98 PRO HG3 4.650 . 5.150 2.988 2.846 3.169 . 0 0 "[ . 1 . 2]" 1
1570 1 96 ILE QG 1 98 PRO HD3 4.420 . 4.920 2.208 2.179 2.255 . 0 0 "[ . 1 . 2]" 1
1571 1 96 ILE MG 1 97 ASP H 4.910 . 5.410 3.788 3.692 3.846 . 0 0 "[ . 1 . 2]" 1
1572 1 97 ASP H 1 97 ASP HB2 3.950 . 4.450 3.098 3.057 3.148 . 0 0 "[ . 1 . 2]" 1
1573 1 97 ASP H 1 97 ASP HB3 3.950 . 4.450 2.593 2.557 2.622 . 0 0 "[ . 1 . 2]" 1
1574 1 97 ASP H 1 98 PRO HD3 4.820 . 5.320 3.175 2.959 3.318 . 0 0 "[ . 1 . 2]" 1
1575 1 97 ASP HA 1 98 PRO HD2 3.350 . 3.850 2.422 2.273 2.534 . 0 0 "[ . 1 . 2]" 1
1576 1 97 ASP HA 1 98 PRO HD3 3.210 . 3.710 2.670 2.436 3.069 . 0 0 "[ . 1 . 2]" 1
1577 1 97 ASP HA 1 98 PRO HG3 4.970 . 5.470 4.703 4.591 4.865 . 0 0 "[ . 1 . 2]" 1
1578 1 98 PRO HA 1 99 LYS H 3.240 . 3.740 2.191 2.148 2.224 . 0 0 "[ . 1 . 2]" 1
1579 1 98 PRO HA 1 99 LYS QG 5.290 . 5.790 3.368 3.200 3.732 . 0 0 "[ . 1 . 2]" 1
1580 1 98 PRO HB3 1 99 LYS H 4.260 . 4.760 3.728 3.611 3.920 . 0 0 "[ . 1 . 2]" 1
1581 1 99 LYS H 1 99 LYS QE 5.650 . 6.150 4.495 3.719 4.907 . 0 0 "[ . 1 . 2]" 1
1582 1 99 LYS H 1 99 LYS QG 4.400 . 4.900 2.422 2.327 2.883 . 0 0 "[ . 1 . 2]" 1
1583 1 99 LYS HA 1 100 VAL H 3.540 . 4.040 2.446 2.404 2.471 . 0 0 "[ . 1 . 2]" 1
1584 1 99 LYS HA 1 100 VAL QG 6.040 . 6.540 3.669 3.595 3.824 . 0 0 "[ . 1 . 2]" 1
1585 1 99 LYS QB 1 99 LYS QE 4.170 . 4.670 2.257 2.017 3.400 . 0 0 "[ . 1 . 2]" 1
1586 1 99 LYS QB 1 100 VAL QG 6.690 . 7.190 4.000 3.908 4.128 . 0 0 "[ . 1 . 2]" 1
1587 1 99 LYS QB 2 3 A Q6 6.930 . 7.430 3.918 2.675 4.223 . 0 0 "[ . 1 . 2]" 1
1588 1 99 LYS HB2 1 100 VAL H 3.950 . 4.450 2.579 2.463 3.668 . 0 0 "[ . 1 . 2]" 1
1589 1 99 LYS HB3 1 100 VAL H 3.950 . 4.450 3.787 2.652 3.918 . 0 0 "[ . 1 . 2]" 1
1590 1 99 LYS QD 2 3 A Q6 5.670 . 6.170 2.539 2.178 3.534 . 0 0 "[ . 1 . 2]" 1
1591 1 99 LYS QE 2 3 A Q6 6.930 . 7.430 4.130 3.084 4.584 . 0 0 "[ . 1 . 2]" 1
1592 1 99 LYS QG 1 100 VAL H 5.260 . 5.760 3.609 3.356 4.183 . 0 0 "[ . 1 . 2]" 1
1593 1 99 LYS QG 2 3 A Q6 5.670 . 6.170 2.675 2.353 4.185 . 0 0 "[ . 1 . 2]" 1
1594 1 100 VAL H 1 100 VAL HB 3.650 . 4.150 2.589 2.552 2.633 . 0 0 "[ . 1 . 2]" 1
1595 1 100 VAL H 1 100 VAL QG 4.020 . 4.520 2.147 2.095 2.257 . 0 0 "[ . 1 . 2]" 1
1596 1 100 VAL HA 1 101 ALA H 3.060 . 3.560 2.189 2.175 2.206 . 0 0 "[ . 1 . 2]" 1
1597 1 100 VAL HA 1 101 ALA MB 4.880 . 5.380 3.932 3.902 3.978 . 0 0 "[ . 1 . 2]" 1
