NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
399828 |
1ufx   |
10066 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ufx
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 2276
_Distance_constraint_stats_list.Viol_count 1278
_Distance_constraint_stats_list.Viol_total 178.046
_Distance_constraint_stats_list.Viol_max 0.116
_Distance_constraint_stats_list.Viol_rms 0.0022
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0070
_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 6 SER 0.001 0.001 1 0 "[ . 1 . 2]"
1 7 GLY 0.044 0.029 12 0 "[ . 1 . 2]"
1 8 THR 0.141 0.026 15 0 "[ . 1 . 2]"
1 9 LEU 0.202 0.034 15 0 "[ . 1 . 2]"
1 10 VAL 0.195 0.021 20 0 "[ . 1 . 2]"
1 11 ARG 0.092 0.016 11 0 "[ . 1 . 2]"
1 12 VAL 0.058 0.010 20 0 "[ . 1 . 2]"
1 13 LYS 0.482 0.066 3 0 "[ . 1 . 2]"
1 14 LYS 0.130 0.042 11 0 "[ . 1 . 2]"
1 15 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ALA 0.001 0.001 17 0 "[ . 1 . 2]"
1 17 ALA 0.004 0.004 9 0 "[ . 1 . 2]"
1 18 THR 0.036 0.019 13 0 "[ . 1 . 2]"
1 19 LEU 0.014 0.004 5 0 "[ . 1 . 2]"
1 20 GLY 0.001 0.001 6 0 "[ . 1 . 2]"
1 21 ILE 0.026 0.015 9 0 "[ . 1 . 2]"
1 22 ALA 0.025 0.004 7 0 "[ . 1 . 2]"
1 23 ILE 0.193 0.014 14 0 "[ . 1 . 2]"
1 24 GLU 0.012 0.004 18 0 "[ . 1 . 2]"
1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 GLY 0.017 0.017 2 0 "[ . 1 . 2]"
1 27 ALA 0.029 0.017 2 0 "[ . 1 . 2]"
1 28 ASN 0.007 0.003 12 0 "[ . 1 . 2]"
1 29 THR 0.028 0.013 5 0 "[ . 1 . 2]"
1 30 ARG 0.124 0.031 16 0 "[ . 1 . 2]"
1 31 GLN 0.244 0.032 5 0 "[ . 1 . 2]"
1 32 PRO 0.299 0.031 16 0 "[ . 1 . 2]"
1 33 LEU 0.290 0.041 14 0 "[ . 1 . 2]"
1 34 PRO 0.431 0.026 14 0 "[ . 1 . 2]"
1 35 ARG 0.548 0.048 6 0 "[ . 1 . 2]"
1 36 ILE 0.255 0.029 15 0 "[ . 1 . 2]"
1 37 VAL 0.140 0.011 15 0 "[ . 1 . 2]"
1 38 THR 0.104 0.010 1 0 "[ . 1 . 2]"
1 39 ILE 0.173 0.024 13 0 "[ . 1 . 2]"
1 40 GLN 0.291 0.073 9 0 "[ . 1 . 2]"
1 41 ARG 0.008 0.008 9 0 "[ . 1 . 2]"
1 42 GLY 0.008 0.008 9 0 "[ . 1 . 2]"
1 43 GLY 0.000 0.000 20 0 "[ . 1 . 2]"
1 44 SER 0.009 0.006 20 0 "[ . 1 . 2]"
1 45 ALA 0.007 0.003 6 0 "[ . 1 . 2]"
1 46 HIS 0.007 0.003 6 0 "[ . 1 . 2]"
1 47 ASN 0.008 0.006 20 0 "[ . 1 . 2]"
1 48 CYS 0.004 0.002 20 0 "[ . 1 . 2]"
1 49 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 GLN 0.053 0.016 20 0 "[ . 1 . 2]"
1 51 LEU 0.103 0.021 20 0 "[ . 1 . 2]"
1 52 LYS 0.178 0.084 20 0 "[ . 1 . 2]"
1 53 VAL 0.045 0.008 9 0 "[ . 1 . 2]"
1 54 GLY 0.037 0.006 14 0 "[ . 1 . 2]"
1 55 HIS 0.215 0.084 20 0 "[ . 1 . 2]"
1 56 VAL 0.266 0.029 6 0 "[ . 1 . 2]"
1 57 ILE 0.462 0.026 14 0 "[ . 1 . 2]"
1 58 LEU 0.431 0.031 12 0 "[ . 1 . 2]"
1 59 GLU 0.225 0.031 12 0 "[ . 1 . 2]"
1 60 VAL 0.140 0.027 13 0 "[ . 1 . 2]"
1 61 ASN 0.455 0.055 18 0 "[ . 1 . 2]"
1 62 GLY 0.489 0.034 1 0 "[ . 1 . 2]"
1 63 LEU 0.587 0.043 8 0 "[ . 1 . 2]"
1 64 THR 0.681 0.045 12 0 "[ . 1 . 2]"
1 65 LEU 0.346 0.041 14 0 "[ . 1 . 2]"
1 66 ARG 0.757 0.105 13 0 "[ . 1 . 2]"
1 67 GLY 0.505 0.067 18 0 "[ . 1 . 2]"
1 68 LYS 0.334 0.116 16 0 "[ . 1 . 2]"
1 69 GLU 0.167 0.016 18 0 "[ . 1 . 2]"
1 70 HIS 0.029 0.005 11 0 "[ . 1 . 2]"
1 71 ARG 0.051 0.006 12 0 "[ . 1 . 2]"
1 72 GLU 0.150 0.016 11 0 "[ . 1 . 2]"
1 73 ALA 0.033 0.007 12 0 "[ . 1 . 2]"
1 74 ALA 0.060 0.015 11 0 "[ . 1 . 2]"
1 75 ARG 0.184 0.016 11 0 "[ . 1 . 2]"
1 76 ILE 0.055 0.006 16 0 "[ . 1 . 2]"
1 77 ILE 0.044 0.006 14 0 "[ . 1 . 2]"
1 78 ALA 0.023 0.006 11 0 "[ . 1 . 2]"
1 79 GLU 0.025 0.006 11 0 "[ . 1 . 2]"
1 80 ALA 0.038 0.008 14 0 "[ . 1 . 2]"
1 81 PHE 0.547 0.059 18 0 "[ . 1 . 2]"
1 82 LYS 0.461 0.059 18 0 "[ . 1 . 2]"
1 83 THR 0.053 0.017 1 0 "[ . 1 . 2]"
1 84 LYS 0.516 0.082 10 0 "[ . 1 . 2]"
1 85 ASP 0.055 0.043 18 0 "[ . 1 . 2]"
1 86 ARG 0.273 0.049 15 0 "[ . 1 . 2]"
1 87 ASP 0.009 0.003 14 0 "[ . 1 . 2]"
1 88 TYR 0.117 0.028 20 0 "[ . 1 . 2]"
1 89 ILE 0.092 0.013 3 0 "[ . 1 . 2]"
1 90 ASP 0.137 0.055 18 0 "[ . 1 . 2]"
1 91 PHE 0.145 0.025 15 0 "[ . 1 . 2]"
1 92 LEU 0.429 0.045 12 0 "[ . 1 . 2]"
1 93 VAL 0.190 0.012 15 0 "[ . 1 . 2]"
1 94 THR 0.063 0.007 12 0 "[ . 1 . 2]"
1 95 GLU 0.019 0.004 2 0 "[ . 1 . 2]"
1 96 PHE 0.010 0.004 15 0 "[ . 1 . 2]"
1 97 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 PRO 0.000 0.000 . 0 "[ . 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 6 SER HA 1 6 SER QB . . 2.480 2.346 2.186 2.477 . 0 0 "[ . 1 . 2]" 1
2 1 6 SER HA 1 7 GLY H . . 3.570 2.299 2.143 3.504 . 0 0 "[ . 1 . 2]" 1
3 1 6 SER QB 1 7 GLY H . . 4.080 3.249 2.282 3.899 . 0 0 "[ . 1 . 2]" 1
4 1 6 SER QB 1 58 LEU MD1 . . 5.000 4.575 4.306 4.873 . 0 0 "[ . 1 . 2]" 1
5 1 6 SER QB 1 94 THR MG . . 5.100 4.627 4.161 5.101 0.001 1 0 "[ . 1 . 2]" 1
6 1 7 GLY H 1 8 THR H . . 4.590 4.213 3.825 4.422 . 0 0 "[ . 1 . 2]" 1
7 1 7 GLY H 1 92 LEU MD1 . . 4.810 4.289 3.839 4.531 . 0 0 "[ . 1 . 2]" 1
8 1 7 GLY HA2 1 8 THR H . . 2.600 2.278 2.142 2.466 . 0 0 "[ . 1 . 2]" 1
9 1 7 GLY HA2 1 8 THR HB . . 4.600 4.494 4.309 4.590 . 0 0 "[ . 1 . 2]" 1
10 1 7 GLY HA2 1 58 LEU MD1 . . 4.500 3.329 2.877 3.793 . 0 0 "[ . 1 . 2]" 1
11 1 7 GLY HA2 1 92 LEU MD1 . . 4.140 2.826 2.207 3.287 . 0 0 "[ . 1 . 2]" 1
12 1 7 GLY HA2 1 92 LEU HG . . 5.120 4.516 4.164 4.911 . 0 0 "[ . 1 . 2]" 1
13 1 7 GLY HA2 1 93 VAL H . . 5.080 4.892 4.386 5.080 . 0 0 "[ . 1 . 2]" 1
14 1 7 GLY HA2 1 93 VAL MG2 . . 5.500 4.872 4.399 5.243 . 0 0 "[ . 1 . 2]" 1
15 1 7 GLY HA2 1 94 THR MG . . 4.550 4.191 3.735 4.538 . 0 0 "[ . 1 . 2]" 1
16 1 7 GLY HA3 1 8 THR H . . 3.240 2.921 2.662 3.199 . 0 0 "[ . 1 . 2]" 1
17 1 7 GLY HA3 1 58 LEU MD1 . . 4.030 3.321 2.962 3.677 . 0 0 "[ . 1 . 2]" 1
18 1 7 GLY HA3 1 92 LEU HB2 . . 5.460 5.426 5.274 5.489 0.029 12 0 "[ . 1 . 2]" 1
19 1 7 GLY HA3 1 92 LEU MD1 . . 2.890 1.981 1.892 2.078 . 0 0 "[ . 1 . 2]" 1
20 1 7 GLY HA3 1 92 LEU MD2 . . 4.420 3.712 3.103 3.997 . 0 0 "[ . 1 . 2]" 1
21 1 7 GLY HA3 1 92 LEU HG . . 4.250 4.012 3.536 4.249 . 0 0 "[ . 1 . 2]" 1
22 1 7 GLY HA3 1 94 THR HB . . 4.010 3.843 3.471 4.011 0.001 16 0 "[ . 1 . 2]" 1
23 1 7 GLY HA3 1 94 THR MG . . 5.470 5.063 4.658 5.336 . 0 0 "[ . 1 . 2]" 1
24 1 8 THR H 1 8 THR HB . . 2.740 2.656 2.516 2.757 0.017 15 0 "[ . 1 . 2]" 1
25 1 8 THR H 1 8 THR MG . . 3.890 3.843 3.792 3.887 . 0 0 "[ . 1 . 2]" 1
26 1 8 THR H 1 9 LEU H . . 4.320 4.106 3.940 4.265 . 0 0 "[ . 1 . 2]" 1
27 1 8 THR H 1 58 LEU MD1 . . 5.040 4.163 3.625 4.804 . 0 0 "[ . 1 . 2]" 1
28 1 8 THR H 1 92 LEU HA . . 4.720 4.071 3.733 4.474 . 0 0 "[ . 1 . 2]" 1
29 1 8 THR H 1 92 LEU MD1 . . 3.190 2.352 1.790 2.934 . 0 0 "[ . 1 . 2]" 1
30 1 8 THR H 1 92 LEU MD2 . . 5.500 4.944 4.166 5.506 0.006 20 0 "[ . 1 . 2]" 1
31 1 8 THR H 1 92 LEU HG . . 4.870 4.295 3.785 4.834 . 0 0 "[ . 1 . 2]" 1
32 1 8 THR H 1 93 VAL H . . 3.560 3.132 2.942 3.486 . 0 0 "[ . 1 . 2]" 1
33 1 8 THR H 1 93 VAL HA . . 4.900 4.609 4.346 4.848 . 0 0 "[ . 1 . 2]" 1
34 1 8 THR H 1 93 VAL MG2 . . 3.910 3.423 2.885 3.726 . 0 0 "[ . 1 . 2]" 1
35 1 8 THR H 1 94 THR HA . . 4.950 3.485 3.256 3.789 . 0 0 "[ . 1 . 2]" 1
36 1 8 THR H 1 94 THR HB . . 4.870 4.155 3.486 4.832 . 0 0 "[ . 1 . 2]" 1
37 1 8 THR HA 1 8 THR HB . . 3.020 3.022 3.010 3.025 0.005 8 0 "[ . 1 . 2]" 1
38 1 8 THR HA 1 8 THR MG . . 2.700 2.390 2.329 2.524 . 0 0 "[ . 1 . 2]" 1
39 1 8 THR HA 1 9 LEU H . . 2.400 2.160 2.142 2.182 . 0 0 "[ . 1 . 2]" 1
40 1 8 THR HA 1 9 LEU HB2 . . 4.430 4.379 4.291 4.456 0.026 15 0 "[ . 1 . 2]" 1
41 1 8 THR HA 1 9 LEU HB3 . . 4.980 4.833 4.729 4.928 . 0 0 "[ . 1 . 2]" 1
42 1 8 THR HA 1 10 VAL MG2 . . 5.290 4.700 4.505 4.864 . 0 0 "[ . 1 . 2]" 1
43 1 8 THR HA 1 92 LEU MD1 . . 4.050 3.743 3.436 4.027 . 0 0 "[ . 1 . 2]" 1
44 1 8 THR HA 1 93 VAL MG2 . . 5.320 4.785 4.505 5.055 . 0 0 "[ . 1 . 2]" 1
45 1 8 THR HB 1 9 LEU H . . 4.440 4.403 4.275 4.448 0.008 20 0 "[ . 1 . 2]" 1
46 1 8 THR HB 1 10 VAL MG2 . . 3.770 3.532 3.324 3.715 . 0 0 "[ . 1 . 2]" 1
47 1 8 THR HB 1 93 VAL H . . 4.300 3.730 3.078 4.267 . 0 0 "[ . 1 . 2]" 1
48 1 8 THR HB 1 93 VAL MG2 . . 3.260 2.591 2.148 3.045 . 0 0 "[ . 1 . 2]" 1
49 1 8 THR MG 1 9 LEU H . . 3.170 2.973 2.567 3.123 . 0 0 "[ . 1 . 2]" 1
50 1 8 THR MG 1 9 LEU HB3 . . 4.550 4.441 4.201 4.556 0.006 20 0 "[ . 1 . 2]" 1
51 1 8 THR MG 1 10 VAL H . . 4.670 4.388 4.058 4.621 . 0 0 "[ . 1 . 2]" 1
52 1 8 THR MG 1 10 VAL HA . . 4.130 4.016 3.821 4.127 . 0 0 "[ . 1 . 2]" 1
53 1 8 THR MG 1 10 VAL MG1 . . 4.520 4.345 4.193 4.464 . 0 0 "[ . 1 . 2]" 1
54 1 8 THR MG 1 10 VAL MG2 . . 2.740 2.383 2.050 2.619 . 0 0 "[ . 1 . 2]" 1
55 1 8 THR MG 1 93 VAL H . . 4.740 4.277 3.733 4.676 . 0 0 "[ . 1 . 2]" 1
56 1 8 THR MG 1 93 VAL MG2 . . 3.810 3.225 2.640 3.722 . 0 0 "[ . 1 . 2]" 1
57 1 9 LEU H 1 9 LEU HB2 . . 2.680 2.314 2.222 2.452 . 0 0 "[ . 1 . 2]" 1
58 1 9 LEU H 1 9 LEU HB3 . . 2.900 2.745 2.657 2.829 . 0 0 "[ . 1 . 2]" 1
59 1 9 LEU H 1 9 LEU MD1 . . 4.290 4.199 4.128 4.290 0.000 11 0 "[ . 1 . 2]" 1
60 1 9 LEU H 1 9 LEU MD2 . . 4.220 3.804 3.657 4.003 . 0 0 "[ . 1 . 2]" 1
61 1 9 LEU H 1 9 LEU HG . . 4.710 4.590 4.504 4.673 . 0 0 "[ . 1 . 2]" 1
62 1 9 LEU H 1 10 VAL H . . 4.600 4.495 4.431 4.549 . 0 0 "[ . 1 . 2]" 1
63 1 9 LEU H 1 92 LEU HA . . 4.650 4.466 4.173 4.609 . 0 0 "[ . 1 . 2]" 1
64 1 9 LEU H 1 92 LEU MD1 . . 4.650 3.550 3.297 3.820 . 0 0 "[ . 1 . 2]" 1
65 1 9 LEU HA 1 9 LEU MD1 . . 3.820 2.578 2.340 2.998 . 0 0 "[ . 1 . 2]" 1
66 1 9 LEU HA 1 9 LEU MD2 . . 2.750 2.111 1.937 2.398 . 0 0 "[ . 1 . 2]" 1
67 1 9 LEU HA 1 9 LEU HG . . 3.760 3.719 3.630 3.780 0.020 15 0 "[ . 1 . 2]" 1
68 1 9 LEU HA 1 10 VAL H . . 2.510 2.143 2.139 2.154 . 0 0 "[ . 1 . 2]" 1
69 1 9 LEU HA 1 10 VAL HB . . 4.710 4.660 4.611 4.712 0.002 15 0 "[ . 1 . 2]" 1
70 1 9 LEU HA 1 10 VAL MG2 . . 3.680 3.568 3.381 3.674 . 0 0 "[ . 1 . 2]" 1
71 1 9 LEU HA 1 92 LEU HA . . 3.090 2.393 2.098 2.516 . 0 0 "[ . 1 . 2]" 1
72 1 9 LEU HA 1 92 LEU HB2 . . 4.550 3.370 3.097 3.619 . 0 0 "[ . 1 . 2]" 1
73 1 9 LEU HA 1 92 LEU MD1 . . 3.270 3.189 2.929 3.284 0.014 12 0 "[ . 1 . 2]" 1
74 1 9 LEU HB2 1 9 LEU MD1 . . 3.560 3.181 3.162 3.191 . 0 0 "[ . 1 . 2]" 1
75 1 9 LEU HB2 1 10 VAL H . . 4.490 4.409 4.340 4.471 . 0 0 "[ . 1 . 2]" 1
76 1 9 LEU HB2 1 92 LEU HA . . 4.840 4.558 4.154 4.710 . 0 0 "[ . 1 . 2]" 1
77 1 9 LEU HB3 1 9 LEU MD1 . . 3.190 2.360 2.139 2.493 . 0 0 "[ . 1 . 2]" 1
78 1 9 LEU HB3 1 9 LEU HG . . 2.660 2.407 2.323 2.549 . 0 0 "[ . 1 . 2]" 1
79 1 9 LEU HB3 1 10 VAL H . . 4.160 4.077 3.964 4.169 0.009 15 0 "[ . 1 . 2]" 1
80 1 9 LEU HB3 1 10 VAL MG2 . . 5.500 4.926 4.774 5.054 . 0 0 "[ . 1 . 2]" 1
81 1 9 LEU HB3 1 92 LEU HA . . 5.460 5.356 5.048 5.494 0.034 15 0 "[ . 1 . 2]" 1
82 1 9 LEU MD1 1 10 VAL H . . 3.790 2.198 1.856 2.966 . 0 0 "[ . 1 . 2]" 1
83 1 9 LEU MD1 1 11 ARG HA . . 4.710 3.294 3.154 3.559 . 0 0 "[ . 1 . 2]" 1
84 1 9 LEU MD1 1 11 ARG QB . . 5.200 3.037 2.775 3.328 . 0 0 "[ . 1 . 2]" 1
85 1 9 LEU MD1 1 90 ASP HA . . 4.550 2.770 2.297 3.111 . 0 0 "[ . 1 . 2]" 1
86 1 9 LEU MD1 1 90 ASP HB2 . . 4.430 3.198 1.995 3.927 . 0 0 "[ . 1 . 2]" 1
87 1 9 LEU MD1 1 90 ASP QB . . 3.630 2.364 1.900 3.014 . 0 0 "[ . 1 . 2]" 1
88 1 9 LEU MD1 1 90 ASP HB3 . . 4.430 2.932 1.911 4.429 . 0 0 "[ . 1 . 2]" 1
89 1 9 LEU MD1 1 91 PHE H . . 4.720 2.855 2.249 3.724 . 0 0 "[ . 1 . 2]" 1
90 1 9 LEU MD1 1 92 LEU HA . . 5.120 4.102 3.603 4.722 . 0 0 "[ . 1 . 2]" 1
91 1 9 LEU MD2 1 10 VAL H . . 3.450 3.115 2.431 3.460 0.010 15 0 "[ . 1 . 2]" 1
92 1 9 LEU MD2 1 10 VAL HA . . 5.500 5.185 4.690 5.420 . 0 0 "[ . 1 . 2]" 1
93 1 9 LEU MD2 1 62 GLY H . . 5.400 4.585 4.240 5.077 . 0 0 "[ . 1 . 2]" 1
94 1 9 LEU MD2 1 90 ASP HA . . 4.140 3.897 3.469 4.140 0.000 19 0 "[ . 1 . 2]" 1
95 1 9 LEU MD2 1 90 ASP QB . . 3.130 2.470 1.898 3.157 0.027 15 0 "[ . 1 . 2]" 1
96 1 9 LEU MD2 1 91 PHE H . . 4.090 3.744 3.200 4.062 . 0 0 "[ . 1 . 2]" 1
97 1 9 LEU MD2 1 92 LEU HA . . 3.950 3.003 2.706 3.669 . 0 0 "[ . 1 . 2]" 1
98 1 9 LEU MD2 1 92 LEU HB3 . . 4.250 3.693 3.124 4.114 . 0 0 "[ . 1 . 2]" 1
99 1 9 LEU MD2 1 93 VAL H . . 5.500 4.776 4.511 5.420 . 0 0 "[ . 1 . 2]" 1
100 1 9 LEU HG 1 10 VAL H . . 5.120 4.719 4.498 4.928 . 0 0 "[ . 1 . 2]" 1
101 1 9 LEU HG 1 90 ASP QB . . 4.970 3.939 3.150 4.810 . 0 0 "[ . 1 . 2]" 1
102 1 10 VAL H 1 10 VAL HB . . 2.900 2.652 2.582 2.720 . 0 0 "[ . 1 . 2]" 1
103 1 10 VAL H 1 10 VAL MG1 . . 3.900 3.857 3.826 3.887 . 0 0 "[ . 1 . 2]" 1
104 1 10 VAL H 1 10 VAL MG2 . . 2.950 2.617 2.493 2.741 . 0 0 "[ . 1 . 2]" 1
105 1 10 VAL H 1 11 ARG H . . 4.510 4.203 4.043 4.487 . 0 0 "[ . 1 . 2]" 1
106 1 10 VAL H 1 91 PHE H . . 3.430 2.895 2.539 3.306 . 0 0 "[ . 1 . 2]" 1
107 1 10 VAL H 1 91 PHE HB2 . . 4.140 3.792 3.466 4.038 . 0 0 "[ . 1 . 2]" 1
108 1 10 VAL H 1 92 LEU HA . . 3.400 3.138 2.994 3.340 . 0 0 "[ . 1 . 2]" 1
109 1 10 VAL H 1 92 LEU HB2 . . 5.270 4.662 4.422 4.919 . 0 0 "[ . 1 . 2]" 1
110 1 10 VAL H 1 92 LEU MD1 . . 4.990 4.667 4.271 4.890 . 0 0 "[ . 1 . 2]" 1
111 1 10 VAL H 1 93 VAL H . . 4.170 4.031 3.693 4.169 . 0 0 "[ . 1 . 2]" 1
112 1 10 VAL H 1 93 VAL MG1 . . 4.980 4.751 4.545 4.933 . 0 0 "[ . 1 . 2]" 1
113 1 10 VAL H 1 93 VAL MG2 . . 4.380 4.260 3.894 4.388 0.008 15 0 "[ . 1 . 2]" 1
114 1 10 VAL HA 1 10 VAL MG1 . . 2.720 2.362 2.256 2.440 . 0 0 "[ . 1 . 2]" 1
115 1 10 VAL HA 1 10 VAL MG2 . . 2.740 2.455 2.428 2.510 . 0 0 "[ . 1 . 2]" 1
116 1 10 VAL HA 1 11 ARG H . . 2.420 2.160 2.140 2.196 . 0 0 "[ . 1 . 2]" 1
117 1 10 VAL HA 1 11 ARG HA . . 4.430 4.412 4.381 4.446 0.016 11 0 "[ . 1 . 2]" 1
118 1 10 VAL HA 1 11 ARG HB2 . . 4.830 4.611 4.377 4.786 . 0 0 "[ . 1 . 2]" 1
119 1 10 VAL HA 1 11 ARG QB . . 4.210 4.107 4.013 4.149 . 0 0 "[ . 1 . 2]" 1
120 1 10 VAL HA 1 11 ARG HB3 . . 4.830 4.619 4.464 4.761 . 0 0 "[ . 1 . 2]" 1
121 1 10 VAL HA 1 51 LEU QD . . 5.370 4.487 4.198 4.924 . 0 0 "[ . 1 . 2]" 1
122 1 10 VAL HA 1 93 VAL MG2 . . 5.500 5.130 4.921 5.266 . 0 0 "[ . 1 . 2]" 1
123 1 10 VAL HB 1 11 ARG H . . 4.390 4.305 3.992 4.401 0.011 11 0 "[ . 1 . 2]" 1
124 1 10 VAL HB 1 12 VAL MG2 . . 3.890 3.502 3.190 3.745 . 0 0 "[ . 1 . 2]" 1
125 1 10 VAL HB 1 51 LEU MD1 . . 4.510 3.436 2.639 3.754 . 0 0 "[ . 1 . 2]" 1
126 1 10 VAL HB 1 51 LEU QD . . 3.170 2.484 2.080 2.881 . 0 0 "[ . 1 . 2]" 1
127 1 10 VAL HB 1 51 LEU MD2 . . 4.510 2.615 2.097 3.871 . 0 0 "[ . 1 . 2]" 1
128 1 10 VAL HB 1 91 PHE H . . 3.830 3.319 3.117 3.583 . 0 0 "[ . 1 . 2]" 1
129 1 10 VAL HB 1 91 PHE HB2 . . 3.290 2.376 2.071 2.590 . 0 0 "[ . 1 . 2]" 1
130 1 10 VAL HB 1 91 PHE HB3 . . 3.710 3.425 3.002 3.661 . 0 0 "[ . 1 . 2]" 1
131 1 10 VAL HB 1 91 PHE QD . . 4.440 4.051 3.766 4.289 . 0 0 "[ . 1 . 2]" 1
132 1 10 VAL HB 1 93 VAL MG1 . . 4.100 3.950 3.606 4.100 0.000 20 0 "[ . 1 . 2]" 1
133 1 10 VAL HB 1 93 VAL MG2 . . 3.860 3.751 3.551 3.864 0.004 20 0 "[ . 1 . 2]" 1
134 1 10 VAL MG1 1 11 ARG H . . 3.200 2.826 2.099 3.126 . 0 0 "[ . 1 . 2]" 1
135 1 10 VAL MG1 1 11 ARG HA . . 4.190 4.055 3.707 4.190 0.000 13 0 "[ . 1 . 2]" 1
136 1 10 VAL MG1 1 11 ARG QB . . 5.340 4.214 3.863 4.336 . 0 0 "[ . 1 . 2]" 1
137 1 10 VAL MG1 1 12 VAL MG2 . . 2.690 2.341 2.143 2.570 . 0 0 "[ . 1 . 2]" 1
138 1 10 VAL MG1 1 50 GLN HB2 . . 3.650 3.170 2.351 3.657 0.007 15 0 "[ . 1 . 2]" 1
139 1 10 VAL MG1 1 50 GLN QB . . 2.910 2.287 1.928 2.599 . 0 0 "[ . 1 . 2]" 1
140 1 10 VAL MG1 1 50 GLN HB3 . . 3.650 2.379 1.974 2.659 . 0 0 "[ . 1 . 2]" 1
141 1 10 VAL MG1 1 50 GLN HG2 . . 4.690 3.444 2.178 4.642 . 0 0 "[ . 1 . 2]" 1
142 1 10 VAL MG1 1 50 GLN QG . . 3.910 3.085 2.139 3.910 . 15 0 "[ . 1 . 2]" 1
143 1 10 VAL MG1 1 50 GLN HG3 . . 4.690 3.824 2.981 4.667 . 0 0 "[ . 1 . 2]" 1
144 1 10 VAL MG1 1 51 LEU HG . . 3.610 2.111 1.927 3.618 0.008 14 0 "[ . 1 . 2]" 1
145 1 10 VAL MG1 1 55 HIS HE1 . . 5.420 5.291 5.060 5.437 0.017 20 0 "[ . 1 . 2]" 1
146 1 10 VAL MG1 1 91 PHE HB2 . . 3.840 3.293 3.012 3.702 . 0 0 "[ . 1 . 2]" 1
147 1 10 VAL MG1 1 91 PHE HB3 . . 4.760 4.388 3.975 4.761 0.001 20 0 "[ . 1 . 2]" 1
148 1 10 VAL MG1 1 93 VAL MG2 . . 4.200 4.062 3.929 4.203 0.003 20 0 "[ . 1 . 2]" 1
149 1 10 VAL MG2 1 11 ARG H . . 4.250 4.177 3.964 4.257 0.007 11 0 "[ . 1 . 2]" 1
150 1 10 VAL MG2 1 12 VAL MG2 . . 4.550 4.362 4.138 4.557 0.007 12 0 "[ . 1 . 2]" 1
151 1 10 VAL MG2 1 50 GLN HA . . 5.500 5.294 4.775 5.500 . 0 0 "[ . 1 . 2]" 1
152 1 10 VAL MG2 1 50 GLN QB . . 4.000 3.452 2.834 3.917 . 0 0 "[ . 1 . 2]" 1
153 1 10 VAL MG2 1 50 GLN QG . . 4.970 3.813 2.524 4.986 0.016 20 0 "[ . 1 . 2]" 1
154 1 10 VAL MG2 1 51 LEU HA . . 5.340 3.928 3.586 4.149 . 0 0 "[ . 1 . 2]" 1
155 1 10 VAL MG2 1 51 LEU MD1 . . 3.910 3.822 2.204 3.931 0.021 20 0 "[ . 1 . 2]" 1
156 1 10 VAL MG2 1 51 LEU QD . . 2.770 2.080 1.894 2.481 . 0 0 "[ . 1 . 2]" 1
157 1 10 VAL MG2 1 51 LEU MD2 . . 3.910 2.167 1.898 3.758 . 0 0 "[ . 1 . 2]" 1
158 1 10 VAL MG2 1 51 LEU HG . . 4.690 3.420 2.979 4.573 . 0 0 "[ . 1 . 2]" 1
159 1 10 VAL MG2 1 55 HIS HE1 . . 4.770 4.475 4.141 4.639 . 0 0 "[ . 1 . 2]" 1
160 1 10 VAL MG2 1 91 PHE H . . 4.780 4.522 4.342 4.707 . 0 0 "[ . 1 . 2]" 1
161 1 10 VAL MG2 1 91 PHE HB2 . . 4.210 3.872 3.663 4.082 . 0 0 "[ . 1 . 2]" 1
162 1 10 VAL MG2 1 91 PHE HB3 . . 4.590 4.223 3.907 4.543 . 0 0 "[ . 1 . 2]" 1
163 1 10 VAL MG2 1 91 PHE QD . . 5.460 5.159 4.963 5.340 . 0 0 "[ . 1 . 2]" 1
164 1 10 VAL MG2 1 92 LEU HA . . 5.500 3.942 3.524 4.212 . 0 0 "[ . 1 . 2]" 1
165 1 10 VAL MG2 1 93 VAL H . . 3.890 3.300 3.021 3.584 . 0 0 "[ . 1 . 2]" 1
166 1 10 VAL MG2 1 93 VAL HB . . 5.150 4.634 4.383 4.891 . 0 0 "[ . 1 . 2]" 1
167 1 10 VAL MG2 1 93 VAL MG2 . . 2.570 2.127 1.930 2.339 . 0 0 "[ . 1 . 2]" 1
168 1 11 ARG H 1 11 ARG HB2 . . 3.110 2.706 2.550 3.032 . 0 0 "[ . 1 . 2]" 1
169 1 11 ARG H 1 11 ARG QB . . 2.670 2.296 2.243 2.417 . 0 0 "[ . 1 . 2]" 1
170 1 11 ARG H 1 11 ARG HB3 . . 3.110 2.498 2.359 2.615 . 0 0 "[ . 1 . 2]" 1
171 1 11 ARG H 1 11 ARG QG . . 4.080 3.986 3.915 4.049 . 0 0 "[ . 1 . 2]" 1
172 1 11 ARG H 1 12 VAL MG2 . . 5.210 4.449 4.159 4.666 . 0 0 "[ . 1 . 2]" 1
173 1 11 ARG HA 1 11 ARG HD2 . . 5.030 4.464 3.701 4.719 . 0 0 "[ . 1 . 2]" 1
174 1 11 ARG HA 1 11 ARG QD . . 4.410 3.998 3.497 4.263 . 0 0 "[ . 1 . 2]" 1
175 1 11 ARG HA 1 11 ARG HD3 . . 5.030 4.548 3.981 4.858 . 0 0 "[ . 1 . 2]" 1
176 1 11 ARG HA 1 11 ARG QG . . 3.290 2.402 2.276 2.532 . 0 0 "[ . 1 . 2]" 1
177 1 11 ARG HA 1 12 VAL H . . 2.690 2.159 2.140 2.199 . 0 0 "[ . 1 . 2]" 1
178 1 11 ARG HA 1 12 VAL HB . . 4.660 4.608 4.488 4.663 0.003 19 0 "[ . 1 . 2]" 1
179 1 11 ARG HA 1 12 VAL MG2 . . 3.960 3.867 3.725 3.961 0.001 17 0 "[ . 1 . 2]" 1
180 1 11 ARG HA 1 88 TYR HB2 . . 5.340 4.210 3.997 4.423 . 0 0 "[ . 1 . 2]" 1
181 1 11 ARG HA 1 88 TYR QD . . 4.490 3.779 3.367 4.260 . 0 0 "[ . 1 . 2]" 1
182 1 11 ARG HA 1 89 ILE H . . 4.910 4.347 4.074 4.688 . 0 0 "[ . 1 . 2]" 1
183 1 11 ARG HA 1 90 ASP HA . . 3.050 2.562 2.211 2.986 . 0 0 "[ . 1 . 2]" 1
184 1 11 ARG HA 1 90 ASP QB . . 5.340 4.262 3.979 4.678 . 0 0 "[ . 1 . 2]" 1
185 1 11 ARG QB 1 11 ARG QD . . 2.990 2.241 2.042 2.421 . 0 0 "[ . 1 . 2]" 1
186 1 11 ARG QB 1 11 ARG HE . . 4.040 3.075 2.180 3.858 . 0 0 "[ . 1 . 2]" 1
187 1 11 ARG QB 1 88 TYR HB2 . . 5.340 4.635 4.492 4.907 . 0 0 "[ . 1 . 2]" 1
188 1 11 ARG QB 1 88 TYR QD . . 5.340 4.400 4.012 4.780 . 0 0 "[ . 1 . 2]" 1
189 1 11 ARG QB 1 90 ASP HA . . 5.310 4.150 3.774 4.475 . 0 0 "[ . 1 . 2]" 1
190 1 11 ARG HB2 1 11 ARG HD2 . . 4.210 2.961 2.532 3.564 . 0 0 "[ . 1 . 2]" 1
191 1 11 ARG HB2 1 11 ARG HD3 . . 4.210 3.182 2.103 4.202 . 0 0 "[ . 1 . 2]" 1
192 1 11 ARG HB2 1 11 ARG HE . . 4.640 3.372 2.196 4.442 . 0 0 "[ . 1 . 2]" 1
193 1 11 ARG HB2 1 12 VAL H . . 4.480 4.416 4.296 4.490 0.010 20 0 "[ . 1 . 2]" 1
194 1 11 ARG HB3 1 11 ARG HD2 . . 4.210 2.999 2.330 3.924 . 0 0 "[ . 1 . 2]" 1
195 1 11 ARG HB3 1 11 ARG HD3 . . 4.210 3.416 2.545 3.895 . 0 0 "[ . 1 . 2]" 1
196 1 11 ARG HB3 1 11 ARG HE . . 4.640 3.957 3.009 4.307 . 0 0 "[ . 1 . 2]" 1
197 1 11 ARG HB3 1 12 VAL H . . 4.480 4.366 4.176 4.484 0.004 19 0 "[ . 1 . 2]" 1
198 1 11 ARG QD 1 88 TYR HB3 . . 4.430 3.990 2.512 4.429 . 0 0 "[ . 1 . 2]" 1
199 1 11 ARG QD 1 88 TYR QD . . 3.500 3.242 2.848 3.497 . 0 0 "[ . 1 . 2]" 1
200 1 11 ARG QD 1 88 TYR QE . . 4.740 3.381 2.806 4.453 . 0 0 "[ . 1 . 2]" 1
201 1 11 ARG HE 1 11 ARG QG . . 3.750 2.529 2.165 2.862 . 0 0 "[ . 1 . 2]" 1
202 1 11 ARG HE 1 88 TYR QD . . 4.170 3.863 3.283 4.171 0.001 9 0 "[ . 1 . 2]" 1
203 1 11 ARG HE 1 88 TYR QE . . 4.570 3.636 2.849 4.552 . 0 0 "[ . 1 . 2]" 1
204 1 11 ARG QG 1 12 VAL H . . 3.750 3.184 2.912 3.414 . 0 0 "[ . 1 . 2]" 1
205 1 11 ARG QG 1 13 LYS H . . 4.830 3.981 3.627 4.720 . 0 0 "[ . 1 . 2]" 1
206 1 11 ARG QG 1 13 LYS HA . . 4.530 4.118 3.956 4.536 0.006 12 0 "[ . 1 . 2]" 1
207 1 11 ARG QG 1 88 TYR HA . . 5.500 4.731 4.567 5.037 . 0 0 "[ . 1 . 2]" 1
208 1 11 ARG QG 1 88 TYR HB2 . . 3.160 2.585 2.421 2.885 . 0 0 "[ . 1 . 2]" 1
209 1 11 ARG QG 1 88 TYR HB3 . . 3.870 3.395 3.231 3.674 . 0 0 "[ . 1 . 2]" 1
210 1 11 ARG QG 1 88 TYR QD . . 3.210 2.608 1.982 3.037 . 0 0 "[ . 1 . 2]" 1
211 1 11 ARG QG 1 88 TYR QE . . 4.120 3.539 3.098 4.028 . 0 0 "[ . 1 . 2]" 1
212 1 11 ARG QG 1 89 ILE H . . 4.450 3.857 3.490 4.298 . 0 0 "[ . 1 . 2]" 1
213 1 11 ARG QG 1 90 ASP HA . . 4.850 4.039 3.592 4.645 . 0 0 "[ . 1 . 2]" 1
214 1 12 VAL H 1 12 VAL HB . . 2.980 2.499 2.445 2.567 . 0 0 "[ . 1 . 2]" 1
215 1 12 VAL H 1 12 VAL MG1 . . 3.830 3.784 3.740 3.813 . 0 0 "[ . 1 . 2]" 1
216 1 12 VAL H 1 12 VAL MG2 . . 3.090 2.607 2.431 2.876 . 0 0 "[ . 1 . 2]" 1
217 1 12 VAL H 1 13 LYS H . . 4.360 4.241 4.040 4.359 . 0 0 "[ . 1 . 2]" 1
218 1 12 VAL H 1 88 TYR QD . . 4.250 3.882 3.252 4.251 0.001 20 0 "[ . 1 . 2]" 1
219 1 12 VAL H 1 89 ILE H . . 3.350 2.935 2.534 3.281 . 0 0 "[ . 1 . 2]" 1
220 1 12 VAL H 1 89 ILE MG . . 4.940 4.617 4.453 4.889 . 0 0 "[ . 1 . 2]" 1
221 1 12 VAL H 1 90 ASP HA . . 3.920 3.416 3.182 3.713 . 0 0 "[ . 1 . 2]" 1
222 1 12 VAL H 1 91 PHE QD . . 3.700 3.317 2.939 3.659 . 0 0 "[ . 1 . 2]" 1
223 1 12 VAL HA 1 12 VAL MG1 . . 3.120 2.428 2.366 2.502 . 0 0 "[ . 1 . 2]" 1
224 1 12 VAL HA 1 12 VAL MG2 . . 2.930 2.344 2.211 2.415 . 0 0 "[ . 1 . 2]" 1
225 1 12 VAL HA 1 13 LYS H . . 2.520 2.160 2.140 2.202 . 0 0 "[ . 1 . 2]" 1
226 1 12 VAL HA 1 13 LYS QB . . 4.120 4.089 4.047 4.125 0.005 6 0 "[ . 1 . 2]" 1
227 1 12 VAL HA 1 48 CYS QB . . 3.930 3.492 2.670 3.837 . 0 0 "[ . 1 . 2]" 1
228 1 12 VAL HB 1 19 LEU QD . . 5.050 4.376 3.786 5.045 . 0 0 "[ . 1 . 2]" 1
229 1 12 VAL HB 1 89 ILE H . . 3.530 3.210 2.865 3.516 . 0 0 "[ . 1 . 2]" 1
230 1 12 VAL HB 1 89 ILE HA . . 5.500 5.171 4.763 5.386 . 0 0 "[ . 1 . 2]" 1
231 1 12 VAL HB 1 89 ILE HB . . 3.400 2.945 2.554 3.366 . 0 0 "[ . 1 . 2]" 1
232 1 12 VAL HB 1 89 ILE MD . . 5.370 4.480 4.234 4.893 . 0 0 "[ . 1 . 2]" 1
233 1 12 VAL HB 1 89 ILE MG . . 4.250 4.073 3.824 4.243 . 0 0 "[ . 1 . 2]" 1
234 1 12 VAL HB 1 91 PHE QD . . 3.300 2.546 2.293 2.711 . 0 0 "[ . 1 . 2]" 1
235 1 12 VAL HB 1 91 PHE QE . . 3.210 2.423 2.145 2.646 . 0 0 "[ . 1 . 2]" 1
236 1 12 VAL MG1 1 13 LYS H . . 3.350 3.001 2.679 3.262 . 0 0 "[ . 1 . 2]" 1
237 1 12 VAL MG1 1 44 SER QB . . 2.950 2.169 1.889 2.656 . 0 0 "[ . 1 . 2]" 1
238 1 12 VAL MG1 1 44 SER HG . . 3.910 3.108 1.974 3.836 . 0 0 "[ . 1 . 2]" 1
239 1 12 VAL MG1 1 45 ALA H . . 3.910 3.326 2.776 3.679 . 0 0 "[ . 1 . 2]" 1
240 1 12 VAL MG1 1 45 ALA HA . . 2.980 2.431 2.071 2.865 . 0 0 "[ . 1 . 2]" 1
241 1 12 VAL MG1 1 48 CYS H . . 4.400 4.036 3.605 4.396 . 0 0 "[ . 1 . 2]" 1
242 1 12 VAL MG1 1 48 CYS HB2 . . 4.430 3.160 2.461 4.368 . 0 0 "[ . 1 . 2]" 1
243 1 12 VAL MG1 1 48 CYS QB . . 3.870 2.913 2.302 3.409 . 0 0 "[ . 1 . 2]" 1
244 1 12 VAL MG1 1 48 CYS HB3 . . 4.430 3.778 2.770 4.432 0.002 20 0 "[ . 1 . 2]" 1
245 1 12 VAL MG1 1 89 ILE MG . . 4.830 4.689 4.468 4.819 . 0 0 "[ . 1 . 2]" 1
246 1 12 VAL MG1 1 91 PHE QE . . 4.030 2.947 2.616 3.161 . 0 0 "[ . 1 . 2]" 1
247 1 12 VAL MG2 1 13 LYS H . . 4.190 4.111 3.999 4.191 0.001 15 0 "[ . 1 . 2]" 1
248 1 12 VAL MG2 1 45 ALA HA . . 4.460 2.829 2.249 3.202 . 0 0 "[ . 1 . 2]" 1
249 1 12 VAL MG2 1 48 CYS HB2 . . 4.110 3.386 2.568 4.105 . 0 0 "[ . 1 . 2]" 1
250 1 12 VAL MG2 1 48 CYS QB . . 3.550 3.042 2.397 3.530 . 0 0 "[ . 1 . 2]" 1
251 1 12 VAL MG2 1 48 CYS HB3 . . 4.110 3.497 2.659 4.012 . 0 0 "[ . 1 . 2]" 1
252 1 12 VAL MG2 1 51 LEU QD . . 2.800 1.964 1.810 2.119 . 0 0 "[ . 1 . 2]" 1
253 1 12 VAL MG2 1 51 LEU HG . . 3.770 3.381 3.005 3.749 . 0 0 "[ . 1 . 2]" 1
254 1 12 VAL MG2 1 89 ILE MG . . 4.990 4.469 4.172 4.714 . 0 0 "[ . 1 . 2]" 1
255 1 12 VAL MG2 1 90 ASP HA . . 5.500 4.645 4.370 4.955 . 0 0 "[ . 1 . 2]" 1
256 1 12 VAL MG2 1 91 PHE H . . 4.390 3.920 3.465 4.392 0.002 15 0 "[ . 1 . 2]" 1
257 1 12 VAL MG2 1 91 PHE QD . . 2.540 1.956 1.827 2.121 . 0 0 "[ . 1 . 2]" 1
258 1 12 VAL MG2 1 91 PHE QE . . 3.290 2.934 2.584 3.223 . 0 0 "[ . 1 . 2]" 1
259 1 12 VAL MG2 1 91 PHE HZ . . 5.210 4.790 4.443 5.067 . 0 0 "[ . 1 . 2]" 1
260 1 13 LYS H 1 13 LYS QB . . 2.660 2.199 2.166 2.225 . 0 0 "[ . 1 . 2]" 1
261 1 13 LYS H 1 13 LYS HG2 . . 4.620 4.355 4.220 4.596 . 0 0 "[ . 1 . 2]" 1
262 1 13 LYS H 1 13 LYS QG . . 4.010 3.901 3.849 3.940 . 0 0 "[ . 1 . 2]" 1
263 1 13 LYS H 1 13 LYS HG3 . . 4.620 4.431 4.232 4.570 . 0 0 "[ . 1 . 2]" 1
264 1 13 LYS H 1 48 CYS QB . . 4.530 4.146 2.620 4.531 0.001 10 0 "[ . 1 . 2]" 1
265 1 13 LYS HA 1 13 LYS QD . . 3.400 2.779 2.025 3.213 . 0 0 "[ . 1 . 2]" 1
266 1 13 LYS HA 1 13 LYS HG2 . . 3.810 2.735 2.185 3.876 0.066 3 0 "[ . 1 . 2]" 1
267 1 13 LYS HA 1 13 LYS HG3 . . 3.810 3.450 3.156 3.637 . 0 0 "[ . 1 . 2]" 1
268 1 13 LYS HA 1 14 LYS H . . 2.540 2.232 2.162 2.330 . 0 0 "[ . 1 . 2]" 1
269 1 13 LYS HA 1 14 LYS QG . . 4.850 3.486 3.355 3.696 . 0 0 "[ . 1 . 2]" 1
270 1 13 LYS HA 1 88 TYR HA . . 2.920 2.457 2.083 2.737 . 0 0 "[ . 1 . 2]" 1