1598 1 100 VAL HB 1 101 ALA H 4.510 . 5.010 4.126 4.088 4.170 . 0 0 "[ . 1 . 2]" 1
1599 1 100 VAL QG 1 101 ALA H 4.700 . 5.200 2.496 2.450 2.561 . 0 0 "[ . 1 . 2]" 1
1600 1 100 VAL MG1 1 101 ALA H 5.140 . 5.640 2.523 2.473 2.592 . 0 0 "[ . 1 . 2]" 1
1601 1 100 VAL MG2 1 101 ALA H 5.140 . 5.640 3.965 3.935 4.011 . 0 0 "[ . 1 . 2]" 1
1602 1 101 ALA HA 2 3 A H2 5.500 . 6.000 3.299 3.092 3.479 . 0 0 "[ . 1 . 2]" 1
1603 1 101 ALA HA 2 3 A Q6 6.170 . 6.670 2.678 2.513 2.860 . 0 0 "[ . 1 . 2]" 1
1604 1 101 ALA MB 1 102 PHE H 4.920 . 5.420 2.969 2.782 3.106 . 0 0 "[ . 1 . 2]" 1
1605 1 101 ALA MB 2 3 A H2 4.200 . 4.700 3.226 2.909 3.393 . 0 0 "[ . 1 . 2]" 1
1606 1 101 ALA MB 2 3 A Q6 7.410 . 7.910 4.199 4.068 4.347 . 0 0 "[ . 1 . 2]" 1
1607 1 102 PHE H 2 3 A H2 3.500 . 4.000 2.228 2.072 2.463 . 0 0 "[ . 1 . 2]" 1
1608 1 102 PHE H 2 3 A Q6 5.050 . 5.550 3.108 2.923 3.301 . 0 0 "[ . 1 . 2]" 1
1609 1 102 PHE HA 1 103 PRO HD2 3.590 . 4.090 2.608 2.292 3.044 . 0 0 "[ . 1 . 2]" 1
1610 1 102 PHE HA 1 103 PRO QD 3.410 . 3.910 2.109 2.017 2.238 . 0 0 "[ . 1 . 2]" 1
1611 1 102 PHE HA 1 103 PRO HD3 3.590 . 4.090 2.287 2.065 2.610 . 0 0 "[ . 1 . 2]" 1
1612 1 102 PHE HA 1 103 PRO QG 4.830 . 5.330 4.033 3.927 4.156 . 0 0 "[ . 1 . 2]" 1
1613 1 102 PHE HA 2 5 U H1' 100.000 5.500 100.500 11.856 10.615 15.178 . 0 0 "[ . 1 . 2]" 1
1614 1 102 PHE QB 2 5 U H1' 112.250 5.500 112.750 9.238 8.207 11.945 . 0 0 "[ . 1 . 2]" 1
1615 1 102 PHE HB2 1 103 PRO QD 4.490 . 4.990 3.705 3.487 4.027 . 0 0 "[ . 1 . 2]" 1
1616 1 102 PHE HB3 1 103 PRO HD2 4.110 . 4.610 2.450 2.136 2.919 . 0 0 "[ . 1 . 2]" 1
1617 1 102 PHE HB3 1 103 PRO QD 4.040 . 4.540 2.406 2.123 2.859 . 0 0 "[ . 1 . 2]" 1
1618 1 102 PHE HB3 1 103 PRO HD3 4.110 . 4.610 3.588 2.998 4.091 . 0 0 "[ . 1 . 2]" 1
1619 1 102 PHE QD 1 103 PRO HD2 5.700 . 6.200 3.965 3.298 4.384 . 0 0 "[ . 1 . 2]" 1
1620 1 102 PHE QD 1 103 PRO HD3 5.700 . 6.200 4.011 3.659 4.330 . 0 0 "[ . 1 . 2]" 1
1621 1 102 PHE QD 2 3 A H1' 5.050 . 5.550 4.204 3.831 4.513 . 0 0 "[ . 1 . 2]" 1
1622 1 102 PHE QD 2 3 A H2 6.170 . 6.670 3.459 3.169 3.645 . 0 0 "[ . 1 . 2]" 1
1623 1 102 PHE QD 2 5 U H1' 112.250 5.500 112.750 10.719 9.686 12.608 . 0 0 "[ . 1 . 2]" 1
1624 1 102 PHE QE 2 3 A H1' 5.050 . 5.550 4.345 3.947 4.511 . 0 0 "[ . 1 . 2]" 1
1625 1 102 PHE QE 2 3 A H8 6.170 . 6.670 4.304 4.082 4.819 . 0 0 "[ . 1 . 2]" 1
1626 1 102 PHE QE 2 5 U H1' 112.250 5.500 112.750 12.671 11.626 14.151 . 0 0 "[ . 1 . 2]" 1
1627 1 102 PHE HZ 2 5 U H1' 100.000 5.500 100.500 15.408 14.333 17.039 . 0 0 "[ . 1 . 2]" 1
1628 1 103 PRO HA 1 104 ARG H 3.160 . 3.660 2.321 2.110 2.530 . 0 0 "[ . 1 . 2]" 1
1629 1 103 PRO QB 1 104 ARG H 4.130 . 4.630 2.696 2.228 3.122 . 0 0 "[ . 1 . 2]" 1
1630 1 103 PRO HB2 1 104 ARG H 4.250 . 4.750 3.036 2.261 3.782 . 0 0 "[ . 1 . 2]" 1
1631 1 103 PRO HB3 1 104 ARG H 4.250 . 4.750 3.301 2.604 3.858 . 0 0 "[ . 1 . 2]" 1
1632 1 103 PRO QG 1 104 ARG H 5.060 . 5.560 4.274 3.839 4.525 . 0 0 "[ . 1 . 2]" 1
1633 1 104 ARG H 1 104 ARG HB2 3.810 . 4.310 3.288 2.331 3.895 . 0 0 "[ . 1 . 2]" 1
1634 1 104 ARG H 1 104 ARG HB3 3.810 . 4.310 3.373 2.636 3.825 . 0 0 "[ . 1 . 2]" 1
1635 1 104 ARG H 1 104 ARG QG 3.970 . 4.470 2.713 2.159 3.558 . 0 0 "[ . 1 . 2]" 1
1636 1 104 ARG H 1 105 ARG H 4.600 . 5.100 4.254 2.200 4.616 . 0 0 "[ . 1 . 2]" 1
1637 1 104 ARG HA 1 105 ARG H 3.010 . 3.510 2.370 2.122 3.060 . 0 0 "[ . 1 . 2]" 1
1638 1 104 ARG QB 1 105 ARG H 4.310 . 4.810 2.764 2.139 3.731 . 0 0 "[ . 1 . 2]" 1
1639 1 104 ARG HB2 1 105 ARG H 4.580 . 5.080 3.237 2.154 4.275 . 0 0 "[ . 1 . 2]" 1
1640 1 104 ARG HB3 1 105 ARG H 4.580 . 5.080 3.589 2.343 4.493 . 0 0 "[ . 1 . 2]" 1
1641 1 104 ARG QD 2 5 U H6 112.250 5.500 112.750 7.444 4.891 11.486 0.609 8 1 "[ . + 1 . 2]" 1
1642 1 105 ARG H 1 105 ARG HB2 4.020 . 4.520 2.787 2.318 3.966 . 0 0 "[ . 1 . 2]" 1
1643 1 105 ARG H 1 105 ARG HB3 4.020 . 4.520 3.271 2.457 3.893 . 0 0 "[ . 1 . 2]" 1
1644 1 105 ARG H 1 105 ARG QG 4.580 . 5.080 3.494 2.374 4.138 . 0 0 "[ . 1 . 2]" 1
1645 1 105 ARG HA 1 105 ARG HD2 4.340 . 4.840 3.326 2.168 4.386 . 0 0 "[ . 1 . 2]" 1
1646 1 105 ARG HA 1 105 ARG HD3 4.340 . 4.840 3.517 2.198 4.464 . 0 0 "[ . 1 . 2]" 1
1647 1 105 ARG HA 1 106 ALA H 3.160 . 3.660 2.191 2.081 3.000 . 0 0 "[ . 1 . 2]" 1
1648 1 105 ARG HA 1 106 ALA MB 5.340 . 5.840 4.037 3.846 4.484 . 0 0 "[ . 1 . 2]" 1
1649 1 105 ARG QB 1 106 ALA H 4.700 . 5.200 3.509 2.698 4.058 . 0 0 "[ . 1 . 2]" 1
1650 1 105 ARG QD 2 5 U H6 112.250 5.500 112.750 9.996 5.291 20.435 0.209 14 0 "[ . 1 . 2]" 1
1651 1 105 ARG QG 1 106 ALA H 5.610 . 6.110 3.849 2.267 4.850 . 0 0 "[ . 1 . 2]" 1
1652 1 106 ALA H 1 107 GLN H 4.850 . 5.350 4.419 4.250 4.679 . 0 0 "[ . 1 . 2]" 1