271 1 13 LYS HA 1 88 TYR HB2 . . 3.470 2.609 2.239 2.915 . 0 0 "[ . 1 . 2]" 1
272 1 13 LYS HA 1 88 TYR HB3 . . 3.340 2.216 2.004 2.346 . 0 0 "[ . 1 . 2]" 1
273 1 13 LYS HA 1 88 TYR QD . . 4.250 4.185 4.009 4.259 0.009 20 0 "[ . 1 . 2]" 1
274 1 13 LYS HA 1 89 ILE H . . 4.320 3.766 3.488 3.960 . 0 0 "[ . 1 . 2]" 1
275 1 13 LYS QB 1 13 LYS QE . . 3.890 3.146 2.223 3.768 . 0 0 "[ . 1 . 2]" 1
276 1 13 LYS QB 1 14 LYS H . . 3.670 3.491 3.252 3.680 0.010 5 0 "[ . 1 . 2]" 1
277 1 13 LYS QB 1 15 SER QB . . 4.210 3.382 2.857 4.161 . 0 0 "[ . 1 . 2]" 1
278 1 13 LYS QB 1 88 TYR HA . . 4.690 4.567 4.288 4.718 0.028 20 0 "[ . 1 . 2]" 1
279 1 13 LYS QB 1 88 TYR HB2 . . 5.500 4.103 3.783 4.357 . 0 0 "[ . 1 . 2]" 1
280 1 13 LYS QB 1 88 TYR QD . . 5.260 4.941 4.604 5.233 . 0 0 "[ . 1 . 2]" 1
281 1 13 LYS QD 1 13 LYS QG . . 2.390 2.049 2.027 2.078 . 0 0 "[ . 1 . 2]" 1
282 1 13 LYS QD 1 14 LYS H . . 2.850 2.007 1.860 2.316 . 0 0 "[ . 1 . 2]" 1
283 1 13 LYS QD 1 14 LYS HA . . 4.430 3.909 3.637 4.445 0.015 12 0 "[ . 1 . 2]" 1
284 1 13 LYS QD 1 14 LYS QB . . 3.550 3.160 2.813 3.433 . 0 0 "[ . 1 . 2]" 1
285 1 13 LYS QD 1 14 LYS QE . . 5.340 5.075 4.733 5.355 0.015 13 0 "[ . 1 . 2]" 1
286 1 13 LYS QD 1 14 LYS QG . . 3.980 3.409 3.039 3.929 . 0 0 "[ . 1 . 2]" 1
287 1 13 LYS QD 1 15 SER QB . . 5.120 3.758 2.482 4.931 . 0 0 "[ . 1 . 2]" 1
288 1 13 LYS QD 1 81 PHE QE . . 5.500 5.484 5.423 5.510 0.010 5 0 "[ . 1 . 2]" 1
289 1 13 LYS QD 1 88 TYR HA . . 4.420 4.032 3.348 4.423 0.003 18 0 "[ . 1 . 2]" 1
290 1 13 LYS QD 1 88 TYR HB2 . . 5.500 4.842 3.867 5.428 . 0 0 "[ . 1 . 2]" 1
291 1 13 LYS QD 1 88 TYR HB3 . . 4.300 3.723 2.634 4.302 0.002 11 0 "[ . 1 . 2]" 1
292 1 13 LYS QD 1 88 TYR QD . . 5.500 4.805 3.765 5.453 . 0 0 "[ . 1 . 2]" 1
293 1 13 LYS QE 1 13 LYS QG . . 3.420 2.225 2.060 2.454 . 0 0 "[ . 1 . 2]" 1
294 1 13 LYS QE 1 14 LYS H . . 5.230 3.992 3.660 4.458 . 0 0 "[ . 1 . 2]" 1
295 1 13 LYS QE 1 14 LYS QB . . 5.500 4.481 3.657 5.351 . 0 0 "[ . 1 . 2]" 1
296 1 13 LYS QG 1 14 LYS H . . 3.610 2.803 2.472 3.270 . 0 0 "[ . 1 . 2]" 1
297 1 13 LYS QG 1 88 TYR HB3 . . 4.970 3.211 2.430 4.746 . 0 0 "[ . 1 . 2]" 1
298 1 14 LYS H 1 14 LYS QB . . 3.890 2.608 2.467 2.744 . 0 0 "[ . 1 . 2]" 1
299 1 14 LYS H 1 14 LYS QE . . 4.720 4.085 3.728 4.386 . 0 0 "[ . 1 . 2]" 1
300 1 14 LYS H 1 14 LYS HG2 . . 3.370 2.861 1.908 3.285 . 0 0 "[ . 1 . 2]" 1
301 1 14 LYS H 1 14 LYS HG3 . . 3.370 2.189 1.913 3.234 . 0 0 "[ . 1 . 2]" 1
302 1 14 LYS H 1 15 SER H . . 4.440 3.694 3.380 4.092 . 0 0 "[ . 1 . 2]" 1
303 1 14 LYS H 1 88 TYR H . . 5.130 4.567 4.348 4.912 . 0 0 "[ . 1 . 2]" 1
304 1 14 LYS H 1 88 TYR HA . . 3.280 2.652 2.338 2.988 . 0 0 "[ . 1 . 2]" 1
305 1 14 LYS H 1 88 TYR HB2 . . 4.890 4.297 3.927 4.685 . 0 0 "[ . 1 . 2]" 1
306 1 14 LYS H 1 88 TYR HB3 . . 3.890 3.546 3.346 3.800 . 0 0 "[ . 1 . 2]" 1
307 1 14 LYS HA 1 14 LYS HG2 . . 3.900 2.681 2.466 2.962 . 0 0 "[ . 1 . 2]" 1
308 1 14 LYS HA 1 14 LYS QG . . 3.340 2.591 2.407 2.876 . 0 0 "[ . 1 . 2]" 1
309 1 14 LYS HA 1 14 LYS HG3 . . 3.900 3.443 3.214 3.902 0.002 11 0 "[ . 1 . 2]" 1
310 1 14 LYS HA 1 15 SER H . . 3.120 2.511 2.281 2.698 . 0 0 "[ . 1 . 2]" 1
311 1 14 LYS HA 1 16 ALA H . . 4.040 3.722 3.044 4.041 0.001 17 0 "[ . 1 . 2]" 1
312 1 14 LYS HA 1 81 PHE QE . . 4.620 2.144 1.997 2.428 . 0 0 "[ . 1 . 2]" 1
313 1 14 LYS QB 1 14 LYS HE2 . . 4.640 3.996 3.656 4.384 . 0 0 "[ . 1 . 2]" 1
314 1 14 LYS QB 1 14 LYS QE . . 3.760 3.477 3.019 3.743 . 0 0 "[ . 1 . 2]" 1
315 1 14 LYS QB 1 14 LYS HE3 . . 4.640 3.876 3.172 4.249 . 0 0 "[ . 1 . 2]" 1
316 1 14 LYS QB 1 81 PHE HA . . 5.170 4.846 4.325 5.113 . 0 0 "[ . 1 . 2]" 1
317 1 14 LYS QB 1 81 PHE QE . . 4.600 2.521 2.022 3.152 . 0 0 "[ . 1 . 2]" 1
318 1 14 LYS QB 1 81 PHE HZ . . 4.990 2.847 2.349 3.685 . 0 0 "[ . 1 . 2]" 1
319 1 14 LYS QB 1 87 ASP HB2 . . 5.500 4.754 3.425 5.503 0.003 14 0 "[ . 1 . 2]" 1
320 1 14 LYS QB 1 87 ASP QB . . 4.690 3.953 3.331 4.482 . 0 0 "[ . 1 . 2]" 1
321 1 14 LYS QB 1 87 ASP HB3 . . 5.500 4.591 3.792 5.478 . 0 0 "[ . 1 . 2]" 1
322 1 14 LYS QB 1 88 TYR HA . . 4.590 4.213 3.815 4.538 . 0 0 "[ . 1 . 2]" 1
323 1 14 LYS QE 1 14 LYS QG . . 2.920 2.178 2.022 2.448 . 0 0 "[ . 1 . 2]" 1
324 1 14 LYS QE 1 81 PHE HA . . 3.000 2.351 1.989 2.996 . 0 0 "[ . 1 . 2]" 1
325 1 14 LYS QE 1 81 PHE QD . . 4.070 3.172 2.195 4.031 . 0 0 "[ . 1 . 2]" 1
326 1 14 LYS QE 1 81 PHE QE . . 5.340 4.142 3.362 4.682 . 0 0 "[ . 1 . 2]" 1
327 1 14 LYS QE 1 88 TYR H . . 4.010 2.364 1.919 2.727 . 0 0 "[ . 1 . 2]" 1
328 1 14 LYS QE 1 88 TYR HA . . 4.150 3.168 2.137 3.626 . 0 0 "[ . 1 . 2]" 1
329 1 14 LYS QE 1 89 ILE HA . . 5.340 4.838 3.849 5.331 . 0 0 "[ . 1 . 2]" 1
330 1 14 LYS QE 1 89 ILE MD . . 4.440 3.481 2.231 4.437 . 0 0 "[ . 1 . 2]" 1
331 1 14 LYS QE 1 89 ILE HG13 . . 4.100 3.133 1.795 4.034 . 0 0 "[ . 1 . 2]" 1
332 1 14 LYS HE2 1 88 TYR H . . 4.840 3.459 2.185 4.262 . 0 0 "[ . 1 . 2]" 1
333 1 14 LYS HE2 1 89 ILE HG12 . . 5.100 3.970 2.417 5.096 . 0 0 "[ . 1 . 2]" 1
334 1 14 LYS HE2 1 89 ILE HG13 . . 4.750 3.416 1.995 4.468 . 0 0 "[ . 1 . 2]" 1
335 1 14 LYS HE3 1 88 TYR H . . 4.840 2.695 1.955 3.909 . 0 0 "[ . 1 . 2]" 1
336 1 14 LYS HE3 1 89 ILE HG12 . . 5.100 4.521 2.937 5.083 . 0 0 "[ . 1 . 2]" 1
337 1 14 LYS HE3 1 89 ILE HG13 . . 4.750 3.843 2.036 4.596 . 0 0 "[ . 1 . 2]" 1
338 1 14 LYS QG 1 81 PHE QD . . 4.110 2.831 2.385 4.152 0.042 11 0 "[ . 1 . 2]" 1
339 1 14 LYS QG 1 81 PHE QE . . 4.240 2.340 1.987 3.860 . 0 0 "[ . 1 . 2]" 1
340 1 14 LYS QG 1 81 PHE HZ . . 5.340 4.191 3.682 5.369 0.029 11 0 "[ . 1 . 2]" 1
341 1 14 LYS QG 1 88 TYR H . . 4.970 3.253 2.882 3.547 . 0 0 "[ . 1 . 2]" 1
342 1 14 LYS QG 1 88 TYR HB3 . . 5.310 3.955 3.635 4.310 . 0 0 "[ . 1 . 2]" 1
343 1 14 LYS HG2 1 88 TYR HA . . 3.960 2.879 2.207 3.301 . 0 0 "[ . 1 . 2]" 1
344 1 14 LYS HG3 1 88 TYR HA . . 3.960 2.528 1.998 3.818 . 0 0 "[ . 1 . 2]" 1
345 1 15 SER H 1 15 SER HB2 . . 3.950 2.532 2.212 3.585 . 0 0 "[ . 1 . 2]" 1
346 1 15 SER H 1 15 SER QB . . 3.250 2.302 2.149 2.651 . 0 0 "[ . 1 . 2]" 1
347 1 15 SER H 1 15 SER HB3 . . 3.950 2.852 2.404 3.616 . 0 0 "[ . 1 . 2]" 1
348 1 15 SER H 1 44 SER HA . . 4.890 3.835 3.061 4.494 . 0 0 "[ . 1 . 2]" 1
349 1 15 SER H 1 44 SER QB . . 4.320 2.958 1.942 3.379 . 0 0 "[ . 1 . 2]" 1
350 1 15 SER QB 1 16 ALA H . . 3.880 2.543 2.207 3.694 . 0 0 "[ . 1 . 2]" 1
351 1 15 SER QB 1 47 ASN QD . . 3.910 2.767 2.186 3.757 . 0 0 "[ . 1 . 2]" 1
352 1 16 ALA H 1 16 ALA MB . . 2.890 2.150 2.042 2.303 . 0 0 "[ . 1 . 2]" 1
353 1 16 ALA H 1 44 SER H . . 4.640 4.171 3.676 4.635 . 0 0 "[ . 1 . 2]" 1
354 1 16 ALA H 1 44 SER HA . . 3.640 2.841 2.401 3.579 . 0 0 "[ . 1 . 2]" 1
355 1 16 ALA H 1 44 SER QB . . 3.990 2.895 2.450 3.757 . 0 0 "[ . 1 . 2]" 1
356 1 16 ALA H 1 81 PHE QE . . 5.460 4.783 4.140 5.175 . 0 0 "[ . 1 . 2]" 1
357 1 16 ALA H 1 81 PHE HZ . . 5.500 4.241 3.250 5.175 . 0 0 "[ . 1 . 2]" 1
358 1 16 ALA MB 1 17 ALA H . . 4.080 2.409 1.960 3.100 . 0 0 "[ . 1 . 2]" 1
359 1 16 ALA MB 1 18 THR H . . 2.930 2.534 2.206 2.865 . 0 0 "[ . 1 . 2]" 1
360 1 16 ALA MB 1 19 LEU HA . . 5.500 3.847 3.409 4.295 . 0 0 "[ . 1 . 2]" 1
361 1 16 ALA MB 1 42 GLY HA2 . . 5.500 4.090 3.298 4.613 . 0 0 "[ . 1 . 2]" 1
362 1 16 ALA MB 1 42 GLY QA . . 4.730 3.821 3.110 4.342 . 0 0 "[ . 1 . 2]" 1
363 1 16 ALA MB 1 42 GLY HA3 . . 5.500 4.605 3.809 5.293 . 0 0 "[ . 1 . 2]" 1
364 1 16 ALA MB 1 43 GLY H . . 5.310 3.929 3.287 4.322 . 0 0 "[ . 1 . 2]" 1
365 1 16 ALA MB 1 43 GLY HA2 . . 3.290 2.604 2.015 2.934 . 0 0 "[ . 1 . 2]" 1
366 1 16 ALA MB 1 43 GLY HA3 . . 4.250 3.838 3.247 4.209 . 0 0 "[ . 1 . 2]" 1
367 1 16 ALA MB 1 44 SER H . . 3.020 2.436 1.983 2.854 . 0 0 "[ . 1 . 2]" 1
368 1 16 ALA MB 1 44 SER HA . . 3.290 2.460 1.980 3.159 . 0 0 "[ . 1 . 2]" 1
369 1 16 ALA MB 1 44 SER QB . . 3.750 2.751 1.980 3.701 . 0 0 "[ . 1 . 2]" 1
370 1 16 ALA MB 1 44 SER HG . . 4.870 3.841 2.764 4.647 . 0 0 "[ . 1 . 2]" 1
371 1 16 ALA MB 1 47 ASN QD . . 3.330 2.604 1.862 3.319 . 0 0 "[ . 1 . 2]" 1
372 1 16 ALA MB 1 81 PHE HZ . . 5.500 3.778 2.921 4.415 . 0 0 "[ . 1 . 2]" 1
373 1 17 ALA H 1 18 THR H . . 3.850 2.522 2.165 2.979 . 0 0 "[ . 1 . 2]" 1
374 1 17 ALA HA 1 18 THR H . . 3.570 3.498 3.401 3.564 . 0 0 "[ . 1 . 2]" 1
375 1 17 ALA HA 1 18 THR MG . . 5.100 4.435 3.915 4.997 . 0 0 "[ . 1 . 2]" 1
376 1 17 ALA HA 1 81 PHE QE . . 5.480 4.585 3.797 5.320 . 0 0 "[ . 1 . 2]" 1
377 1 17 ALA HA 1 81 PHE HZ . . 4.950 4.645 3.672 4.954 0.004 9 0 "[ . 1 . 2]" 1
378 1 17 ALA MB 1 18 THR H . . 3.640 2.752 2.470 3.035 . 0 0 "[ . 1 . 2]" 1
379 1 17 ALA MB 1 18 THR HA . . 4.370 4.227 4.056 4.332 . 0 0 "[ . 1 . 2]" 1
380 1 17 ALA MB 1 18 THR HB . . 5.460 4.284 3.431 4.994 . 0 0 "[ . 1 . 2]" 1
381 1 17 ALA MB 1 18 THR MG . . 3.270 2.824 2.411 3.262 . 0 0 "[ . 1 . 2]" 1
382 1 18 THR H 1 18 THR HB . . 3.910 3.656 3.323 3.929 0.019 13 0 "[ . 1 . 2]" 1
383 1 18 THR H 1 18 THR MG . . 3.280 2.782 2.169 3.252 . 0 0 "[ . 1 . 2]" 1
384 1 18 THR H 1 44 SER H . . 5.240 4.841 4.461 5.107 . 0 0 "[ . 1 . 2]" 1
385 1 18 THR HA 1 18 THR HB . . 2.850 2.477 2.341 2.544 . 0 0 "[ . 1 . 2]" 1
386 1 18 THR HA 1 18 THR MG . . 3.210 2.701 2.139 3.205 . 0 0 "[ . 1 . 2]" 1
387 1 18 THR HA 1 81 PHE QE . . 3.300 2.156 1.998 2.665 . 0 0 "[ . 1 . 2]" 1
388 1 18 THR HA 1 81 PHE HZ . . 4.630 3.679 2.644 4.247 . 0 0 "[ . 1 . 2]" 1
389 1 18 THR HB 1 19 LEU H . . 5.270 3.473 2.276 4.228 . 0 0 "[ . 1 . 2]" 1
390 1 18 THR HB 1 81 PHE QE . . 5.500 4.346 3.454 5.063 . 0 0 "[ . 1 . 2]" 1
391 1 18 THR MG 1 19 LEU H . . 5.040 3.791 3.395 4.163 . 0 0 "[ . 1 . 2]" 1
392 1 18 THR MG 1 81 PHE QE . . 4.980 4.160 3.563 4.793 . 0 0 "[ . 1 . 2]" 1
393 1 18 THR MG 1 81 PHE HZ . . 5.500 5.385 5.052 5.502 0.002 5 0 "[ . 1 . 2]" 1
394 1 19 LEU H 1 19 LEU QD . . 4.910 3.699 3.588 3.790 . 0 0 "[ . 1 . 2]" 1
395 1 19 LEU HA 1 19 LEU MD1 . . 4.010 2.403 1.954 3.774 . 0 0 "[ . 1 . 2]" 1
396 1 19 LEU HA 1 19 LEU QD . . 2.620 2.328 1.946 2.624 0.004 5 0 "[ . 1 . 2]" 1
397 1 19 LEU HA 1 19 LEU MD2 . . 4.010 3.866 2.676 4.013 0.003 20 0 "[ . 1 . 2]" 1
398 1 19 LEU HA 1 19 LEU HG . . 3.640 3.017 2.455 3.456 . 0 0 "[ . 1 . 2]" 1
399 1 19 LEU HA 1 21 ILE MG . . 4.630 4.420 4.128 4.625 . 0 0 "[ . 1 . 2]" 1
400 1 19 LEU HA 1 44 SER H . . 3.220 2.503 2.024 2.832 . 0 0 "[ . 1 . 2]" 1
401 1 19 LEU HA 1 44 SER QB . . 4.100 3.712 3.441 4.028 . 0 0 "[ . 1 . 2]" 1
402 1 19 LEU HA 1 44 SER HG . . 4.260 2.998 2.000 4.147 . 0 0 "[ . 1 . 2]" 1
403 1 19 LEU HA 1 45 ALA H . . 4.370 4.050 3.636 4.358 . 0 0 "[ . 1 . 2]" 1
404 1 19 LEU HA 1 81 PHE QD . . 5.500 5.062 4.662 5.397 . 0 0 "[ . 1 . 2]" 1
405 1 19 LEU QB 1 19 LEU QD . . 2.460 1.870 1.801 1.968 . 0 0 "[ . 1 . 2]" 1
406 1 19 LEU QB 1 77 ILE MG . . 4.690 4.067 3.857 4.286 . 0 0 "[ . 1 . 2]" 1
407 1 19 LEU QB 1 81 PHE HB2 . . 4.590 3.450 3.225 3.743 . 0 0 "[ . 1 . 2]" 1
408 1 19 LEU QB 1 81 PHE HB3 . . 5.010 4.016 3.639 4.231 . 0 0 "[ . 1 . 2]" 1
409 1 19 LEU HB2 1 81 PHE HB2 . . 5.240 3.767 3.445 4.323 . 0 0 "[ . 1 . 2]" 1
410 1 19 LEU HB2 1 81 PHE QD . . 4.910 3.390 2.982 3.835 . 0 0 "[ . 1 . 2]" 1
411 1 19 LEU HB3 1 81 PHE HB2 . . 5.240 4.134 3.589 4.766 . 0 0 "[ . 1 . 2]" 1
412 1 19 LEU HB3 1 81 PHE QD . . 4.910 4.036 3.604 4.537 . 0 0 "[ . 1 . 2]" 1
413 1 19 LEU QD 1 21 ILE H . . 4.370 3.730 2.519 4.286 . 0 0 "[ . 1 . 2]" 1
414 1 19 LEU QD 1 21 ILE QG . . 3.390 2.289 1.849 3.132 . 0 0 "[ . 1 . 2]" 1
415 1 19 LEU QD 1 21 ILE MG . . 3.640 2.312 1.757 2.870 . 0 0 "[ . 1 . 2]" 1
416 1 19 LEU QD 1 44 SER H . . 3.830 3.099 2.535 3.822 . 0 0 "[ . 1 . 2]" 1
417 1 19 LEU QD 1 44 SER QB . . 4.050 3.178 1.989 4.033 . 0 0 "[ . 1 . 2]" 1
418 1 19 LEU QD 1 45 ALA H . . 3.420 2.731 2.128 3.339 . 0 0 "[ . 1 . 2]" 1
419 1 19 LEU QD 1 45 ALA MB . . 3.430 2.813 2.413 3.412 . 0 0 "[ . 1 . 2]" 1
420 1 19 LEU QD 1 77 ILE HB . . 4.060 3.565 3.135 4.034 . 0 0 "[ . 1 . 2]" 1
421 1 19 LEU QD 1 78 ALA HA . . 4.060 3.171 2.713 3.780 . 0 0 "[ . 1 . 2]" 1
422 1 19 LEU QD 1 81 PHE H . . 5.000 4.506 4.079 4.728 . 0 0 "[ . 1 . 2]" 1
423 1 19 LEU QD 1 81 PHE HA . . 5.440 4.754 4.263 5.043 . 0 0 "[ . 1 . 2]" 1
424 1 19 LEU QD 1 81 PHE HB2 . . 3.610 3.012 2.479 3.278 . 0 0 "[ . 1 . 2]" 1
425 1 19 LEU QD 1 81 PHE HB3 . . 4.180 4.056 3.629 4.182 0.002 12 0 "[ . 1 . 2]" 1
426 1 19 LEU QD 1 81 PHE QD . . 4.220 3.372 3.061 3.702 . 0 0 "[ . 1 . 2]" 1
427 1 19 LEU QD 1 81 PHE HZ . . 5.440 4.625 4.197 5.132 . 0 0 "[ . 1 . 2]" 1
428 1 19 LEU QD 1 91 PHE QE . . 4.230 2.952 2.462 3.348 . 0 0 "[ . 1 . 2]" 1
429 1 19 LEU QD 1 91 PHE HZ . . 3.460 2.355 1.886 2.800 . 0 0 "[ . 1 . 2]" 1
430 1 19 LEU MD1 1 21 ILE H . . 5.230 4.475 3.745 5.044 . 0 0 "[ . 1 . 2]" 1
431 1 19 LEU MD1 1 21 ILE HB . . 5.500 4.725 4.050 5.439 . 0 0 "[ . 1 . 2]" 1
432 1 19 LEU MD1 1 21 ILE MD . . 3.540 2.837 2.045 3.522 . 0 0 "[ . 1 . 2]" 1
433 1 19 LEU MD1 1 21 ILE HG12 . . 5.160 3.085 2.080 5.162 0.002 9 0 "[ . 1 . 2]" 1
434 1 19 LEU MD1 1 21 ILE HG13 . . 5.160 4.392 3.697 5.046 . 0 0 "[ . 1 . 2]" 1
435 1 19 LEU MD1 1 44 SER QB . . 5.500 3.229 1.993 4.482 . 0 0 "[ . 1 . 2]" 1
436 1 19 LEU MD1 1 81 PHE HB2 . . 5.100 4.371 2.485 5.102 0.002 6 0 "[ . 1 . 2]" 1
437 1 19 LEU MD1 1 81 PHE QD . . 5.200 3.827 3.164 4.471 . 0 0 "[ . 1 . 2]" 1
438 1 19 LEU MD1 1 91 PHE HZ . . 4.450 2.959 2.395 3.515 . 0 0 "[ . 1 . 2]" 1
439 1 19 LEU MD2 1 21 ILE H . . 5.230 4.061 2.530 4.814 . 0 0 "[ . 1 . 2]" 1
440 1 19 LEU MD2 1 21 ILE HB . . 5.500 4.817 3.799 5.285 . 0 0 "[ . 1 . 2]" 1
441 1 19 LEU MD2 1 21 ILE MD . . 3.540 2.280 1.934 2.781 . 0 0 "[ . 1 . 2]" 1
442 1 19 LEU MD2 1 21 ILE HG12 . . 5.160 2.531 1.871 4.343 . 0 0 "[ . 1 . 2]" 1
443 1 19 LEU MD2 1 21 ILE HG13 . . 5.160 3.429 3.061 3.962 . 0 0 "[ . 1 . 2]" 1
444 1 19 LEU MD2 1 44 SER QB . . 5.500 5.148 4.075 5.500 0.000 4 0 "[ . 1 . 2]" 1
445 1 19 LEU MD2 1 81 PHE HB2 . . 5.100 3.207 2.675 5.098 . 0 0 "[ . 1 . 2]" 1
446 1 19 LEU MD2 1 81 PHE QD . . 5.200 3.887 3.249 5.079 . 0 0 "[ . 1 . 2]" 1
447 1 19 LEU MD2 1 91 PHE HZ . . 4.450 2.637 1.900 3.507 . 0 0 "[ . 1 . 2]" 1
448 1 19 LEU HG 1 21 ILE H . . 5.500 3.480 2.754 5.484 . 0 0 "[ . 1 . 2]" 1
449 1 19 LEU HG 1 21 ILE MG . . 4.680 2.913 1.990 3.704 . 0 0 "[ . 1 . 2]" 1
450 1 19 LEU HG 1 44 SER H . . 5.420 4.875 3.722 5.335 . 0 0 "[ . 1 . 2]" 1
451 1 19 LEU HG 1 77 ILE MG . . 4.390 4.076 3.731 4.373 . 0 0 "[ . 1 . 2]" 1
452 1 19 LEU HG 1 91 PHE HZ . . 5.500 4.820 4.182 5.324 . 0 0 "[ . 1 . 2]" 1
453 1 20 GLY HA2 1 21 ILE H . . 3.300 2.246 2.152 2.360 . 0 0 "[ . 1 . 2]" 1
454 1 20 GLY HA2 1 21 ILE MG . . 5.500 4.083 3.880 4.291 . 0 0 "[ . 1 . 2]" 1
455 1 20 GLY HA2 1 40 GLN H . . 4.980 4.849 4.439 4.979 . 0 0 "[ . 1 . 2]" 1
456 1 20 GLY HA2 1 40 GLN HB2 . . 3.720 3.450 2.615 3.702 . 0 0 "[ . 1 . 2]" 1
457 1 20 GLY HA2 1 43 GLY HA3 . . 5.100 4.559 3.610 5.093 . 0 0 "[ . 1 . 2]" 1
458 1 20 GLY HA3 1 40 GLN H . . 4.250 4.124 3.970 4.251 0.001 6 0 "[ . 1 . 2]" 1
459 1 20 GLY HA3 1 40 GLN HB2 . . 3.470 2.154 2.003 2.362 . 0 0 "[ . 1 . 2]" 1
460 1 20 GLY HA3 1 40 GLN HB3 . . 3.710 3.276 2.742 3.674 . 0 0 "[ . 1 . 2]" 1
461 1 20 GLY HA3 1 43 GLY HA3 . . 4.080 3.175 2.187 3.790 . 0 0 "[ . 1 . 2]" 1
462 1 21 ILE H 1 21 ILE HB . . 3.950 3.889 3.838 3.952 0.002 2 0 "[ . 1 . 2]" 1
463 1 21 ILE H 1 21 ILE HG12 . . 3.940 2.668 2.262 3.416 . 0 0 "[ . 1 . 2]" 1
464 1 21 ILE H 1 21 ILE HG13 . . 3.940 2.866 2.440 3.955 0.015 9 0 "[ . 1 . 2]" 1
465 1 21 ILE H 1 21 ILE MG . . 3.550 3.135 2.889 3.295 . 0 0 "[ . 1 . 2]" 1
466 1 21 ILE HA 1 21 ILE HG12 . . 4.250 3.789 3.693 3.874 . 0 0 "[ . 1 . 2]" 1
467 1 21 ILE HA 1 21 ILE QG . . 3.600 3.315 3.299 3.480 . 0 0 "[ . 1 . 2]" 1
468 1 21 ILE HA 1 21 ILE HG13 . . 4.250 3.674 3.586 4.254 0.004 9 0 "[ . 1 . 2]" 1
469 1 21 ILE HA 1 21 ILE MG . . 2.850 2.288 2.164 2.396 . 0 0 "[ . 1 . 2]" 1
470 1 21 ILE HA 1 22 ALA H . . 2.520 2.249 2.166 2.318 . 0 0 "[ . 1 . 2]" 1
471 1 21 ILE HA 1 22 ALA MB . . 3.900 3.826 3.778 3.876 . 0 0 "[ . 1 . 2]" 1
472 1 21 ILE HA 1 36 ILE MG . . 4.510 4.269 4.041 4.461 . 0 0 "[ . 1 . 2]" 1
473 1 21 ILE HA 1 38 THR H . . 5.500 5.350 5.130 5.489 . 0 0 "[ . 1 . 2]" 1
474 1 21 ILE HA 1 39 ILE HA . . 3.550 2.630 2.367 2.929 . 0 0 "[ . 1 . 2]" 1
475 1 21 ILE HA 1 39 ILE MG . . 5.500 3.780 3.527 4.103 . 0 0 "[ . 1 . 2]" 1
476 1 21 ILE HA 1 40 GLN H . . 3.680 2.828 2.474 3.098 . 0 0 "[ . 1 . 2]" 1
477 1 21 ILE HB 1 22 ALA H . . 3.170 2.810 2.591 3.141 . 0 0 "[ . 1 . 2]" 1
478 1 21 ILE HB 1 36 ILE MG . . 3.880 3.512 3.303 3.785 . 0 0 "[ . 1 . 2]" 1
479 1 21 ILE MD 1 57 ILE MD . . 4.500 2.770 2.496 4.104 . 0 0 "[ . 1 . 2]" 1
480 1 21 ILE MD 1 77 ILE HB . . 4.550 3.590 3.042 4.052 . 0 0 "[ . 1 . 2]" 1
481 1 21 ILE MD 1 77 ILE MD . . 2.960 2.256 1.924 2.867 . 0 0 "[ . 1 . 2]" 1
482 1 21 ILE MD 1 77 ILE MG . . 3.270 2.064 1.830 2.435 . 0 0 "[ . 1 . 2]" 1
483 1 21 ILE MD 1 91 PHE QE . . 3.710 2.959 2.681 3.709 . 0 0 "[ . 1 . 2]" 1
484 1 21 ILE MD 1 91 PHE HZ . . 3.790 2.934 2.534 3.367 . 0 0 "[ . 1 . 2]" 1
485 1 21 ILE QG 1 21 ILE MG . . 3.130 2.202 2.031 2.335 . 0 0 "[ . 1 . 2]" 1
486 1 21 ILE QG 1 22 ALA H . . 4.900 3.915 3.607 4.097 . 0 0 "[ . 1 . 2]" 1
487 1 21 ILE QG 1 77 ILE MG . . 5.130 3.375 2.954 3.774 . 0 0 "[ . 1 . 2]" 1
488 1 21 ILE MG 1 22 ALA H . . 4.050 3.763 3.593 4.052 0.002 9 0 "[ . 1 . 2]" 1
489 1 21 ILE MG 1 39 ILE HA . . 4.050 3.267 2.869 3.635 . 0 0 "[ . 1 . 2]" 1
490 1 21 ILE MG 1 40 GLN H . . 4.260 3.838 3.539 4.126 . 0 0 "[ . 1 . 2]" 1
491 1 21 ILE MG 1 45 ALA H . . 5.010 3.484 3.093 3.767 . 0 0 "[ . 1 . 2]" 1
492 1 21 ILE MG 1 45 ALA MB . . 2.450 1.982 1.775 2.234 . 0 0 "[ . 1 . 2]" 1
493 1 21 ILE MG 1 91 PHE QE . . 5.460 4.401 4.013 4.874 . 0 0 "[ . 1 . 2]" 1
494 1 21 ILE MG 1 91 PHE HZ . . 5.500 4.361 3.851 4.990 . 0 0 "[ . 1 . 2]" 1
495 1 22 ALA H 1 22 ALA MB . . 2.850 2.457 2.308 2.559 . 0 0 "[ . 1 . 2]" 1
496 1 22 ALA H 1 23 ILE H . . 4.530 4.449 4.385 4.532 0.002 9 0 "[ . 1 . 2]" 1
497 1 22 ALA H 1 23 ILE MG . . 4.950 4.207 4.080 4.389 . 0 0 "[ . 1 . 2]" 1
498 1 22 ALA H 1 36 ILE MG . . 3.720 3.327 3.145 3.514 . 0 0 "[ . 1 . 2]" 1
499 1 22 ALA H 1 37 VAL H . . 4.660 4.342 4.094 4.634 . 0 0 "[ . 1 . 2]" 1
500 1 22 ALA H 1 37 VAL MG2 . . 4.330 4.140 3.912 4.331 0.001 5 0 "[ . 1 . 2]" 1
501 1 22 ALA H 1 38 THR H . . 3.550 3.391 3.234 3.549 . 0 0 "[ . 1 . 2]" 1
502 1 22 ALA H 1 38 THR HB . . 4.140 4.031 3.783 4.140 0.000 6 0 "[ . 1 . 2]" 1
503 1 22 ALA H 1 38 THR MG . . 4.370 4.281 4.030 4.368 . 0 0 "[ . 1 . 2]" 1
504 1 22 ALA H 1 39 ILE HA . . 3.850 3.264 3.008 3.541 . 0 0 "[ . 1 . 2]" 1
505 1 22 ALA HA 1 23 ILE H . . 2.450 2.239 2.202 2.290 . 0 0 "[ . 1 . 2]" 1
506 1 22 ALA HA 1 23 ILE HA . . 4.460 4.444 4.429 4.464 0.004 7 0 "[ . 1 . 2]" 1
507 1 22 ALA HA 1 23 ILE HG12 . . 3.890 3.622 3.535 3.710 . 0 0 "[ . 1 . 2]" 1
508 1 22 ALA HA 1 23 ILE HG13 . . 4.080 3.833 3.751 3.929 . 0 0 "[ . 1 . 2]" 1
509 1 22 ALA HA 1 23 ILE MG . . 4.190 4.160 4.104 4.193 0.003 3 0 "[ . 1 . 2]" 1
510 1 22 ALA HA 1 37 VAL MG2 . . 4.170 4.041 3.893 4.166 . 0 0 "[ . 1 . 2]" 1
511 1 22 ALA MB 1 23 ILE H . . 3.020 2.859 2.706 2.969 . 0 0 "[ . 1 . 2]" 1
512 1 22 ALA MB 1 23 ILE HA . . 4.080 3.902 3.856 3.965 . 0 0 "[ . 1 . 2]" 1
513 1 22 ALA MB 1 23 ILE MG . . 4.420 4.384 4.337 4.423 0.003 12 0 "[ . 1 . 2]" 1
514 1 22 ALA MB 1 37 VAL H . . 3.600 3.409 3.259 3.592 . 0 0 "[ . 1 . 2]" 1
515 1 22 ALA MB 1 37 VAL HB . . 4.470 4.339 4.172 4.466 . 0 0 "[ . 1 . 2]" 1
516 1 22 ALA MB 1 37 VAL MG2 . . 2.580 2.007 1.911 2.143 . 0 0 "[ . 1 . 2]" 1
517 1 22 ALA MB 1 38 THR H . . 3.000 2.539 2.288 2.840 . 0 0 "[ . 1 . 2]" 1
518 1 22 ALA MB 1 38 THR HA . . 4.320 4.169 4.004 4.324 0.004 14 0 "[ . 1 . 2]" 1
519 1 22 ALA MB 1 38 THR HB . . 2.490 2.111 1.942 2.281 . 0 0 "[ . 1 . 2]" 1
520 1 22 ALA MB 1 38 THR MG . . 3.310 3.046 2.755 3.293 . 0 0 "[ . 1 . 2]" 1
521 1 22 ALA MB 1 39 ILE HA . . 5.450 4.349 4.072 4.727 . 0 0 "[ . 1 . 2]" 1
522 1 23 ILE H 1 23 ILE HB . . 3.810 3.737 3.715 3.765 . 0 0 "[ . 1 . 2]" 1
523 1 23 ILE H 1 23 ILE MD . . 3.930 3.858 3.805 3.913 . 0 0 "[ . 1 . 2]" 1
524 1 23 ILE H 1 23 ILE HG12 . . 2.900 2.839 2.749 2.900 . 0 0 "[ . 1 . 2]" 1
525 1 23 ILE H 1 23 ILE HG13 . . 2.990 2.204 2.120 2.298 . 0 0 "[ . 1 . 2]" 1
526 1 23 ILE H 1 23 ILE MG . . 3.510 3.480 3.452 3.510 0.000 2 0 "[ . 1 . 2]" 1
527 1 23 ILE H 1 24 GLU H . . 4.430 4.405 4.397 4.412 . 0 0 "[ . 1 . 2]" 1
528 1 23 ILE H 1 37 VAL MG2 . . 3.750 3.335 3.213 3.464 . 0 0 "[ . 1 . 2]" 1
529 1 23 ILE H 1 70 HIS HE1 . . 3.530 2.327 2.091 2.594 . 0 0 "[ . 1 . 2]" 1
530 1 23 ILE H 1 74 ALA MB . . 5.460 5.174 4.907 5.417 . 0 0 "[ . 1 . 2]" 1
531 1 23 ILE HA 1 23 ILE HB . . 2.850 2.637 2.626 2.646 . 0 0 "[ . 1 . 2]" 1
532 1 23 ILE HA 1 23 ILE MD . . 4.180 4.173 4.165 4.178 . 0 0 "[ . 1 . 2]" 1
533 1 23 ILE HA 1 23 ILE HG12 . . 3.890 3.697 3.657 3.735 . 0 0 "[ . 1 . 2]" 1
534 1 23 ILE HA 1 23 ILE HG13 . . 3.750 3.594 3.570 3.624 . 0 0 "[ . 1 . 2]" 1
535 1 23 ILE HA 1 23 ILE MG . . 2.660 2.154 2.131 2.189 . 0 0 "[ . 1 . 2]" 1
536 1 23 ILE HA 1 24 GLU H . . 2.560 2.551 2.536 2.564 0.004 18 0 "[ . 1 . 2]" 1
537 1 23 ILE HA 1 24 GLU HB3 . . 4.860 4.198 4.115 4.301 . 0 0 "[ . 1 . 2]" 1
538 1 23 ILE HA 1 24 GLU HG2 . . 5.180 3.884 3.709 4.067 . 0 0 "[ . 1 . 2]" 1
539 1 23 ILE HA 1 34 PRO HB2 . . 5.500 4.745 4.674 4.858 . 0 0 "[ . 1 . 2]" 1
540 1 23 ILE HA 1 35 ARG H . . 4.340 4.183 4.079 4.294 . 0 0 "[ . 1 . 2]" 1
541 1 23 ILE HA 1 36 ILE HA . . 2.980 2.528 2.379 2.645 . 0 0 "[ . 1 . 2]" 1
542 1 23 ILE HA 1 36 ILE MG . . 4.390 4.176 4.022 4.296 . 0 0 "[ . 1 . 2]" 1
543 1 23 ILE HA 1 37 VAL H . . 3.050 2.421 2.264 2.510 . 0 0 "[ . 1 . 2]" 1
544 1 23 ILE HA 1 37 VAL MG1 . . 3.550 3.267 3.103 3.459 . 0 0 "[ . 1 . 2]" 1
545 1 23 ILE HA 1 37 VAL MG2 . . 3.030 2.497 2.281 2.691 . 0 0 "[ . 1 . 2]" 1
546 1 23 ILE HA 1 38 THR H . . 4.280 4.130 4.003 4.206 . 0 0 "[ . 1 . 2]" 1
547 1 23 ILE HB 1 24 GLU H . . 2.770 2.092 2.065 2.128 . 0 0 "[ . 1 . 2]" 1
548 1 23 ILE HB 1 34 PRO HA . . 3.890 3.580 3.481 3.676 . 0 0 "[ . 1 . 2]" 1
549 1 23 ILE HB 1 34 PRO HB2 . . 3.290 2.462 2.343 2.649 . 0 0 "[ . 1 . 2]" 1
550 1 23 ILE HB 1 35 ARG H . . 4.520 3.129 2.995 3.331 . 0 0 "[ . 1 . 2]" 1
551 1 23 ILE HB 1 36 ILE HA . . 4.360 4.243 4.130 4.328 . 0 0 "[ . 1 . 2]" 1
552 1 23 ILE HB 1 37 VAL MG2 . . 4.870 4.580 4.476 4.720 . 0 0 "[ . 1 . 2]" 1
553 1 23 ILE HB 1 70 HIS HA . . 5.500 4.623 4.379 4.833 . 0 0 "[ . 1 . 2]" 1
554 1 23 ILE HB 1 70 HIS HE1 . . 4.270 3.993 3.883 4.140 . 0 0 "[ . 1 . 2]" 1
555 1 23 ILE MD 1 24 GLU H . . 4.040 3.915 3.871 4.024 . 0 0 "[ . 1 . 2]" 1
556 1 23 ILE MD 1 34 PRO HA . . 4.080 3.914 3.774 4.052 . 0 0 "[ . 1 . 2]" 1
557 1 23 ILE MD 1 34 PRO HB2 . . 3.500 2.119 1.981 2.295 . 0 0 "[ . 1 . 2]" 1
558 1 23 ILE MD 1 34 PRO HB3 . . 2.980 2.347 2.233 2.489 . 0 0 "[ . 1 . 2]" 1
559 1 23 ILE MD 1 34 PRO HD2 . . 5.500 5.076 4.928 5.201 . 0 0 "[ . 1 . 2]" 1
560 1 23 ILE MD 1 34 PRO HD3 . . 4.910 4.568 4.439 4.673 . 0 0 "[ . 1 . 2]" 1
561 1 23 ILE MD 1 34 PRO HG2 . . 4.650 3.484 3.319 3.654 . 0 0 "[ . 1 . 2]" 1
562 1 23 ILE MD 1 34 PRO HG3 . . 4.340 3.051 2.904 3.167 . 0 0 "[ . 1 . 2]" 1
563 1 23 ILE MD 1 70 HIS HE1 . . 3.580 3.414 3.254 3.572 . 0 0 "[ . 1 . 2]" 1
564 1 23 ILE MD 1 73 ALA H . . 4.600 4.357 4.075 4.540 . 0 0 "[ . 1 . 2]" 1
565 1 23 ILE MD 1 73 ALA MB . . 2.800 2.444 2.245 2.709 . 0 0 "[ . 1 . 2]" 1
566 1 23 ILE MD 1 74 ALA H . . 3.340 3.056 2.849 3.231 . 0 0 "[ . 1 . 2]" 1
567 1 23 ILE MD 1 74 ALA HA . . 3.270 3.025 2.740 3.272 0.002 9 0 "[ . 1 . 2]" 1
568 1 23 ILE MD 1 74 ALA MB . . 3.140 2.935 2.584 3.140 0.000 7 0 "[ . 1 . 2]" 1
569 1 23 ILE HG12 1 23 ILE MG . . 2.800 2.205 2.172 2.241 . 0 0 "[ . 1 . 2]" 1
570 1 23 ILE HG12 1 70 HIS HE1 . . 3.930 3.703 3.558 3.896 . 0 0 "[ . 1 . 2]" 1
571 1 23 ILE HG13 1 23 ILE MG . . 3.160 3.156 3.139 3.173 0.013 5 0 "[ . 1 . 2]" 1
572 1 23 ILE HG13 1 24 GLU H . . 4.170 4.083 4.034 4.112 . 0 0 "[ . 1 . 2]" 1
573 1 23 ILE HG13 1 37 VAL MG2 . . 5.500 4.784 4.699 4.942 . 0 0 "[ . 1 . 2]" 1
574 1 23 ILE HG13 1 70 HIS HE1 . . 2.720 2.066 2.000 2.239 . 0 0 "[ . 1 . 2]" 1
575 1 23 ILE HG13 1 74 ALA MB . . 4.110 3.897 3.559 4.104 . 0 0 "[ . 1 . 2]" 1
576 1 23 ILE HG13 1 77 ILE MD . . 5.500 4.736 4.520 4.929 . 0 0 "[ . 1 . 2]" 1
577 1 23 ILE MG 1 24 GLU H . . 3.430 3.083 3.060 3.124 . 0 0 "[ . 1 . 2]" 1
578 1 23 ILE MG 1 24 GLU HG2 . . 4.980 4.806 4.671 4.947 . 0 0 "[ . 1 . 2]" 1
579 1 23 ILE MG 1 34 PRO HA . . 4.470 4.123 4.033 4.208 . 0 0 "[ . 1 . 2]" 1
580 1 23 ILE MG 1 34 PRO HB2 . . 3.290 2.213 2.119 2.298 . 0 0 "[ . 1 . 2]" 1
581 1 23 ILE MG 1 34 PRO HD2 . . 5.460 5.458 5.395 5.474 0.014 14 0 "[ . 1 . 2]" 1
582 1 23 ILE MG 1 35 ARG H . . 4.080 3.337 3.228 3.445 . 0 0 "[ . 1 . 2]" 1
583 1 23 ILE MG 1 35 ARG HA . . 5.170 3.395 3.304 3.451 . 0 0 "[ . 1 . 2]" 1
584 1 23 ILE MG 1 36 ILE H . . 4.290 2.937 2.793 3.018 . 0 0 "[ . 1 . 2]" 1
585 1 23 ILE MG 1 36 ILE HA . . 2.850 1.977 1.932 2.050 . 0 0 "[ . 1 . 2]" 1
586 1 23 ILE MG 1 36 ILE HG12 . . 3.590 2.514 2.342 2.706 . 0 0 "[ . 1 . 2]" 1
587 1 23 ILE MG 1 36 ILE HG13 . . 3.290 3.032 2.952 3.121 . 0 0 "[ . 1 . 2]" 1
588 1 23 ILE MG 1 36 ILE MG . . 3.470 3.396 3.294 3.476 0.006 14 0 "[ . 1 . 2]" 1
589 1 23 ILE MG 1 37 VAL H . . 3.600 3.338 3.271 3.418 . 0 0 "[ . 1 . 2]" 1
590 1 23 ILE MG 1 37 VAL HA . . 5.460 5.460 5.433 5.471 0.011 15 0 "[ . 1 . 2]" 1
591 1 23 ILE MG 1 38 THR H . . 4.720 4.633 4.562 4.720 . 0 0 "[ . 1 . 2]" 1
592 1 23 ILE MG 1 57 ILE MD . . 4.500 2.285 2.111 2.531 . 0 0 "[ . 1 . 2]" 1