1653 1 106 ALA HA 1 107 GLN H 2.800 . 3.300 2.428 2.224 2.803 . 0 0 "[ . 1 . 2]" 1
1654 1 106 ALA HA 2 5 U H5 100.000 5.500 100.500 11.529 6.747 22.366 . 0 0 "[ . 1 . 2]" 1
1655 1 106 ALA MB 1 107 GLN H 4.310 . 4.810 2.517 2.024 2.983 . 0 0 "[ . 1 . 2]" 1
1656 1 107 GLN H 1 107 GLN HB2 3.790 . 4.290 2.986 2.383 3.915 . 0 0 "[ . 1 . 2]" 1
1657 1 107 GLN H 1 107 GLN QB 3.550 . 4.050 2.711 2.232 3.192 . 0 0 "[ . 1 . 2]" 1
1658 1 107 GLN H 1 107 GLN HB3 3.790 . 4.290 3.527 2.473 3.832 . 0 0 "[ . 1 . 2]" 1
1659 1 107 GLN H 1 107 GLN QG 4.590 . 5.090 3.095 2.217 4.125 . 0 0 "[ . 1 . 2]" 1
1660 1 107 GLN HA 1 108 PRO HD2 3.240 . 3.740 2.433 2.265 2.995 . 0 0 "[ . 1 . 2]" 1
1661 1 107 GLN HA 1 108 PRO HD3 3.240 . 3.740 2.383 2.140 2.563 . 0 0 "[ . 1 . 2]" 1
1662 1 107 GLN QB 1 108 PRO QD 4.310 . 4.810 2.513 2.141 3.462 . 0 0 "[ . 1 . 2]" 1
1663 1 108 PRO HA 1 109 LYS H 2.890 . 3.390 2.259 2.144 2.506 . 0 0 "[ . 1 . 2]" 1
1664 1 108 PRO QB 1 109 LYS H 4.530 . 5.030 3.046 2.513 4.041 . 0 0 "[ . 1 . 2]" 1
1665 2 1 G H1' 2 1 G H8 5.000 . 5.500 3.829 3.702 3.907 . 0 0 "[ . 1 . 2]" 1
1666 2 1 G H2' 2 1 G H8 3.500 . 4.000 2.199 2.091 2.316 . 0 0 "[ . 1 . 2]" 1
1667 2 2 U H1' 2 2 U H6 5.000 . 5.500 3.725 3.713 3.736 . 0 0 "[ . 1 . 2]" 1
1668 2 2 U H2' 2 2 U H5 5.000 . 5.500 4.556 4.490 4.698 . 0 0 "[ . 1 . 2]" 1
1669 2 2 U H2' 2 2 U H6 3.300 . 3.800 2.694 2.584 2.836 . 0 0 "[ . 1 . 2]" 1
1670 2 2 U H3' 2 2 U H6 5.000 . 5.500 4.351 4.236 4.443 . 0 0 "[ . 1 . 2]" 1
1671 2 3 A H1' 2 3 A H8 5.000 . 5.500 3.904 3.891 3.931 . 0 0 "[ . 1 . 2]" 1
1672 2 3 A H2' 2 3 A H8 3.500 . 4.000 2.310 2.224 2.665 . 0 0 "[ . 1 . 2]" 1
1673 2 3 A H3' 2 3 A H8 5.000 . 5.500 4.419 4.294 4.704 . 0 0 "[ . 1 . 2]" 1
1674 2 4 G H1' 2 4 G H8 2.800 . 3.300 2.499 2.430 2.588 . 0 0 "[ . 1 . 2]" 1
1675 2 4 G H2' 2 5 U H5 5.000 . 5.500 4.254 3.341 5.022 . 0 0 "[ . 1 . 2]" 1
1676 2 4 G H2' 2 5 U H6 5.000 . 5.500 2.679 2.172 3.268 . 0 0 "[ . 1 . 2]" 1
1677 2 4 G H3' 2 4 G H8 100.000 5.500 100.500 5.448 5.417 5.530 0.083 3 0 "[ . 1 . 2]" 1
1678 2 4 G H8 2 5 U H2' 5.000 . 5.500 4.519 3.604 5.014 . 0 0 "[ . 1 . 2]" 1
1679 2 5 U H1' 2 5 U H6 5.000 . 5.500 3.693 3.396 3.754 . 0 0 "[ . 1 . 2]" 1
1680 2 5 U H2' 2 5 U H6 3.500 . 4.000 2.557 2.219 3.159 . 0 0 "[ . 1 . 2]" 1
1681 2 5 U H3' 2 5 U H6 5.000 . 5.500 4.320 4.014 4.539 . 0 0 "[ . 1 . 2]" 1
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