593 1 24 GLU H 1 24 GLU HB3 . . 4.190 3.337 3.288 3.401 . 0 0 "[ . 1 . 2]" 1
594 1 24 GLU H 1 24 GLU HG2 . . 3.640 2.794 2.636 2.975 . 0 0 "[ . 1 . 2]" 1
595 1 24 GLU H 1 24 GLU HG3 . . 3.520 3.322 3.089 3.477 . 0 0 "[ . 1 . 2]" 1
596 1 24 GLU H 1 35 ARG H . . 3.030 2.338 2.213 2.536 . 0 0 "[ . 1 . 2]" 1
597 1 24 GLU H 1 35 ARG HB3 . . 4.460 3.765 3.602 3.950 . 0 0 "[ . 1 . 2]" 1
598 1 24 GLU H 1 36 ILE HA . . 4.600 4.448 4.292 4.557 . 0 0 "[ . 1 . 2]" 1
599 1 24 GLU H 1 37 VAL MG1 . . 3.630 3.502 3.395 3.617 . 0 0 "[ . 1 . 2]" 1
600 1 24 GLU H 1 37 VAL MG2 . . 3.940 3.773 3.641 3.924 . 0 0 "[ . 1 . 2]" 1
601 1 24 GLU HB2 1 25 GLY H . . 4.220 2.493 2.022 3.087 . 0 0 "[ . 1 . 2]" 1
602 1 24 GLU HB2 1 25 GLY HA2 . . 4.840 4.249 4.063 4.454 . 0 0 "[ . 1 . 2]" 1
603 1 24 GLU HB3 1 37 VAL MG1 . . 3.520 2.501 2.209 2.766 . 0 0 "[ . 1 . 2]" 1
604 1 24 GLU HB3 1 37 VAL MG2 . . 3.300 2.947 2.742 3.142 . 0 0 "[ . 1 . 2]" 1
605 1 24 GLU HB3 1 70 HIS HE1 . . 5.050 4.880 4.707 5.037 . 0 0 "[ . 1 . 2]" 1
606 1 24 GLU HG2 1 25 GLY H . . 5.500 4.607 4.292 4.935 . 0 0 "[ . 1 . 2]" 1
607 1 24 GLU HG2 1 35 ARG H . . 5.500 3.874 3.681 4.167 . 0 0 "[ . 1 . 2]" 1
608 1 24 GLU HG2 1 35 ARG HB2 . . 5.420 4.965 4.736 5.281 . 0 0 "[ . 1 . 2]" 1
609 1 24 GLU HG2 1 35 ARG HB3 . . 3.750 3.245 2.993 3.592 . 0 0 "[ . 1 . 2]" 1
610 1 24 GLU HG2 1 35 ARG QD . . 5.140 4.620 4.301 5.025 . 0 0 "[ . 1 . 2]" 1
611 1 24 GLU HG2 1 35 ARG QG . . 5.210 4.180 3.667 4.701 . 0 0 "[ . 1 . 2]" 1
612 1 24 GLU HG2 1 37 VAL MG1 . . 2.520 1.862 1.788 1.924 . 0 0 "[ . 1 . 2]" 1
613 1 24 GLU HG2 1 37 VAL MG2 . . 3.350 3.310 3.119 3.352 0.002 3 0 "[ . 1 . 2]" 1
614 1 24 GLU HG3 1 25 GLY H . . 4.490 3.475 3.104 3.915 . 0 0 "[ . 1 . 2]" 1
615 1 24 GLU HG3 1 35 ARG H . . 4.830 3.820 3.568 4.061 . 0 0 "[ . 1 . 2]" 1
616 1 24 GLU HG3 1 35 ARG HB2 . . 5.470 4.810 4.492 5.189 . 0 0 "[ . 1 . 2]" 1
617 1 24 GLU HG3 1 35 ARG HB3 . . 3.670 3.326 2.974 3.668 . 0 0 "[ . 1 . 2]" 1
618 1 24 GLU HG3 1 35 ARG QD . . 5.120 4.658 4.218 5.096 . 0 0 "[ . 1 . 2]" 1
619 1 24 GLU HG3 1 35 ARG QG . . 5.500 4.871 4.354 5.397 . 0 0 "[ . 1 . 2]" 1
620 1 24 GLU HG3 1 37 VAL MG1 . . 3.320 3.214 3.135 3.301 . 0 0 "[ . 1 . 2]" 1
621 1 24 GLU HG3 1 37 VAL MG2 . . 4.960 4.729 4.619 4.779 . 0 0 "[ . 1 . 2]" 1
622 1 25 GLY H 1 29 THR MG . . 4.300 3.877 3.680 4.234 . 0 0 "[ . 1 . 2]" 1
623 1 25 GLY HA2 1 26 GLY H . . 3.050 2.967 2.838 3.049 . 0 0 "[ . 1 . 2]" 1
624 1 25 GLY HA2 1 29 THR HB . . 4.380 3.748 3.125 4.259 . 0 0 "[ . 1 . 2]" 1
625 1 25 GLY HA2 1 29 THR MG . . 3.400 2.318 1.838 3.208 . 0 0 "[ . 1 . 2]" 1
626 1 25 GLY HA2 1 31 GLN HB2 . . 4.430 4.209 3.924 4.355 . 0 0 "[ . 1 . 2]" 1
627 1 25 GLY HA2 1 31 GLN HB3 . . 3.640 3.182 2.896 3.344 . 0 0 "[ . 1 . 2]" 1
628 1 25 GLY HA2 1 31 GLN HG3 . . 5.460 5.346 5.026 5.447 . 0 0 "[ . 1 . 2]" 1
629 1 25 GLY HA3 1 26 GLY H . . 3.110 2.243 2.197 2.327 . 0 0 "[ . 1 . 2]" 1
630 1 25 GLY HA3 1 29 THR MG . . 4.530 3.339 2.684 4.483 . 0 0 "[ . 1 . 2]" 1
631 1 25 GLY HA3 1 31 GLN HB2 . . 4.370 3.926 3.624 4.172 . 0 0 "[ . 1 . 2]" 1
632 1 25 GLY HA3 1 31 GLN HB3 . . 3.640 2.537 2.317 2.748 . 0 0 "[ . 1 . 2]" 1
633 1 25 GLY HA3 1 31 GLN HG2 . . 4.010 3.594 3.295 3.842 . 0 0 "[ . 1 . 2]" 1
634 1 26 GLY H 1 29 THR MG . . 4.410 3.009 2.163 4.226 . 0 0 "[ . 1 . 2]" 1
635 1 26 GLY H 1 31 GLN HB2 . . 4.770 4.383 4.085 4.660 . 0 0 "[ . 1 . 2]" 1
636 1 26 GLY H 1 31 GLN HB3 . . 3.990 2.659 2.375 2.950 . 0 0 "[ . 1 . 2]" 1
637 1 26 GLY H 1 32 PRO HA . . 4.690 4.449 4.236 4.689 . 0 0 "[ . 1 . 2]" 1
638 1 26 GLY QA 1 27 ALA HA . . 4.760 4.021 3.995 4.041 . 0 0 "[ . 1 . 2]" 1
639 1 26 GLY QA 1 27 ALA MB . . 3.810 3.771 3.742 3.791 . 0 0 "[ . 1 . 2]" 1
640 1 26 GLY QA 1 70 HIS H . . 4.010 2.029 1.898 2.144 . 0 0 "[ . 1 . 2]" 1
641 1 26 GLY QA 1 70 HIS HA . . 4.080 3.806 3.658 4.012 . 0 0 "[ . 1 . 2]" 1
642 1 26 GLY QA 1 70 HIS QB . . 3.890 3.229 3.107 3.363 . 0 0 "[ . 1 . 2]" 1
643 1 26 GLY HA2 1 27 ALA H . . 3.100 2.270 2.204 2.368 . 0 0 "[ . 1 . 2]" 1
644 1 26 GLY HA2 1 27 ALA MB . . 4.490 4.102 4.047 4.182 . 0 0 "[ . 1 . 2]" 1
645 1 26 GLY HA3 1 27 ALA H . . 3.100 2.916 2.778 3.024 . 0 0 "[ . 1 . 2]" 1
646 1 26 GLY HA3 1 27 ALA MB . . 4.490 4.404 4.321 4.507 0.017 2 0 "[ . 1 . 2]" 1
647 1 27 ALA H 1 27 ALA MB . . 2.640 2.168 2.056 2.264 . 0 0 "[ . 1 . 2]" 1
648 1 27 ALA H 1 28 ASN H . . 4.320 2.960 2.745 3.308 . 0 0 "[ . 1 . 2]" 1
649 1 27 ALA H 1 68 LYS H . . 4.720 4.039 3.522 4.505 . 0 0 "[ . 1 . 2]" 1
650 1 27 ALA H 1 69 GLU HA . . 2.980 2.379 2.182 2.660 . 0 0 "[ . 1 . 2]" 1
651 1 27 ALA H 1 69 GLU HG2 . . 5.140 3.313 2.985 3.939 . 0 0 "[ . 1 . 2]" 1
652 1 27 ALA HA 1 28 ASN H . . 3.570 3.506 3.419 3.572 0.002 4 0 "[ . 1 . 2]" 1
653 1 27 ALA HA 1 29 THR H . . 5.190 4.489 3.347 5.184 . 0 0 "[ . 1 . 2]" 1
654 1 27 ALA HA 1 32 PRO HB2 . . 4.600 4.415 3.987 4.600 . 0 0 "[ . 1 . 2]" 1
655 1 27 ALA MB 1 28 ASN H . . 3.680 2.665 1.973 3.030 . 0 0 "[ . 1 . 2]" 1
656 1 27 ALA MB 1 28 ASN HA . . 4.270 3.797 3.602 3.941 . 0 0 "[ . 1 . 2]" 1
657 1 27 ALA MB 1 28 ASN QB . . 5.180 3.966 3.711 4.311 . 0 0 "[ . 1 . 2]" 1
658 1 27 ALA MB 1 32 PRO HA . . 3.890 3.622 3.481 3.747 . 0 0 "[ . 1 . 2]" 1
659 1 27 ALA MB 1 67 GLY H . . 4.730 4.110 3.526 4.735 0.005 5 0 "[ . 1 . 2]" 1
660 1 27 ALA MB 1 67 GLY HA2 . . 4.010 2.281 1.999 2.655 . 0 0 "[ . 1 . 2]" 1
661 1 27 ALA MB 1 67 GLY QA . . 3.130 2.255 1.984 2.615 . 0 0 "[ . 1 . 2]" 1
662 1 27 ALA MB 1 67 GLY HA3 . . 4.010 3.579 3.210 3.995 . 0 0 "[ . 1 . 2]" 1
663 1 27 ALA MB 1 68 LYS H . . 3.660 3.251 2.788 3.551 . 0 0 "[ . 1 . 2]" 1
664 1 27 ALA MB 1 68 LYS HA . . 4.510 3.606 3.250 3.991 . 0 0 "[ . 1 . 2]" 1
665 1 27 ALA MB 1 68 LYS HB2 . . 5.500 4.998 4.674 5.205 . 0 0 "[ . 1 . 2]" 1
666 1 27 ALA MB 1 69 GLU H . . 4.440 3.976 3.457 4.355 . 0 0 "[ . 1 . 2]" 1
667 1 27 ALA MB 1 69 GLU HA . . 3.660 3.550 3.403 3.661 0.001 16 0 "[ . 1 . 2]" 1
668 1 27 ALA MB 1 69 GLU HB2 . . 5.420 5.142 4.977 5.263 . 0 0 "[ . 1 . 2]" 1
669 1 27 ALA MB 1 69 GLU HB3 . . 4.980 4.798 4.698 4.978 . 0 0 "[ . 1 . 2]" 1
670 1 27 ALA MB 1 69 GLU HG2 . . 3.240 2.800 2.571 3.144 . 0 0 "[ . 1 . 2]" 1
671 1 27 ALA MB 1 69 GLU HG3 . . 3.940 3.766 3.567 3.927 . 0 0 "[ . 1 . 2]" 1
672 1 28 ASN H 1 28 ASN QB . . 3.640 2.290 2.175 2.674 . 0 0 "[ . 1 . 2]" 1
673 1 28 ASN H 1 29 THR H . . 3.730 2.871 2.669 3.116 . 0 0 "[ . 1 . 2]" 1
674 1 28 ASN H 1 69 GLU HA . . 3.990 3.766 3.397 3.989 . 0 0 "[ . 1 . 2]" 1
675 1 28 ASN H 1 69 GLU HG3 . . 5.500 4.699 4.153 5.002 . 0 0 "[ . 1 . 2]" 1
676 1 28 ASN QB 1 28 ASN QD . . 3.010 2.153 2.064 2.379 . 0 0 "[ . 1 . 2]" 1
677 1 28 ASN QB 1 69 GLU HG2 . . 3.860 3.544 3.154 3.814 . 0 0 "[ . 1 . 2]" 1
678 1 28 ASN QB 1 69 GLU HG3 . . 5.050 4.839 4.362 5.053 0.003 12 0 "[ . 1 . 2]" 1
679 1 29 THR H 1 29 THR HB . . 3.990 3.088 2.422 3.664 . 0 0 "[ . 1 . 2]" 1
680 1 29 THR H 1 29 THR MG . . 3.350 2.341 1.866 2.740 . 0 0 "[ . 1 . 2]" 1
681 1 29 THR HB 1 31 GLN H . . 4.320 3.879 2.978 4.333 0.013 5 0 "[ . 1 . 2]" 1
682 1 29 THR MG 1 31 GLN H . . 4.720 2.910 1.887 4.636 . 0 0 "[ . 1 . 2]" 1
683 1 29 THR MG 1 31 GLN HB3 . . 5.100 3.323 2.296 5.082 . 0 0 "[ . 1 . 2]" 1
684 1 29 THR MG 1 70 HIS HB2 . . 5.420 5.199 4.885 5.421 0.001 8 0 "[ . 1 . 2]" 1
685 1 29 THR MG 1 70 HIS QB . . 4.710 4.572 4.404 4.712 0.002 11 0 "[ . 1 . 2]" 1
686 1 29 THR MG 1 70 HIS HB3 . . 5.420 5.094 4.725 5.378 . 0 0 "[ . 1 . 2]" 1
687 1 30 ARG HA 1 30 ARG HB2 . . 3.020 2.612 2.353 3.025 0.005 2 0 "[ . 1 . 2]" 1
688 1 30 ARG HA 1 30 ARG HB3 . . 3.020 2.851 2.401 3.023 0.003 16 0 "[ . 1 . 2]" 1
689 1 30 ARG HA 1 30 ARG QD . . 4.220 3.674 1.997 4.187 . 0 0 "[ . 1 . 2]" 1
690 1 30 ARG HA 1 30 ARG QG . . 3.340 2.569 2.262 3.342 0.002 20 0 "[ . 1 . 2]" 1
691 1 30 ARG HA 1 31 GLN H . . 3.570 3.513 3.444 3.562 . 0 0 "[ . 1 . 2]" 1
692 1 30 ARG HA 1 32 PRO HD3 . . 4.870 4.800 4.588 4.901 0.031 16 0 "[ . 1 . 2]" 1
693 1 30 ARG QB 1 30 ARG QD . . 3.110 2.240 2.066 2.664 . 0 0 "[ . 1 . 2]" 1
694 1 30 ARG HB2 1 30 ARG QD . . 3.740 2.673 2.208 3.246 . 0 0 "[ . 1 . 2]" 1
695 1 30 ARG HB3 1 30 ARG QD . . 3.740 2.567 2.139 3.506 . 0 0 "[ . 1 . 2]" 1
696 1 30 ARG QG 1 31 GLN H . . 4.260 3.798 2.057 4.261 0.001 9 0 "[ . 1 . 2]" 1
697 1 31 GLN H 1 31 GLN HB2 . . 3.120 2.423 2.354 2.486 . 0 0 "[ . 1 . 2]" 1
698 1 31 GLN H 1 31 GLN HB3 . . 3.820 2.746 2.676 2.791 . 0 0 "[ . 1 . 2]" 1
699 1 31 GLN H 1 31 GLN HG2 . . 4.660 4.648 4.613 4.692 0.032 5 0 "[ . 1 . 2]" 1
700 1 31 GLN H 1 31 GLN HG3 . . 4.610 4.547 4.504 4.582 . 0 0 "[ . 1 . 2]" 1
701 1 31 GLN H 1 32 PRO HD2 . . 4.750 4.747 4.713 4.764 0.014 16 0 "[ . 1 . 2]" 1
702 1 31 GLN H 1 32 PRO HD3 . . 4.630 4.554 4.451 4.604 . 0 0 "[ . 1 . 2]" 1
703 1 31 GLN HA 1 31 GLN HG3 . . 3.750 2.831 2.727 2.898 . 0 0 "[ . 1 . 2]" 1
704 1 31 GLN HA 1 32 PRO HD3 . . 2.630 2.358 2.337 2.402 . 0 0 "[ . 1 . 2]" 1
705 1 31 GLN HA 1 32 PRO QG . . 3.780 3.771 3.766 3.775 . 0 0 "[ . 1 . 2]" 1
706 1 31 GLN HB2 1 31 GLN HG2 . . 2.830 2.455 2.402 2.525 . 0 0 "[ . 1 . 2]" 1
707 1 31 GLN HB2 1 32 PRO HD2 . . 4.350 4.239 4.162 4.334 . 0 0 "[ . 1 . 2]" 1
708 1 31 GLN HB2 1 32 PRO HD3 . . 4.990 4.937 4.895 4.981 . 0 0 "[ . 1 . 2]" 1
709 1 31 GLN HB2 1 35 ARG QD . . 5.500 5.464 5.197 5.505 0.005 12 0 "[ . 1 . 2]" 1
710 1 31 GLN HB3 1 31 GLN HG2 . . 2.770 2.399 2.338 2.450 . 0 0 "[ . 1 . 2]" 1
711 1 31 GLN HB3 1 32 PRO HD2 . . 4.340 4.266 4.202 4.331 . 0 0 "[ . 1 . 2]" 1
712 1 31 GLN HE21 1 31 GLN HG2 . . 3.550 2.846 2.684 3.013 . 0 0 "[ . 1 . 2]" 1
713 1 31 GLN HE21 1 31 GLN HG3 . . 3.140 2.294 2.185 2.419 . 0 0 "[ . 1 . 2]" 1
714 1 31 GLN HE21 1 33 LEU H . . 4.050 3.582 3.195 3.904 . 0 0 "[ . 1 . 2]" 1
715 1 31 GLN HE21 1 33 LEU HB2 . . 5.500 3.720 3.472 4.058 . 0 0 "[ . 1 . 2]" 1
716 1 31 GLN HE21 1 56 VAL MG1 . . 3.890 2.644 2.399 2.883 . 0 0 "[ . 1 . 2]" 1
717 1 31 GLN HE21 1 56 VAL MG2 . . 4.900 3.090 2.784 3.387 . 0 0 "[ . 1 . 2]" 1
718 1 31 GLN HE21 1 96 PHE QD . . 4.980 4.025 3.127 4.588 . 0 0 "[ . 1 . 2]" 1
719 1 31 GLN HE22 1 31 GLN HG2 . . 3.850 3.746 3.670 3.824 . 0 0 "[ . 1 . 2]" 1
720 1 31 GLN HE22 1 31 GLN HG3 . . 3.570 3.507 3.464 3.557 . 0 0 "[ . 1 . 2]" 1
721 1 31 GLN HE22 1 32 PRO QG . . 5.500 4.508 4.311 4.696 . 0 0 "[ . 1 . 2]" 1
722 1 31 GLN HE22 1 33 LEU H . . 4.990 4.788 4.635 4.962 . 0 0 "[ . 1 . 2]" 1
723 1 31 GLN HE22 1 35 ARG HB2 . . 5.000 4.822 4.409 5.000 . 0 0 "[ . 1 . 2]" 1
724 1 31 GLN HE22 1 35 ARG QD . . 5.100 4.526 3.932 5.103 0.003 15 0 "[ . 1 . 2]" 1
725 1 31 GLN HE22 1 56 VAL MG1 . . 3.950 3.835 3.605 3.959 0.009 14 0 "[ . 1 . 2]" 1
726 1 31 GLN HE22 1 56 VAL MG2 . . 3.840 3.568 3.272 3.771 . 0 0 "[ . 1 . 2]" 1
727 1 31 GLN HE22 1 96 PHE QD . . 4.790 3.516 2.575 4.092 . 0 0 "[ . 1 . 2]" 1
728 1 31 GLN HG2 1 35 ARG H . . 5.330 4.271 3.994 4.516 . 0 0 "[ . 1 . 2]" 1
729 1 31 GLN HG2 1 35 ARG HB2 . . 3.750 3.234 2.911 3.458 . 0 0 "[ . 1 . 2]" 1
730 1 31 GLN HG2 1 35 ARG HB3 . . 4.070 3.776 3.583 4.034 . 0 0 "[ . 1 . 2]" 1
731 1 31 GLN HG2 1 35 ARG QD . . 5.320 3.948 3.762 4.286 . 0 0 "[ . 1 . 2]" 1
732 1 31 GLN HG2 1 35 ARG QG . . 5.500 5.078 4.811 5.183 . 0 0 "[ . 1 . 2]" 1
733 1 31 GLN HG3 1 35 ARG H . . 5.040 4.986 4.826 5.047 0.007 20 0 "[ . 1 . 2]" 1
734 1 31 GLN HG3 1 35 ARG HB2 . . 4.480 4.240 3.910 4.480 . 0 0 "[ . 1 . 2]" 1
735 1 32 PRO HA 1 33 LEU H . . 3.570 3.570 3.566 3.573 0.003 9 0 "[ . 1 . 2]" 1
736 1 32 PRO HB2 1 33 LEU H . . 3.850 2.917 2.872 3.001 . 0 0 "[ . 1 . 2]" 1
737 1 32 PRO HB2 1 33 LEU MD1 . . 4.370 3.548 3.222 3.990 . 0 0 "[ . 1 . 2]" 1
738 1 32 PRO HB2 1 33 LEU MD2 . . 4.090 1.985 1.939 2.071 . 0 0 "[ . 1 . 2]" 1
739 1 32 PRO HB3 1 33 LEU H . . 3.960 3.900 3.874 3.949 . 0 0 "[ . 1 . 2]" 1
740 1 32 PRO HB3 1 33 LEU MD2 . . 3.510 3.504 3.450 3.532 0.022 12 0 "[ . 1 . 2]" 1
741 1 32 PRO HD2 1 33 LEU H . . 3.430 2.748 2.712 2.769 . 0 0 "[ . 1 . 2]" 1
742 1 32 PRO HD2 1 33 LEU MD2 . . 4.080 3.948 3.755 4.047 . 0 0 "[ . 1 . 2]" 1
743 1 32 PRO HD3 1 33 LEU H . . 3.880 3.872 3.858 3.880 0.000 9 0 "[ . 1 . 2]" 1
744 1 32 PRO QG 1 33 LEU H . . 3.220 1.927 1.891 1.999 . 0 0 "[ . 1 . 2]" 1
745 1 32 PRO QG 1 33 LEU MD1 . . 4.640 4.209 3.959 4.469 . 0 0 "[ . 1 . 2]" 1
746 1 32 PRO QG 1 33 LEU MD2 . . 3.750 2.053 1.925 2.172 . 0 0 "[ . 1 . 2]" 1
747 1 32 PRO QG 1 33 LEU HG . . 4.780 4.536 4.376 4.614 . 0 0 "[ . 1 . 2]" 1
748 1 33 LEU H 1 33 LEU HB2 . . 3.630 2.361 2.320 2.408 . 0 0 "[ . 1 . 2]" 1
749 1 33 LEU H 1 33 LEU MD1 . . 4.070 3.687 3.504 3.886 . 0 0 "[ . 1 . 2]" 1
750 1 33 LEU H 1 33 LEU MD2 . . 3.640 2.328 2.242 2.418 . 0 0 "[ . 1 . 2]" 1
751 1 33 LEU H 1 33 LEU HG . . 4.280 4.231 4.086 4.285 0.005 12 0 "[ . 1 . 2]" 1
752 1 33 LEU H 1 56 VAL MG1 . . 3.990 3.776 3.678 3.889 . 0 0 "[ . 1 . 2]" 1
753 1 33 LEU HA 1 33 LEU MD1 . . 2.660 1.996 1.941 2.159 . 0 0 "[ . 1 . 2]" 1
754 1 33 LEU HA 1 33 LEU MD2 . . 3.290 2.961 2.686 3.149 . 0 0 "[ . 1 . 2]" 1
755 1 33 LEU HA 1 33 LEU HG . . 3.730 3.680 3.655 3.727 . 0 0 "[ . 1 . 2]" 1
756 1 33 LEU HA 1 34 PRO HB3 . . 4.850 4.847 4.839 4.854 0.004 12 0 "[ . 1 . 2]" 1
757 1 33 LEU HA 1 34 PRO HD2 . . 2.800 2.402 2.341 2.436 . 0 0 "[ . 1 . 2]" 1
758 1 33 LEU HA 1 34 PRO HD3 . . 2.620 2.301 2.280 2.315 . 0 0 "[ . 1 . 2]" 1
759 1 33 LEU HA 1 34 PRO HG2 . . 4.540 4.514 4.465 4.542 0.002 12 0 "[ . 1 . 2]" 1
760 1 33 LEU HA 1 34 PRO HG3 . . 4.500 4.473 4.438 4.494 . 0 0 "[ . 1 . 2]" 1
761 1 33 LEU HA 1 56 VAL MG1 . . 4.310 4.147 4.004 4.302 . 0 0 "[ . 1 . 2]" 1
762 1 33 LEU HA 1 65 LEU HB3 . . 4.600 3.792 3.611 3.923 . 0 0 "[ . 1 . 2]" 1
763 1 33 LEU HA 1 65 LEU MD1 . . 4.480 4.340 4.118 4.481 0.001 3 0 "[ . 1 . 2]" 1
764 1 33 LEU HB2 1 33 LEU MD2 . . 3.260 2.176 2.085 2.298 . 0 0 "[ . 1 . 2]" 1
765 1 33 LEU HB2 1 33 LEU HG . . 2.860 2.510 2.428 2.551 . 0 0 "[ . 1 . 2]" 1
766 1 33 LEU HB2 1 56 VAL MG1 . . 2.710 2.276 2.142 2.421 . 0 0 "[ . 1 . 2]" 1
767 1 33 LEU HB2 1 58 LEU HA . . 4.910 4.029 3.944 4.173 . 0 0 "[ . 1 . 2]" 1
768 1 33 LEU HB2 1 96 PHE QE . . 4.950 4.070 3.780 4.595 . 0 0 "[ . 1 . 2]" 1
769 1 33 LEU HB3 1 33 LEU MD1 . . 3.240 2.393 2.260 2.462 . 0 0 "[ . 1 . 2]" 1
770 1 33 LEU HB3 1 34 PRO HD2 . . 3.840 2.067 1.997 2.227 . 0 0 "[ . 1 . 2]" 1
771 1 33 LEU HB3 1 34 PRO HD3 . . 3.690 3.503 3.444 3.639 . 0 0 "[ . 1 . 2]" 1
772 1 33 LEU HB3 1 34 PRO HG2 . . 4.120 3.778 3.725 3.894 . 0 0 "[ . 1 . 2]" 1
773 1 33 LEU HB3 1 56 VAL MG1 . . 2.930 2.324 2.170 2.473 . 0 0 "[ . 1 . 2]" 1
774 1 33 LEU HB3 1 57 ILE H . . 4.560 4.425 4.217 4.549 . 0 0 "[ . 1 . 2]" 1
775 1 33 LEU HB3 1 57 ILE HA . . 5.420 5.228 5.114 5.289 . 0 0 "[ . 1 . 2]" 1
776 1 33 LEU HB3 1 58 LEU QB . . 4.440 4.278 4.247 4.340 . 0 0 "[ . 1 . 2]" 1
777 1 33 LEU MD1 1 34 PRO HD2 . . 2.930 2.096 1.972 2.312 . 0 0 "[ . 1 . 2]" 1
778 1 33 LEU MD1 1 34 PRO HD3 . . 3.120 2.762 2.611 2.915 . 0 0 "[ . 1 . 2]" 1
779 1 33 LEU MD1 1 34 PRO HG2 . . 4.910 4.109 3.862 4.328 . 0 0 "[ . 1 . 2]" 1
780 1 33 LEU MD1 1 34 PRO HG3 . . 4.660 4.152 4.022 4.330 . 0 0 "[ . 1 . 2]" 1
781 1 33 LEU MD1 1 58 LEU HA . . 3.770 2.285 1.896 2.579 . 0 0 "[ . 1 . 2]" 1
782 1 33 LEU MD1 1 64 THR MG . . 5.480 4.805 4.279 5.166 . 0 0 "[ . 1 . 2]" 1
783 1 33 LEU MD1 1 65 LEU H . . 4.080 2.929 2.728 3.130 . 0 0 "[ . 1 . 2]" 1
784 1 33 LEU MD1 1 65 LEU HB2 . . 4.330 1.920 1.834 2.008 . 0 0 "[ . 1 . 2]" 1
785 1 33 LEU MD1 1 65 LEU HB3 . . 3.400 2.546 2.345 2.727 . 0 0 "[ . 1 . 2]" 1
786 1 33 LEU MD1 1 65 LEU MD2 . . 4.060 4.044 3.945 4.101 0.041 14 0 "[ . 1 . 2]" 1
787 1 33 LEU MD1 1 66 ARG H . . 3.550 2.728 2.460 2.988 . 0 0 "[ . 1 . 2]" 1
788 1 33 LEU MD1 1 66 ARG HA . . 2.690 1.953 1.829 2.269 . 0 0 "[ . 1 . 2]" 1
789 1 33 LEU MD1 1 66 ARG QB . . 3.720 3.366 2.897 3.711 . 0 0 "[ . 1 . 2]" 1
790 1 33 LEU MD1 1 66 ARG HD2 . . 5.500 4.688 1.943 5.480 . 0 0 "[ . 1 . 2]" 1
791 1 33 LEU MD1 1 66 ARG HD3 . . 5.500 4.981 2.934 5.502 0.002 19 0 "[ . 1 . 2]" 1
792 1 33 LEU MD1 1 66 ARG QG . . 4.910 3.502 2.507 4.707 . 0 0 "[ . 1 . 2]" 1
793 1 33 LEU MD1 1 67 GLY H . . 4.100 3.568 3.073 4.101 0.001 13 0 "[ . 1 . 2]" 1
794 1 33 LEU MD1 1 68 LYS H . . 5.300 3.589 3.352 3.760 . 0 0 "[ . 1 . 2]" 1
795 1 33 LEU MD2 1 34 PRO HD2 . . 4.430 4.293 4.151 4.413 . 0 0 "[ . 1 . 2]" 1
796 1 33 LEU MD2 1 56 VAL MG1 . . 3.780 3.553 3.352 3.781 0.001 14 0 "[ . 1 . 2]" 1
797 1 33 LEU MD2 1 58 LEU HA . . 3.900 3.733 3.613 3.844 . 0 0 "[ . 1 . 2]" 1
798 1 33 LEU MD2 1 58 LEU MD2 . . 3.100 2.827 2.620 3.078 . 0 0 "[ . 1 . 2]" 1
799 1 33 LEU MD2 1 66 ARG H . . 4.460 4.349 3.965 4.462 0.002 8 0 "[ . 1 . 2]" 1
800 1 33 LEU MD2 1 66 ARG HA . . 3.170 2.464 2.130 2.716 . 0 0 "[ . 1 . 2]" 1
801 1 33 LEU MD2 1 66 ARG QB . . 3.930 3.580 2.687 3.938 0.008 20 0 "[ . 1 . 2]" 1
802 1 33 LEU MD2 1 66 ARG QD . . 5.340 4.403 2.026 5.243 . 0 0 "[ . 1 . 2]" 1
803 1 33 LEU MD2 1 67 GLY H . . 5.500 4.095 2.869 5.430 . 0 0 "[ . 1 . 2]" 1
804 1 33 LEU MD2 1 96 PHE QE . . 4.860 4.197 3.767 4.686 . 0 0 "[ . 1 . 2]" 1
805 1 33 LEU MD2 1 96 PHE HZ . . 5.500 4.590 4.007 5.124 . 0 0 "[ . 1 . 2]" 1
806 1 33 LEU HG 1 34 PRO HD2 . . 4.080 3.788 3.698 3.968 . 0 0 "[ . 1 . 2]" 1
807 1 33 LEU HG 1 56 VAL MG1 . . 3.810 3.413 3.219 3.540 . 0 0 "[ . 1 . 2]" 1
808 1 33 LEU HG 1 58 LEU HA . . 3.450 2.094 1.996 2.309 . 0 0 "[ . 1 . 2]" 1
809 1 33 LEU HG 1 58 LEU HB3 . . 2.500 2.502 2.482 2.510 0.010 12 0 "[ . 1 . 2]" 1
810 1 33 LEU HG 1 58 LEU MD2 . . 2.610 2.052 1.895 2.243 . 0 0 "[ . 1 . 2]" 1
811 1 33 LEU HG 1 66 ARG HA . . 4.450 4.091 3.741 4.364 . 0 0 "[ . 1 . 2]" 1
812 1 34 PRO HA 1 35 ARG H . . 2.630 2.187 2.164 2.216 . 0 0 "[ . 1 . 2]" 1
813 1 34 PRO HB2 1 35 ARG H . . 3.430 3.307 3.173 3.440 0.010 15 0 "[ . 1 . 2]" 1
814 1 34 PRO HB2 1 65 LEU MD1 . . 4.330 3.944 3.784 4.158 . 0 0 "[ . 1 . 2]" 1
815 1 34 PRO HB3 1 35 ARG H . . 3.930 3.853 3.769 3.938 0.008 15 0 "[ . 1 . 2]" 1
816 1 34 PRO HB3 1 57 ILE H . . 5.500 5.510 5.502 5.526 0.026 14 0 "[ . 1 . 2]" 1
817 1 34 PRO HB3 1 65 LEU MD1 . . 4.110 3.946 3.737 4.110 0.000 3 0 "[ . 1 . 2]" 1
818 1 34 PRO HB3 1 73 ALA MB . . 3.640 3.068 2.857 3.300 . 0 0 "[ . 1 . 2]" 1
819 1 34 PRO HD2 1 57 ILE H . . 4.550 4.422 4.279 4.511 . 0 0 "[ . 1 . 2]" 1
820 1 34 PRO HD2 1 57 ILE HB . . 4.080 3.758 3.593 3.875 . 0 0 "[ . 1 . 2]" 1
821 1 34 PRO HD2 1 57 ILE MD . . 5.500 5.136 4.876 5.278 . 0 0 "[ . 1 . 2]" 1
822 1 34 PRO HD2 1 57 ILE MG . . 5.500 4.339 4.175 4.456 . 0 0 "[ . 1 . 2]" 1
823 1 34 PRO HD2 1 58 LEU QB . . 5.460 5.259 5.182 5.387 . 0 0 "[ . 1 . 2]" 1
824 1 34 PRO HD2 1 65 LEU HB2 . . 3.690 2.882 2.720 3.073 . 0 0 "[ . 1 . 2]" 1
825 1 34 PRO HD2 1 65 LEU HB3 . . 3.870 3.077 2.886 3.229 . 0 0 "[ . 1 . 2]" 1
826 1 34 PRO HD2 1 65 LEU MD1 . . 3.240 2.463 2.171 2.770 . 0 0 "[ . 1 . 2]" 1
827 1 34 PRO HD3 1 65 LEU HA . . 5.100 5.093 4.921 5.125 0.025 12 0 "[ . 1 . 2]" 1
828 1 34 PRO HD3 1 65 LEU HB2 . . 4.080 3.508 3.250 3.754 . 0 0 "[ . 1 . 2]" 1
829 1 34 PRO HD3 1 65 LEU HB3 . . 3.580 2.713 2.622 2.794 . 0 0 "[ . 1 . 2]" 1
830 1 34 PRO HD3 1 65 LEU MD1 . . 4.320 2.939 2.783 3.180 . 0 0 "[ . 1 . 2]" 1
831 1 34 PRO HD3 1 65 LEU MD2 . . 5.500 4.088 3.890 4.309 . 0 0 "[ . 1 . 2]" 1
832 1 34 PRO HG2 1 57 ILE H . . 4.370 3.176 3.153 3.226 . 0 0 "[ . 1 . 2]" 1
833 1 34 PRO HG2 1 57 ILE HB . . 3.550 2.021 1.992 2.083 . 0 0 "[ . 1 . 2]" 1
834 1 34 PRO HG2 1 57 ILE MD . . 4.970 3.178 2.889 3.358 . 0 0 "[ . 1 . 2]" 1
835 1 34 PRO HG2 1 57 ILE MG . . 4.620 3.464 3.333 3.561 . 0 0 "[ . 1 . 2]" 1
836 1 34 PRO HG2 1 65 LEU HB2 . . 4.590 4.260 4.034 4.494 . 0 0 "[ . 1 . 2]" 1
837 1 34 PRO HG2 1 65 LEU HB3 . . 4.510 4.273 4.137 4.456 . 0 0 "[ . 1 . 2]" 1
838 1 34 PRO HG2 1 65 LEU MD1 . . 2.830 2.297 2.155 2.598 . 0 0 "[ . 1 . 2]" 1
839 1 34 PRO HG2 1 70 HIS HA . . 5.460 5.427 5.319 5.465 0.005 11 0 "[ . 1 . 2]" 1
840 1 34 PRO HG2 1 73 ALA MB . . 3.830 3.611 3.465 3.763 . 0 0 "[ . 1 . 2]" 1
841 1 34 PRO HG3 1 65 LEU MD1 . . 2.730 1.962 1.821 2.073 . 0 0 "[ . 1 . 2]" 1
842 1 34 PRO HG3 1 70 HIS HA . . 4.220 4.095 3.904 4.213 . 0 0 "[ . 1 . 2]" 1
843 1 34 PRO HG3 1 73 ALA MB . . 2.910 2.281 2.105 2.465 . 0 0 "[ . 1 . 2]" 1
844 1 35 ARG H 1 35 ARG HB2 . . 3.400 3.058 2.920 3.245 . 0 0 "[ . 1 . 2]" 1
845 1 35 ARG H 1 35 ARG HB3 . . 3.290 2.586 2.469 2.677 . 0 0 "[ . 1 . 2]" 1
846 1 35 ARG H 1 35 ARG QD . . 4.870 4.713 4.591 4.918 0.048 6 0 "[ . 1 . 2]" 1
847 1 35 ARG H 1 35 ARG QG . . 4.080 4.022 3.930 4.083 0.003 3 0 "[ . 1 . 2]" 1
848 1 35 ARG HA 1 35 ARG QD . . 4.180 3.984 3.875 4.183 0.003 6 0 "[ . 1 . 2]" 1
849 1 35 ARG HA 1 35 ARG QG . . 3.160 2.461 2.374 2.572 . 0 0 "[ . 1 . 2]" 1
850 1 35 ARG HA 1 36 ILE H . . 2.660 2.158 2.149 2.165 . 0 0 "[ . 1 . 2]" 1
851 1 35 ARG HA 1 36 ILE HA . . 4.370 4.354 4.348 4.363 . 0 0 "[ . 1 . 2]" 1
852 1 35 ARG HA 1 36 ILE HB . . 4.690 4.687 4.664 4.693 0.003 18 0 "[ . 1 . 2]" 1
853 1 35 ARG HA 1 36 ILE MD . . 5.110 5.084 4.960 5.119 0.009 5 0 "[ . 1 . 2]" 1
854 1 35 ARG HA 1 36 ILE HG12 . . 5.290 4.979 4.913 5.104 . 0 0 "[ . 1 . 2]" 1
855 1 35 ARG HA 1 36 ILE HG13 . . 4.080 3.739 3.697 3.776 . 0 0 "[ . 1 . 2]" 1
856 1 35 ARG HA 1 56 VAL H . . 4.690 4.599 4.544 4.639 . 0 0 "[ . 1 . 2]" 1
857 1 35 ARG HA 1 56 VAL HA . . 2.770 2.004 1.987 2.045 . 0 0 "[ . 1 . 2]" 1
858 1 35 ARG HA 1 56 VAL HB . . 5.340 4.626 4.497 4.707 . 0 0 "[ . 1 . 2]" 1
859 1 35 ARG HA 1 56 VAL MG1 . . 3.380 3.268 3.170 3.339 . 0 0 "[ . 1 . 2]" 1
860 1 35 ARG HA 1 56 VAL MG2 . . 3.290 2.619 2.289 2.804 . 0 0 "[ . 1 . 2]" 1
861 1 35 ARG HA 1 57 ILE H . . 3.340 3.317 3.225 3.347 0.007 6 0 "[ . 1 . 2]" 1
862 1 35 ARG HB2 1 35 ARG QD . . 3.090 2.324 2.131 2.770 . 0 0 "[ . 1 . 2]" 1
863 1 35 ARG HB2 1 36 ILE H . . 4.240 4.190 4.058 4.269 0.029 15 0 "[ . 1 . 2]" 1
864 1 35 ARG HB2 1 56 VAL HA . . 3.820 3.733 3.593 3.831 0.011 15 0 "[ . 1 . 2]" 1
865 1 35 ARG HB2 1 56 VAL MG1 . . 3.890 3.236 3.114 3.423 . 0 0 "[ . 1 . 2]" 1
866 1 35 ARG HB2 1 56 VAL MG2 . . 3.290 2.128 2.008 2.254 . 0 0 "[ . 1 . 2]" 1
867 1 35 ARG HB3 1 35 ARG QD . . 2.950 2.526 2.279 2.736 . 0 0 "[ . 1 . 2]" 1
868 1 35 ARG HB3 1 35 ARG QG . . 2.700 2.304 2.259 2.354 . 0 0 "[ . 1 . 2]" 1
869 1 35 ARG HB3 1 36 ILE H . . 4.260 4.189 4.083 4.268 0.008 4 0 "[ . 1 . 2]" 1
870 1 35 ARG HB3 1 37 VAL MG1 . . 3.790 3.595 3.442 3.751 . 0 0 "[ . 1 . 2]" 1
871 1 35 ARG HB3 1 56 VAL HA . . 4.980 4.846 4.795 4.877 . 0 0 "[ . 1 . 2]" 1
872 1 35 ARG HB3 1 56 VAL MG2 . . 3.850 3.623 3.390 3.719 . 0 0 "[ . 1 . 2]" 1
873 1 35 ARG QD 1 35 ARG QG . . 2.440 2.064 2.003 2.090 . 0 0 "[ . 1 . 2]" 1
874 1 35 ARG QD 1 36 ILE H . . 4.780 4.763 4.691 4.791 0.011 14 0 "[ . 1 . 2]" 1
875 1 35 ARG QD 1 37 VAL HA . . 5.500 5.391 5.228 5.503 0.003 7 0 "[ . 1 . 2]" 1
876 1 35 ARG QD 1 37 VAL MG1 . . 4.330 4.073 3.850 4.336 0.006 5 0 "[ . 1 . 2]" 1
877 1 35 ARG QD 1 54 GLY HA2 . . 4.100 3.971 3.572 4.105 0.005 20 0 "[ . 1 . 2]" 1
878 1 35 ARG QD 1 54 GLY HA3 . . 5.500 5.037 4.467 5.436 . 0 0 "[ . 1 . 2]" 1
879 1 35 ARG QD 1 56 VAL HB . . 5.500 5.488 5.388 5.529 0.029 6 0 "[ . 1 . 2]" 1
880 1 35 ARG QD 1 56 VAL MG1 . . 4.700 4.383 4.222 4.713 0.013 6 0 "[ . 1 . 2]" 1
881 1 35 ARG QD 1 56 VAL MG2 . . 3.290 2.715 2.546 2.890 . 0 0 "[ . 1 . 2]" 1
882 1 35 ARG QG 1 36 ILE H . . 3.290 2.720 2.625 2.806 . 0 0 "[ . 1 . 2]" 1
883 1 35 ARG QG 1 36 ILE HB . . 5.450 4.022 3.945 4.109 . 0 0 "[ . 1 . 2]" 1
884 1 35 ARG QG 1 37 VAL MG1 . . 3.660 3.306 2.848 3.652 . 0 0 "[ . 1 . 2]" 1
885 1 35 ARG QG 1 54 GLY HA2 . . 3.550 2.991 2.805 3.201 . 0 0 "[ . 1 . 2]" 1
886 1 35 ARG QG 1 56 VAL HA . . 4.430 3.396 3.134 3.660 . 0 0 "[ . 1 . 2]" 1
887 1 35 ARG QG 1 56 VAL MG2 . . 2.800 2.233 1.864 2.716 . 0 0 "[ . 1 . 2]" 1
888 1 36 ILE H 1 36 ILE HB . . 2.830 2.556 2.526 2.580 . 0 0 "[ . 1 . 2]" 1
889 1 36 ILE H 1 36 ILE MD . . 3.650 3.597 3.491 3.626 . 0 0 "[ . 1 . 2]" 1
890 1 36 ILE H 1 36 ILE HG12 . . 3.710 3.298 3.230 3.395 . 0 0 "[ . 1 . 2]" 1
891 1 36 ILE H 1 36 ILE HG13 . . 2.920 2.076 2.015 2.131 . 0 0 "[ . 1 . 2]" 1
892 1 36 ILE H 1 36 ILE MG . . 4.330 3.765 3.763 3.766 . 0 0 "[ . 1 . 2]" 1
893 1 36 ILE H 1 55 HIS HB2 . . 4.490 4.032 3.935 4.192 . 0 0 "[ . 1 . 2]" 1
894 1 36 ILE H 1 55 HIS HB3 . . 5.500 4.523 4.378 4.626 . 0 0 "[ . 1 . 2]" 1
895 1 36 ILE H 1 56 VAL HA . . 3.600 3.037 2.926 3.167 . 0 0 "[ . 1 . 2]" 1
896 1 36 ILE H 1 56 VAL MG2 . . 3.970 3.795 3.614 3.918 . 0 0 "[ . 1 . 2]" 1
897 1 36 ILE HA 1 36 ILE MD . . 3.860 3.823 3.808 3.862 0.002 12 0 "[ . 1 . 2]" 1
898 1 36 ILE HA 1 36 ILE HG12 . . 3.470 2.525 2.502 2.599 . 0 0 "[ . 1 . 2]" 1
899 1 36 ILE HA 1 36 ILE HG13 . . 3.340 3.063 2.963 3.114 . 0 0 "[ . 1 . 2]" 1
900 1 36 ILE HA 1 36 ILE MG . . 2.650 2.376 2.312 2.454 . 0 0 "[ . 1 . 2]" 1
901 1 36 ILE HA 1 37 VAL H . . 2.550 2.143 2.139 2.150 . 0 0 "[ . 1 . 2]" 1
902 1 36 ILE HA 1 37 VAL MG1 . . 4.160 3.982 3.888 4.101 . 0 0 "[ . 1 . 2]" 1
903 1 36 ILE HA 1 37 VAL MG2 . . 3.700 3.654 3.560 3.699 . 0 0 "[ . 1 . 2]" 1
904 1 36 ILE HA 1 38 THR H . . 3.790 3.670 3.592 3.763 . 0 0 "[ . 1 . 2]" 1
905 1 36 ILE HA 1 53 VAL HA . . 5.460 5.389 5.255 5.462 0.002 17 0 "[ . 1 . 2]" 1
906 1 36 ILE HA 1 57 ILE MD . . 4.830 4.316 4.161 4.503 . 0 0 "[ . 1 . 2]" 1
907 1 36 ILE HB 1 36 ILE MD . . 2.830 2.384 2.272 2.493 . 0 0 "[ . 1 . 2]" 1
908 1 36 ILE HB 1 39 ILE MD . . 4.420 3.895 3.526 4.295 . 0 0 "[ . 1 . 2]" 1
909 1 36 ILE HB 1 53 VAL HA . . 3.560 3.282 3.152 3.436 . 0 0 "[ . 1 . 2]" 1
910 1 36 ILE HB 1 54 GLY H . . 3.170 2.130 1.993 2.431 . 0 0 "[ . 1 . 2]" 1
911 1 36 ILE HB 1 55 HIS H . . 3.070 2.365 2.114 2.560 . 0 0 "[ . 1 . 2]" 1
912 1 36 ILE HB 1 55 HIS HB2 . . 3.750 3.011 2.853 3.152 . 0 0 "[ . 1 . 2]" 1
913 1 36 ILE HB 1 55 HIS HB3 . . 4.520 4.414 4.217 4.522 0.002 8 0 "[ . 1 . 2]" 1
914 1 36 ILE MD 1 51 LEU HA . . 4.940 4.862 4.524 4.944 0.004 7 0 "[ . 1 . 2]" 1
915 1 36 ILE MD 1 51 LEU HB2 . . 4.840 4.353 3.599 4.768 . 0 0 "[ . 1 . 2]" 1
916 1 36 ILE MD 1 51 LEU HB3 . . 3.560 3.215 2.668 3.495 . 0 0 "[ . 1 . 2]" 1
917 1 36 ILE MD 1 51 LEU MD1 . . 4.080 3.253 3.010 3.606 . 0 0 "[ . 1 . 2]" 1
918 1 36 ILE MD 1 51 LEU QD . . 3.360 2.720 2.373 3.181 . 0 0 "[ . 1 . 2]" 1
919 1 36 ILE MD 1 51 LEU MD2 . . 4.080 2.981 2.445 4.086 0.006 14 0 "[ . 1 . 2]" 1
920 1 36 ILE MD 1 52 LYS H . . 3.920 3.689 3.419 3.925 0.005 5 0 "[ . 1 . 2]" 1
921 1 36 ILE MD 1 53 VAL HA . . 4.180 3.833 3.645 4.155 . 0 0 "[ . 1 . 2]" 1
922 1 36 ILE MD 1 55 HIS H . . 3.550 3.216 2.928 3.384 . 0 0 "[ . 1 . 2]" 1
923 1 36 ILE MD 1 55 HIS HA . . 5.150 4.536 4.309 4.658 . 0 0 "[ . 1 . 2]" 1
924 1 36 ILE MD 1 55 HIS HB2 . . 2.950 2.075 1.897 2.209 . 0 0 "[ . 1 . 2]" 1
925 1 36 ILE MD 1 55 HIS HB3 . . 3.140 2.930 2.562 3.143 0.003 1 0 "[ . 1 . 2]" 1
926 1 36 ILE MD 1 56 VAL H . . 5.110 4.474 4.199 4.720 . 0 0 "[ . 1 . 2]" 1
927 1 36 ILE MD 1 56 VAL HA . . 5.500 4.737 4.561 4.901 . 0 0 "[ . 1 . 2]" 1
928 1 36 ILE MD 1 57 ILE MD . . 3.920 2.945 2.480 3.116 . 0 0 "[ . 1 . 2]" 1
929 1 36 ILE MD 1 57 ILE QG . . 3.930 2.942 2.748 3.112 . 0 0 "[ . 1 . 2]" 1
930 1 36 ILE MD 1 91 PHE QD . . 5.020 4.724 4.491 4.949 . 0 0 "[ . 1 . 2]" 1
931 1 36 ILE MD 1 93 VAL HB . . 5.500 4.718 4.354 5.073 . 0 0 "[ . 1 . 2]" 1
932 1 36 ILE HG12 1 55 HIS HB2 . . 4.710 4.403 4.249 4.615 . 0 0 "[ . 1 . 2]" 1
933 1 36 ILE HG12 1 57 ILE MD . . 3.950 2.620 2.440 2.832 . 0 0 "[ . 1 . 2]" 1
934 1 36 ILE HG13 1 36 ILE MG . . 3.200 3.189 3.182 3.201 0.001 8 0 "[ . 1 . 2]" 1
935 1 36 ILE HG13 1 51 LEU QD . . 5.440 4.808 4.425 5.265 . 0 0 "[ . 1 . 2]" 1
936 1 36 ILE HG13 1 54 GLY H . . 5.230 4.517 4.372 4.794 . 0 0 "[ . 1 . 2]" 1
937 1 36 ILE HG13 1 55 HIS H . . 4.630 3.973 3.681 4.184 . 0 0 "[ . 1 . 2]" 1
938 1 36 ILE HG13 1 55 HIS HB2 . . 4.370 3.195 3.034 3.373 . 0 0 "[ . 1 . 2]" 1
939 1 36 ILE HG13 1 57 ILE MD . . 3.300 3.091 2.929 3.229 . 0 0 "[ . 1 . 2]" 1
940 1 36 ILE HG13 1 57 ILE QG . . 4.390 2.900 2.738 3.084 . 0 0 "[ . 1 . 2]" 1
941 1 36 ILE MG 1 37 VAL H . . 2.830 2.654 2.394 2.835 0.005 7 0 "[ . 1 . 2]" 1
942 1 36 ILE MG 1 37 VAL HA . . 4.270 3.846 3.713 4.015 . 0 0 "[ . 1 . 2]" 1
943 1 36 ILE MG 1 38 THR H . . 2.870 2.581 2.476 2.781 . 0 0 "[ . 1 . 2]" 1
944 1 36 ILE MG 1 38 THR HA . . 4.340 3.834 3.776 3.924 . 0 0 "[ . 1 . 2]" 1
945 1 36 ILE MG 1 39 ILE H . . 4.710 4.103 4.014 4.243 . 0 0 "[ . 1 . 2]" 1
946 1 36 ILE MG 1 39 ILE HA . . 4.560 3.680 3.567 3.832 . 0 0 "[ . 1 . 2]" 1
947 1 36 ILE MG 1 39 ILE MD . . 2.910 2.271 2.002 2.622 . 0 0 "[ . 1 . 2]" 1
948 1 36 ILE MG 1 39 ILE HG13 . . 2.710 2.196 2.024 2.473 . 0 0 "[ . 1 . 2]" 1
949 1 36 ILE MG 1 53 VAL HA . . 2.660 2.169 2.001 2.500 . 0 0 "[ . 1 . 2]" 1
950 1 36 ILE MG 1 53 VAL HB . . 4.880 4.712 4.605 4.879 . 0 0 "[ . 1 . 2]" 1
951 1 36 ILE MG 1 54 GLY H . . 4.150 2.696 2.542 2.921 . 0 0 "[ . 1 . 2]" 1
952 1 36 ILE MG 1 54 GLY HA2 . . 4.850 4.600 4.460 4.856 0.006 14 0 "[ . 1 . 2]" 1
953 1 36 ILE MG 1 55 HIS H . . 3.890 3.578 3.357 3.762 . 0 0 "[ . 1 . 2]" 1
954 1 36 ILE MG 1 55 HIS HB2 . . 4.080 3.940 3.810 4.030 . 0 0 "[ . 1 . 2]" 1
955 1 37 VAL H 1 37 VAL HB . . 3.710 3.666 3.641 3.705 . 0 0 "[ . 1 . 2]" 1
956 1 37 VAL H 1 37 VAL MG1 . . 3.760 2.827 2.654 2.934 . 0 0 "[ . 1 . 2]" 1
957 1 37 VAL H 1 37 VAL MG2 . . 2.640 1.974 1.874 2.064 . 0 0 "[ . 1 . 2]" 1
958 1 37 VAL H 1 38 THR H . . 2.490 2.093 1.968 2.215 . 0 0 "[ . 1 . 2]" 1
959 1 37 VAL H 1 38 THR HB . . 4.850 4.699 4.584 4.819 . 0 0 "[ . 1 . 2]" 1
960 1 37 VAL HA 1 37 VAL HB . . 2.650 2.526 2.495 2.545 . 0 0 "[ . 1 . 2]" 1
961 1 37 VAL HA 1 37 VAL MG1 . . 3.240 2.302 2.238 2.340 . 0 0 "[ . 1 . 2]" 1
962 1 37 VAL HA 1 37 VAL MG2 . . 3.190 3.186 3.179 3.197 0.007 8 0 "[ . 1 . 2]" 1
963 1 37 VAL HA 1 38 THR H . . 3.520 3.495 3.480 3.511 . 0 0 "[ . 1 . 2]" 1
964 1 37 VAL HB 1 38 THR H . . 3.800 3.741 3.661 3.800 0.000 14 0 "[ . 1 . 2]" 1
965 1 37 VAL HB 1 38 THR HA . . 4.880 4.800 4.739 4.870 . 0 0 "[ . 1 . 2]" 1
966 1 37 VAL MG1 1 38 THR H . . 4.080 4.068 4.011 4.090 0.010 1 0 "[ . 1 . 2]" 1
967 1 37 VAL MG2 1 38 THR H . . 2.860 1.956 1.890 2.226 . 0 0 "[ . 1 . 2]" 1
968 1 37 VAL MG2 1 38 THR HA . . 4.110 4.061 3.917 4.115 0.005 14 0 "[ . 1 . 2]" 1
969 1 37 VAL MG2 1 38 THR HB . . 3.400 2.983 2.837 3.094 . 0 0 "[ . 1 . 2]" 1
970 1 37 VAL MG2 1 70 HIS HE1 . . 5.260 4.574 4.332 4.809 . 0 0 "[ . 1 . 2]" 1
971 1 38 THR H 1 38 THR HB . . 3.060 2.848 2.798 2.898 . 0 0 "[ . 1 . 2]" 1
972 1 38 THR H 1 38 THR MG . . 3.960 3.901 3.852 3.938 . 0 0 "[ . 1 . 2]" 1
973 1 38 THR H 1 39 ILE H . . 4.370 4.280 4.229 4.316 . 0 0 "[ . 1 . 2]" 1
974 1 38 THR H 1 39 ILE HA . . 5.270 4.691 4.618 4.729 . 0 0 "[ . 1 . 2]" 1
975 1 38 THR HA 1 38 THR HB . . 3.020 3.022 3.015 3.025 0.005 10 0 "[ . 1 . 2]" 1
976 1 38 THR HA 1 38 THR MG . . 2.640 2.413 2.287 2.489 . 0 0 "[ . 1 . 2]" 1
977 1 38 THR HA 1 39 ILE H . . 2.400 2.192 2.172 2.222 . 0 0 "[ . 1 . 2]" 1
978 1 38 THR HA 1 39 ILE HB . . 4.600 4.558 4.495 4.602 0.002 9 0 "[ . 1 . 2]" 1
979 1 38 THR HA 1 39 ILE HG13 . . 4.520 3.687 3.608 3.813 . 0 0 "[ . 1 . 2]" 1
980 1 38 THR HA 1 53 VAL MG1 . . 3.670 2.714 2.187 3.354 . 0 0 "[ . 1 . 2]" 1
981 1 38 THR HA 1 53 VAL MG2 . . 2.970 2.716 2.375 2.971 0.001 1 0 "[ . 1 . 2]" 1
982 1 38 THR HB 1 39 ILE H . . 4.150 4.101 4.024 4.152 0.002 15 0 "[ . 1 . 2]" 1
983 1 38 THR MG 1 39 ILE H . . 2.810 2.219 1.979 2.490 . 0 0 "[ . 1 . 2]" 1
984 1 38 THR MG 1 39 ILE HB . . 4.510 4.370 4.176 4.478 . 0 0 "[ . 1 . 2]" 1
985 1 38 THR MG 1 40 GLN H . . 3.850 3.351 3.208 3.620 . 0 0 "[ . 1 . 2]" 1
986 1 38 THR MG 1 40 GLN HA . . 3.740 3.563 3.409 3.677 . 0 0 "[ . 1 . 2]" 1
987 1 38 THR MG 1 40 GLN HB3 . . 5.400 5.219 4.992 5.373 . 0 0 "[ . 1 . 2]" 1
988 1 38 THR MG 1 40 GLN QE . . 5.140 4.235 1.939 4.893 . 0 0 "[ . 1 . 2]" 1
989 1 38 THR MG 1 40 GLN HG2 . . 4.430 3.456 2.826 4.430 0.000 9 0 "[ . 1 . 2]" 1
990 1 38 THR MG 1 40 GLN QG . . 3.750 3.137 2.787 3.450 . 0 0 "[ . 1 . 2]" 1
991 1 38 THR MG 1 40 GLN HG3 . . 4.430 3.973 2.995 4.439 0.009 16 0 "[ . 1 . 2]" 1
992 1 39 ILE H 1 39 ILE HB . . 2.850 2.624 2.563 2.664 . 0 0 "[ . 1 . 2]" 1
993 1 39 ILE H 1 39 ILE MD . . 4.100 4.039 3.793 4.101 0.001 9 0 "[ . 1 . 2]" 1
994 1 39 ILE H 1 39 ILE HG12 . . 4.920 3.987 3.829 4.121 . 0 0 "[ . 1 . 2]" 1
995 1 39 ILE H 1 39 ILE HG13 . . 3.350 2.861 2.728 2.992 . 0 0 "[ . 1 . 2]" 1
996 1 39 ILE H 1 53 VAL MG2 . . 3.030 2.475 2.148 2.776 . 0 0 "[ . 1 . 2]" 1
997 1 39 ILE HA 1 39 ILE HG12 . . 3.290 2.525 2.484 2.635 . 0 0 "[ . 1 . 2]" 1
998 1 39 ILE HA 1 39 ILE HG13 . . 3.240 2.987 2.869 3.118 . 0 0 "[ . 1 . 2]" 1
999 1 39 ILE HA 1 39 ILE MG . . 2.800 2.421 2.336 2.464 . 0 0 "[ . 1 . 2]" 1
1000 1 39 ILE HA 1 40 GLN H . . 2.470 2.188 2.160 2.211 . 0 0 "[ . 1 . 2]" 1
1001 1 39 ILE HA 1 40 GLN HA . . 4.460 4.463 4.434 4.484 0.024 13 0 "[ . 1 . 2]" 1
1002 1 39 ILE HA 1 40 GLN HB2 . . 4.630 4.484 4.352 4.644 0.014 4 0 "[ . 1 . 2]" 1
1003 1 39 ILE HA 1 45 ALA MB . . 4.870 4.286 3.904 4.642 . 0 0 "[ . 1 . 2]" 1
1004 1 39 ILE HB 1 39 ILE MD . . 2.800 2.336 2.230 2.400 . 0 0 "[ . 1 . 2]" 1
1005 1 39 ILE HB 1 39 ILE HG13 . . 3.000 2.479 2.432 2.548 . 0 0 "[ . 1 . 2]" 1
1006 1 39 ILE HB 1 46 HIS HA . . 5.250 4.877 4.253 5.239 . 0 0 "[ . 1 . 2]" 1
1007 1 39 ILE HB 1 53 VAL MG2 . . 3.240 2.586 2.232 3.054 . 0 0 "[ . 1 . 2]" 1
1008 1 39 ILE MD 1 39 ILE MG . . 2.930 2.126 1.992 2.304 . 0 0 "[ . 1 . 2]" 1
1009 1 39 ILE MD 1 45 ALA MB . . 3.690 3.226 2.884 3.568 . 0 0 "[ . 1 . 2]" 1
1010 1 39 ILE MD 1 46 HIS HA . . 4.500 4.133 3.651 4.441 . 0 0 "[ . 1 . 2]" 1
1011 1 39 ILE MD 1 51 LEU HA . . 4.870 4.755 4.466 4.874 0.004 20 0 "[ . 1 . 2]" 1
1012 1 39 ILE MD 1 51 LEU HB2 . . 3.540 3.321 2.699 3.538 . 0 0 "[ . 1 . 2]" 1
1013 1 39 ILE MD 1 52 LYS H . . 3.890 3.370 3.083 3.586 . 0 0 "[ . 1 . 2]" 1
1014 1 39 ILE MD 1 52 LYS HA . . 3.190 2.775 2.426 3.047 . 0 0 "[ . 1 . 2]" 1
1015 1 39 ILE MD 1 53 VAL H . . 3.160 2.865 2.515 3.155 . 0 0 "[ . 1 . 2]" 1
1016 1 39 ILE MD 1 53 VAL HA . . 3.550 2.357 2.119 2.702 . 0 0 "[ . 1 . 2]" 1
1017 1 39 ILE MD 1 53 VAL HB . . 4.240 4.093 3.858 4.238 . 0 0 "[ . 1 . 2]" 1
1018 1 39 ILE MD 1 53 VAL MG2 . . 2.910 2.050 1.890 2.274 . 0 0 "[ . 1 . 2]" 1
1019 1 39 ILE MD 1 54 GLY H . . 4.380 3.866 3.491 4.379 . 0 0 "[ . 1 . 2]" 1
1020 1 39 ILE MD 1 55 HIS H . . 5.200 4.345 3.879 4.779 . 0 0 "[ . 1 . 2]" 1
1021 1 39 ILE MD 1 55 HIS HE1 . . 5.460 5.435 5.307 5.464 0.004 15 0 "[ . 1 . 2]" 1
1022 1 39 ILE HG12 1 40 GLN H . . 5.500 4.647 4.589 4.751 . 0 0 "[ . 1 . 2]" 1
1023 1 39 ILE HG13 1 53 VAL HA . . 4.900 2.923 2.549 3.264 . 0 0 "[ . 1 . 2]" 1
1024 1 39 ILE HG13 1 53 VAL HB . . 5.380 4.771 4.356 5.143 . 0 0 "[ . 1 . 2]" 1
1025 1 39 ILE HG13 1 53 VAL MG2 . . 2.870 2.221 1.850 2.515 . 0 0 "[ . 1 . 2]" 1
1026 1 39 ILE MG 1 40 GLN H . . 3.210 3.103 2.958 3.208 . 0 0 "[ . 1 . 2]" 1
1027 1 39 ILE MG 1 40 GLN HA . . 4.350 4.302 4.229 4.351 0.001 1 0 "[ . 1 . 2]" 1
1028 1 39 ILE MG 1 41 ARG HA . . 4.370 4.106 3.862 4.302 . 0 0 "[ . 1 . 2]" 1
1029 1 39 ILE MG 1 45 ALA H . . 4.850 4.461 4.138 4.846 . 0 0 "[ . 1 . 2]" 1
1030 1 39 ILE MG 1 45 ALA MB . . 2.660 2.207 1.870 2.660 0.000 15 0 "[ . 1 . 2]" 1
1031 1 39 ILE MG 1 46 HIS H . . 3.370 2.912 2.303 3.264 . 0 0 "[ . 1 . 2]" 1
1032 1 39 ILE MG 1 46 HIS HA . . 3.130 2.691 2.142 3.061 . 0 0 "[ . 1 . 2]" 1
1033 1 39 ILE MG 1 46 HIS QB . . 3.580 2.320 1.842 2.875 . 0 0 "[ . 1 . 2]" 1
1034 1 39 ILE MG 1 46 HIS HD2 . . 4.250 3.893 3.178 4.248 . 0 0 "[ . 1 . 2]" 1
1035 1 39 ILE MG 1 51 LEU HB2 . . 5.130 4.309 3.931 4.551 . 0 0 "[ . 1 . 2]" 1
1036 1 40 GLN H 1 40 GLN HB2 . . 3.060 2.490 2.332 2.681 . 0 0 "[ . 1 . 2]" 1
1037 1 40 GLN H 1 40 GLN HB3 . . 3.590 3.584 3.561 3.603 0.013 3 0 "[ . 1 . 2]" 1
1038 1 40 GLN H 1 40 GLN HG2 . . 3.640 2.957 2.340 3.713 0.073 9 0 "[ . 1 . 2]" 1
1039 1 40 GLN H 1 40 GLN HG3 . . 3.640 2.704 2.076 3.462 . 0 0 "[ . 1 . 2]" 1
1040 1 40 GLN H 1 46 HIS QB . . 5.340 4.986 4.483 5.332 . 0 0 "[ . 1 . 2]" 1
1041 1 40 GLN HA 1 40 GLN HG2 . . 3.740 2.575 2.267 3.655 . 0 0 "[ . 1 . 2]" 1
1042 1 40 GLN HA 1 40 GLN QG . . 3.240 2.402 2.225 2.643 . 0 0 "[ . 1 . 2]" 1
1043 1 40 GLN HA 1 40 GLN HG3 . . 3.740 3.317 2.454 3.743 0.003 16 0 "[ . 1 . 2]" 1
1044 1 40 GLN HA 1 41 ARG HA . . 5.310 4.335 4.314 4.373 . 0 0 "[ . 1 . 2]" 1
1045 1 40 GLN HA 1 41 ARG QB . . 5.230 4.178 4.014 4.456 . 0 0 "[ . 1 . 2]" 1
1046 1 41 ARG HA 1 41 ARG HG2 . . 3.890 3.001 2.225 3.762 . 0 0 "[ . 1 . 2]" 1
1047 1 41 ARG HA 1 41 ARG QG . . 3.290 2.359 2.151 2.637 . 0 0 "[ . 1 . 2]" 1
1048 1 41 ARG HA 1 41 ARG HG3 . . 3.890 2.641 2.171 3.628 . 0 0 "[ . 1 . 2]" 1
1049 1 41 ARG HA 1 42 GLY QA . . 4.410 4.300 3.917 4.418 0.008 9 0 "[ . 1 . 2]" 1
1050 1 41 ARG QB 1 41 ARG QD . . 2.710 2.211 2.073 2.523 . 0 0 "[ . 1 . 2]" 1
1051 1 41 ARG QB 1 42 GLY QA . . 5.340 3.664 3.454 4.157 . 0 0 "[ . 1 . 2]" 1
1052 1 41 ARG QB 1 46 HIS HE1 . . 4.780 4.022 2.991 4.743 . 0 0 "[ . 1 . 2]" 1
1053 1 41 ARG QD 1 41 ARG HG2 . . 2.650 2.287 2.154 2.440 . 0 0 "[ . 1 . 2]" 1
1054 1 41 ARG QD 1 41 ARG HG3 . . 2.650 2.333 2.167 2.477 . 0 0 "[ . 1 . 2]" 1
1055 1 41 ARG QD 1 46 HIS HE1 . . 4.900 4.024 2.069 4.900 0.000 7 0 "[ . 1 . 2]" 1
1056 1 41 ARG QG 1 46 HIS HE1 . . 3.590 2.573 2.011 3.056 . 0 0 "[ . 1 . 2]" 1
1057 1 41 ARG HG2 1 46 HIS HE1 . . 4.410 3.303 2.543 4.409 . 0 0 "[ . 1 . 2]" 1
1058 1 41 ARG HG3 1 46 HIS HE1 . . 4.410 3.134 2.029 4.352 . 0 0 "[ . 1 . 2]" 1
1059 1 42 GLY H 1 43 GLY H . . 3.790 3.245 1.911 3.677 . 0 0 "[ . 1 . 2]" 1
1060 1 43 GLY H 1 43 GLY HA3 . . 2.920 2.507 2.294 2.666 . 0 0 "[ . 1 . 2]" 1
1061 1 43 GLY H 1 44 SER H . . 5.160 4.453 4.267 4.622 . 0 0 "[ . 1 . 2]" 1
1062 1 43 GLY H 1 46 HIS H . . 4.610 3.922 3.493 4.456 . 0 0 "[ . 1 . 2]" 1
1063 1 43 GLY H 1 46 HIS QB . . 3.680 2.828 2.087 3.631 . 0 0 "[ . 1 . 2]" 1
1064 1 43 GLY HA2 1 44 SER H . . 2.950 2.334 2.155 2.815 . 0 0 "[ . 1 . 2]" 1
1065 1 43 GLY HA3 1 44 SER H . . 3.140 2.855 2.338 3.140 . 20 0 "[ . 1 . 2]" 1
1066 1 43 GLY HA3 1 45 ALA H . . 3.990 3.433 2.977 3.893 . 0 0 "[ . 1 . 2]" 1
1067 1 44 SER H 1 44 SER QB . . 3.110 2.493 2.224 2.718 . 0 0 "[ . 1 . 2]" 1
1068 1 44 SER H 1 44 SER HG . . 3.560 2.474 1.954 3.379 . 0 0 "[ . 1 . 2]" 1
1069 1 44 SER H 1 81 PHE QE . . 5.300 4.841 4.107 5.302 0.002 15 0 "[ . 1 . 2]" 1
1070 1 44 SER HA 1 44 SER HG . . 3.900 3.566 3.238 3.855 . 0 0 "[ . 1 . 2]" 1
1071 1 44 SER HA 1 47 ASN H . . 4.180 3.795 3.204 4.179 . 0 0 "[ . 1 . 2]" 1
1072 1 44 SER HA 1 47 ASN QB . . 4.040 2.764 2.303 4.046 0.006 20 0 "[ . 1 . 2]" 1
1073 1 44 SER HA 1 47 ASN HD21 . . 5.290 3.260 2.063 4.473 . 0 0 "[ . 1 . 2]" 1
1074 1 44 SER HA 1 47 ASN QD . . 4.600 3.075 1.899 4.195 . 0 0 "[ . 1 . 2]" 1
1075 1 44 SER HA 1 47 ASN HD22 . . 5.290 4.281 1.908 5.103 . 0 0 "[ . 1 . 2]" 1
1076 1 44 SER HA 1 48 CYS H . . 5.170 4.164 3.164 4.942 . 0 0 "[ . 1 . 2]" 1
1077 1 44 SER QB 1 45 ALA H . . 4.010 3.297 2.269 3.696 . 0 0 "[ . 1 . 2]" 1
1078 1 44 SER QB 1 81 PHE QE . . 4.530 3.069 2.363 3.652 . 0 0 "[ . 1 . 2]" 1
1079 1 44 SER HG 1 45 ALA H . . 4.340 2.925 2.011 4.324 . 0 0 "[ . 1 . 2]" 1
1080 1 45 ALA H 1 45 ALA MB . . 2.660 2.130 2.027 2.241 . 0 0 "[ . 1 . 2]" 1
1081 1 45 ALA H 1 46 HIS H . . 3.220 2.845 2.521 3.110 . 0 0 "[ . 1 . 2]" 1
1082 1 45 ALA H 1 46 HIS HB2 . . 5.500 5.172 4.547 5.491 . 0 0 "[ . 1 . 2]" 1
1083 1 45 ALA H 1 46 HIS HB3 . . 5.500 5.065 4.697 5.388 . 0 0 "[ . 1 . 2]" 1
1084 1 45 ALA H 1 47 ASN H . . 4.790 4.401 4.056 4.695 . 0 0 "[ . 1 . 2]" 1
1085 1 45 ALA HA 1 48 CYS H . . 4.390 3.989 3.490 4.387 . 0 0 "[ . 1 . 2]" 1
1086 1 45 ALA HA 1 48 CYS QB . . 4.190 3.506 2.912 4.186 . 0 0 "[ . 1 . 2]" 1
1087 1 45 ALA HA 1 51 LEU QD . . 3.510 2.659 2.254 2.988 . 0 0 "[ . 1 . 2]" 1
1088 1 45 ALA MB 1 46 HIS H . . 3.280 2.440 2.016 2.762 . 0 0 "[ . 1 . 2]" 1
1089 1 45 ALA MB 1 46 HIS HA . . 3.840 3.717 3.615 3.843 0.003 6 0 "[ . 1 . 2]" 1
1090 1 45 ALA MB 1 46 HIS HB2 . . 5.500 3.965 3.616 4.261 . 0 0 "[ . 1 . 2]" 1
1091 1 45 ALA MB 1 46 HIS QB . . 4.620 3.736 3.493 3.971 . 0 0 "[ . 1 . 2]" 1
1092 1 45 ALA MB 1 46 HIS HB3 . . 5.500 4.598 4.368 5.024 . 0 0 "[ . 1 . 2]" 1
1093 1 45 ALA MB 1 51 LEU QD . . 3.310 2.512 2.043 3.137 . 0 0 "[ . 1 . 2]" 1
1094 1 46 HIS H 1 46 HIS HB2 . . 3.400 2.468 2.212 2.730 . 0 0 "[ . 1 . 2]" 1
1095 1 46 HIS H 1 46 HIS QB . . 2.880 2.236 2.153 2.297 . 0 0 "[ . 1 . 2]" 1
1096 1 46 HIS H 1 46 HIS HB3 . . 3.400 2.631 2.402 2.959 . 0 0 "[ . 1 . 2]" 1
1097 1 46 HIS H 1 47 ASN H . . 3.260 2.868 2.541 3.129 . 0 0 "[ . 1 . 2]" 1
1098 1 46 HIS HA 1 46 HIS HD2 . . 3.530 2.604 2.251 3.055 . 0 0 "[ . 1 . 2]" 1
1099 1 46 HIS HA 1 48 CYS H . . 5.100 4.496 3.897 5.092 . 0 0 "[ . 1 . 2]" 1
1100 1 46 HIS QB 1 47 ASN H . . 3.780 2.350 2.042 3.780 0.000 9 0 "[ . 1 . 2]" 1
1101 1 46 HIS HD2 1 47 ASN HA . . 5.460 4.962 3.934 5.460 0.000 3 0 "[ . 1 . 2]" 1
1102 1 47 ASN H 1 47 ASN HB2 . . 3.620 2.513 2.188 3.583 . 0 0 "[ . 1 . 2]" 1
1103 1 47 ASN H 1 47 ASN HB3 . . 3.620 3.416 2.822 3.619 . 0 0 "[ . 1 . 2]" 1
1104 1 47 ASN H 1 48 CYS H . . 3.240 2.954 1.915 3.241 0.001 20 0 "[ . 1 . 2]" 1
1105 1 47 ASN HA 1 47 ASN HD22 . . 5.500 4.511 4.089 5.278 . 0 0 "[ . 1 . 2]" 1
1106 1 47 ASN QB 1 47 ASN QD . . 3.100 2.132 2.064 2.220 . 0 0 "[ . 1 . 2]" 1
1107 1 47 ASN HB2 1 47 ASN HD22 . . 3.980 3.569 3.433 3.789 . 0 0 "[ . 1 . 2]" 1
1108 1 47 ASN HB2 1 48 CYS H . . 3.740 2.745 2.156 3.736 . 0 0 "[ . 1 . 2]" 1
1109 1 47 ASN HB3 1 47 ASN HD22 . . 3.980 3.716 3.475 3.953 . 0 0 "[ . 1 . 2]" 1
1110 1 47 ASN HB3 1 48 CYS H . . 3.740 3.188 2.322 3.737 . 0 0 "[ . 1 . 2]" 1
1111 1 48 CYS H 1 48 CYS HB2 . . 3.610 2.511 2.191 3.596 . 0 0 "[ . 1 . 2]" 1
1112 1 48 CYS H 1 48 CYS QB . . 2.880 2.256 2.135 2.425 . 0 0 "[ . 1 . 2]" 1
1113 1 48 CYS H 1 48 CYS HB3 . . 3.610 3.009 2.373 3.594 . 0 0 "[ . 1 . 2]" 1
1114 1 48 CYS QB 1 49 GLY H . . 4.210 2.972 2.199 4.021 . 0 0 "[ . 1 . 2]" 1
1115 1 50 GLN HA 1 50 GLN QE . . 5.300 4.123 2.915 4.791 . 0 0 "[ . 1 . 2]" 1
1116 1 50 GLN HA 1 50 GLN HG2 . . 3.730 3.044 2.170 3.743 0.013 2 0 "[ . 1 . 2]" 1
1117 1 50 GLN HA 1 50 GLN QG . . 3.050 2.433 2.130 2.847 . 0 0 "[ . 1 . 2]" 1
1118 1 50 GLN HA 1 50 GLN HG3 . . 3.730 2.828 2.200 3.735 0.005 12 0 "[ . 1 . 2]" 1
1119 1 50 GLN QB 1 51 LEU QD . . 5.280 3.558 2.136 4.484 . 0 0 "[ . 1 . 2]" 1
1120 1 51 LEU HA 1 51 LEU MD1 . . 3.920 3.803 2.082 3.928 0.008 3 0 "[ . 1 . 2]" 1
1121 1 51 LEU HA 1 51 LEU QD . . 2.750 2.285 2.013 2.516 . 0 0 "[ . 1 . 2]" 1
1122 1 51 LEU HA 1 51 LEU MD2 . . 3.920 2.358 2.019 3.193 . 0 0 "[ . 1 . 2]" 1
1123 1 51 LEU HA 1 51 LEU HG . . 3.750 2.894 2.579 3.719 . 0 0 "[ . 1 . 2]" 1
1124 1 51 LEU HA 1 52 LYS H . . 2.840 2.438 2.352 2.528 . 0 0 "[ . 1 . 2]" 1
1125 1 51 LEU HA 1 52 LYS QB . . 5.340 4.254 4.048 4.532 . 0 0 "[ . 1 . 2]" 1
1126 1 51 LEU HA 1 52 LYS QG . . 4.790 3.601 3.147 4.498 . 0 0 "[ . 1 . 2]" 1
1127 1 51 LEU HA 1 55 HIS HE1 . . 2.680 2.191 1.995 2.460 . 0 0 "[ . 1 . 2]" 1
1128 1 51 LEU HB2 1 51 LEU QD . . 2.880 2.185 2.088 2.316 . 0 0 "[ . 1 . 2]" 1
1129 1 51 LEU HB2 1 52 LYS H . . 3.700 3.588 3.362 3.696 . 0 0 "[ . 1 . 2]" 1
1130 1 51 LEU HB2 1 55 HIS HE1 . . 5.120 4.984 4.769 5.112 . 0 0 "[ . 1 . 2]" 1
1131 1 51 LEU HB3 1 51 LEU MD1 . . 3.260 2.522 2.290 2.636 . 0 0 "[ . 1 . 2]" 1
1132 1 51 LEU HB3 1 51 LEU MD2 . . 3.260 2.253 2.032 3.162 . 0 0 "[ . 1 . 2]" 1
1133 1 51 LEU HB3 1 52 LYS H . . 2.700 2.334 2.153 2.533 . 0 0 "[ . 1 . 2]" 1
1134 1 51 LEU HB3 1 55 HIS HE1 . . 4.150 3.971 3.667 4.153 0.003 15 0 "[ . 1 . 2]" 1
1135 1 51 LEU QD 1 52 LYS H . . 3.340 3.093 2.647 3.308 . 0 0 "[ . 1 . 2]" 1
1136 1 51 LEU QD 1 55 HIS HB2 . . 4.060 3.618 3.218 3.936 . 0 0 "[ . 1 . 2]" 1
1137 1 51 LEU QD 1 55 HIS HB3 . . 4.170 3.726 3.292 4.066 . 0 0 "[ . 1 . 2]" 1
1138 1 51 LEU QD 1 55 HIS HE1 . . 3.560 3.206 2.909 3.371 . 0 0 "[ . 1 . 2]" 1
1139 1 51 LEU QD 1 91 PHE HB2 . . 3.470 2.713 2.507 2.973 . 0 0 "[ . 1 . 2]" 1
1140 1 51 LEU QD 1 91 PHE HB3 . . 3.730 2.852 2.541 3.039 . 0 0 "[ . 1 . 2]" 1
1141 1 51 LEU QD 1 91 PHE QD . . 3.570 2.965 2.601 3.414 . 0 0 "[ . 1 . 2]" 1
1142 1 51 LEU QD 1 91 PHE QE . . 4.550 3.994 3.755 4.300 . 0 0 "[ . 1 . 2]" 1
1143 1 51 LEU QD 1 93 VAL H . . 5.230 4.508 4.086 4.702 . 0 0 "[ . 1 . 2]" 1
1144 1 51 LEU QD 1 93 VAL MG2 . . 3.150 2.533 2.282 2.726 . 0 0 "[ . 1 . 2]" 1
1145 1 51 LEU MD1 1 52 LYS H . . 4.660 4.440 3.383 4.644 . 0 0 "[ . 1 . 2]" 1
1146 1 51 LEU MD1 1 91 PHE HB2 . . 4.370 3.006 2.668 3.278 . 0 0 "[ . 1 . 2]" 1
1147 1 51 LEU MD1 1 91 PHE QD . . 4.120 3.080 2.632 4.113 . 0 0 "[ . 1 . 2]" 1
1148 1 51 LEU MD1 1 91 PHE QE . . 5.460 4.164 3.828 5.466 0.006 14 0 "[ . 1 . 2]" 1
1149 1 51 LEU MD2 1 52 LYS H . . 4.660 3.217 2.669 4.671 0.011 14 0 "[ . 1 . 2]" 1
1150 1 51 LEU MD2 1 91 PHE HB2 . . 4.370 3.116 2.909 3.788 . 0 0 "[ . 1 . 2]" 1
1151 1 51 LEU MD2 1 91 PHE QD . . 4.120 4.024 3.647 4.123 0.003 11 0 "[ . 1 . 2]" 1
1152 1 51 LEU MD2 1 91 PHE QE . . 5.460 5.364 4.499 5.462 0.002 3 0 "[ . 1 . 2]" 1
1153 1 51 LEU HG 1 55 HIS HE1 . . 5.500 4.892 4.573 5.488 . 0 0 "[ . 1 . 2]" 1
1154 1 52 LYS H 1 52 LYS HB2 . . 4.020 2.851 2.654 3.020 . 0 0 "[ . 1 . 2]" 1
1155 1 52 LYS H 1 52 LYS QB . . 3.380 2.782 2.603 2.928 . 0 0 "[ . 1 . 2]" 1
1156 1 52 LYS H 1 52 LYS HB3 . . 4.020 3.883 3.763 3.944 . 0 0 "[ . 1 . 2]" 1
1157 1 52 LYS H 1 52 LYS QG . . 3.890 3.252 2.831 3.854 . 0 0 "[ . 1 . 2]" 1
1158 1 52 LYS H 1 55 HIS HB2 . . 3.990 3.704 3.251 3.941 . 0 0 "[ . 1 . 2]" 1
1159 1 52 LYS H 1 55 HIS HE1 . . 2.940 2.509 2.184 2.917 . 0 0 "[ . 1 . 2]" 1
1160 1 52 LYS H 1 93 VAL MG2 . . 5.500 4.759 4.586 4.925 . 0 0 "[ . 1 . 2]" 1
1161 1 52 LYS HA 1 52 LYS QB . . 2.630 2.381 2.262 2.465 . 0 0 "[ . 1 . 2]" 1
1162 1 52 LYS HA 1 52 LYS HD2 . . 5.500 4.310 2.191 4.966 . 0 0 "[ . 1 . 2]" 1
1163 1 52 LYS HA 1 52 LYS QD . . 4.770 3.671 2.079 4.245 . 0 0 "[ . 1 . 2]" 1
1164 1 52 LYS HA 1 52 LYS HD3 . . 5.500 4.128 2.092 4.764 . 0 0 "[ . 1 . 2]" 1
1165 1 52 LYS HA 1 52 LYS QE . . 4.870 4.277 3.386 4.911 0.041 20 0 "[ . 1 . 2]" 1
1166 1 52 LYS HA 1 53 VAL H . . 2.450 2.364 2.213 2.458 0.008 9 0 "[ . 1 . 2]" 1
1167 1 52 LYS HA 1 53 VAL HB . . 4.880 4.819 4.682 4.887 0.007 15 0 "[ . 1 . 2]" 1
1168 1 52 LYS QB 1 52 LYS QE . . 3.750 2.785 1.951 3.707 . 0 0 "[ . 1 . 2]" 1
1169 1 52 LYS QB 1 53 VAL H . . 3.090 2.510 2.294 2.896 . 0 0 "[ . 1 . 2]" 1
1170 1 52 LYS QB 1 53 VAL HB . . 4.760 4.316 4.176 4.460 . 0 0 "[ . 1 . 2]" 1
1171 1 52 LYS QB 1 55 HIS HD2 . . 4.670 4.572 4.179 4.672 0.002 5 0 "[ . 1 . 2]" 1
1172 1 52 LYS QB 1 55 HIS HE1 . . 3.210 3.085 2.630 3.213 0.003 7 0 "[ . 1 . 2]" 1
1173 1 52 LYS HB2 1 52 LYS QE . . 4.370 3.330 2.209 4.364 . 0 0 "[ . 1 . 2]" 1
1174 1 52 LYS HB3 1 52 LYS QE . . 4.370 3.218 1.993 4.371 0.001 11 0 "[ . 1 . 2]" 1
1175 1 52 LYS HD2 1 55 HIS HE1 . . 5.500 4.515 2.049 5.502 0.002 9 0 "[ . 1 . 2]" 1
1176 1 52 LYS HD3 1 55 HIS HE1 . . 5.500 4.445 1.987 5.473 . 0 0 "[ . 1 . 2]" 1
1177 1 52 LYS QE 1 52 LYS QG . . 3.200 2.265 2.061 2.637 . 0 0 "[ . 1 . 2]" 1
1178 1 52 LYS QE 1 55 HIS HE1 . . 5.460 4.439 2.709 5.351 . 0 0 "[ . 1 . 2]" 1
1179 1 52 LYS QG 1 55 HIS HE1 . . 3.890 3.209 2.085 3.974 0.084 20 0 "[ . 1 . 2]" 1
1180 1 53 VAL H 1 53 VAL HB . . 2.580 2.479 2.421 2.556 . 0 0 "[ . 1 . 2]" 1
1181 1 53 VAL H 1 53 VAL MG1 . . 4.050 3.760 3.745 3.771 . 0 0 "[ . 1 . 2]" 1
1182 1 53 VAL H 1 53 VAL MG2 . . 2.550 2.321 2.129 2.486 . 0 0 "[ . 1 . 2]" 1
1183 1 53 VAL HA 1 53 VAL MG1 . . 2.710 2.429 2.355 2.471 . 0 0 "[ . 1 . 2]" 1
1184 1 53 VAL HA 1 53 VAL MG2 . . 2.620 2.361 2.265 2.424 . 0 0 "[ . 1 . 2]" 1
1185 1 53 VAL HA 1 54 GLY H . . 2.460 2.153 2.144 2.184 . 0 0 "[ . 1 . 2]" 1
1186 1 53 VAL HA 1 54 GLY HA2 . . 4.430 4.368 4.334 4.403 . 0 0 "[ . 1 . 2]" 1
1187 1 53 VAL HA 1 54 GLY HA3 . . 4.520 4.399 4.393 4.415 . 0 0 "[ . 1 . 2]" 1
1188 1 53 VAL HA 1 55 HIS H . . 3.670 3.512 3.424 3.604 . 0 0 "[ . 1 . 2]" 1
1189 1 53 VAL HB 1 54 GLY H . . 4.440 4.359 4.279 4.444 0.004 17 0 "[ . 1 . 2]" 1
1190 1 53 VAL MG1 1 54 GLY H . . 3.040 2.866 2.558 3.044 0.004 15 0 "[ . 1 . 2]" 1
1191 1 53 VAL MG1 1 54 GLY HA2 . . 3.610 3.408 3.301 3.575 . 0 0 "[ . 1 . 2]" 1
1192 1 53 VAL MG1 1 54 GLY HA3 . . 3.890 3.689 3.549 3.855 . 0 0 "[ . 1 . 2]" 1
1193 1 53 VAL MG1 1 55 HIS H . . 4.830 4.513 4.380 4.665 . 0 0 "[ . 1 . 2]" 1
1194 1 53 VAL MG2 1 54 GLY H . . 4.300 4.108 4.012 4.188 . 0 0 "[ . 1 . 2]" 1
1195 1 54 GLY H 1 54 GLY HA2 . . 2.780 2.531 2.486 2.574 . 0 0 "[ . 1 . 2]" 1
1196 1 54 GLY H 1 55 HIS H . . 2.850 1.958 1.798 2.194 . 0 0 "[ . 1 . 2]" 1
1197 1 54 GLY H 1 55 HIS HB2 . . 4.790 3.860 3.707 4.029 . 0 0 "[ . 1 . 2]" 1
1198 1 55 HIS H 1 55 HIS HB2 . . 2.550 2.250 2.206 2.308 . 0 0 "[ . 1 . 2]" 1
1199 1 55 HIS H 1 55 HIS HB3 . . 3.570 3.534 3.507 3.556 . 0 0 "[ . 1 . 2]" 1
1200 1 55 HIS H 1 55 HIS HD2 . . 4.310 4.150 3.967 4.288 . 0 0 "[ . 1 . 2]" 1
1201 1 55 HIS H 1 56 VAL H . . 4.640 4.581 4.551 4.610 . 0 0 "[ . 1 . 2]" 1
1202 1 55 HIS H 1 93 VAL MG1 . . 5.500 4.838 4.662 5.066 . 0 0 "[ . 1 . 2]" 1
1203 1 55 HIS HA 1 55 HIS HD2 . . 2.400 2.206 2.129 2.255 . 0 0 "[ . 1 . 2]" 1
1204 1 55 HIS HA 1 56 VAL H . . 3.040 2.516 2.432 2.558 . 0 0 "[ . 1 . 2]" 1
1205 1 55 HIS HA 1 93 VAL HB . . 5.160 3.729 3.576 3.866 . 0 0 "[ . 1 . 2]" 1
1206 1 55 HIS HA 1 93 VAL MG1 . . 4.680 4.137 4.008 4.299 . 0 0 "[ . 1 . 2]" 1
1207 1 55 HIS HA 1 94 THR H . . 4.670 4.455 4.150 4.677 0.007 12 0 "[ . 1 . 2]" 1
1208 1 55 HIS HB2 1 55 HIS HD2 . . 3.940 3.907 3.867 3.924 . 0 0 "[ . 1 . 2]" 1
1209 1 55 HIS HB2 1 56 VAL H . . 3.840 3.637 3.559 3.810 . 0 0 "[ . 1 . 2]" 1
1210 1 55 HIS HB2 1 93 VAL HB . . 4.300 4.020 3.735 4.245 . 0 0 "[ . 1 . 2]" 1
1211 1 55 HIS HB2 1 93 VAL MG1 . . 3.470 2.971 2.698 3.236 . 0 0 "[ . 1 . 2]" 1
1212 1 55 HIS HB2 1 93 VAL MG2 . . 4.450 4.306 4.058 4.453 0.003 1 0 "[ . 1 . 2]" 1
1213 1 55 HIS HB3 1 55 HIS HD2 . . 3.490 3.399 3.353 3.483 . 0 0 "[ . 1 . 2]" 1
1214 1 55 HIS HB3 1 56 VAL H . . 3.490 2.210 2.116 2.415 . 0 0 "[ . 1 . 2]" 1
1215 1 55 HIS HB3 1 56 VAL HB . . 5.500 4.952 4.875 5.099 . 0 0 "[ . 1 . 2]" 1
1216 1 55 HIS HB3 1 56 VAL MG2 . . 4.550 4.456 4.362 4.554 0.004 6 0 "[ . 1 . 2]" 1
1217 1 55 HIS HB3 1 93 VAL HA . . 4.340 4.077 3.862 4.279 . 0 0 "[ . 1 . 2]" 1
1218 1 55 HIS HB3 1 93 VAL HB . . 3.240 2.362 2.050 2.586 . 0 0 "[ . 1 . 2]" 1
1219 1 55 HIS HB3 1 93 VAL MG1 . . 3.200 1.993 1.902 2.119 . 0 0 "[ . 1 . 2]" 1
1220 1 55 HIS HB3 1 93 VAL MG2 . . 3.750 3.363 3.148 3.535 . 0 0 "[ . 1 . 2]" 1
1221 1 55 HIS HB3 1 94 THR H . . 4.700 4.206 3.888 4.489 . 0 0 "[ . 1 . 2]" 1
1222 1 55 HIS HD2 1 56 VAL H . . 3.880 3.787 3.676 3.898 0.018 20 0 "[ . 1 . 2]" 1
1223 1 55 HIS HD2 1 93 VAL HB . . 3.570 3.502 3.412 3.574 0.004 15 0 "[ . 1 . 2]" 1
1224 1 55 HIS HD2 1 93 VAL MG1 . . 4.410 4.372 4.294 4.416 0.006 5 0 "[ . 1 . 2]" 1
1225 1 55 HIS HD2 1 93 VAL MG2 . . 3.740 3.712 3.537 3.747 0.007 20 0 "[ . 1 . 2]" 1
1226 1 55 HIS HD2 1 94 THR H . . 4.890 4.493 4.144 4.807 . 0 0 "[ . 1 . 2]" 1
1227 1 55 HIS HD2 1 95 GLU HB2 . . 5.050 4.000 1.999 5.050 0.000 17 0 "[ . 1 . 2]" 1
1228 1 55 HIS HD2 1 95 GLU QB . . 4.290 3.386 1.989 4.291 0.001 5 0 "[ . 1 . 2]" 1
1229 1 55 HIS HD2 1 95 GLU HB3 . . 5.050 4.017 2.712 4.917 . 0 0 "[ . 1 . 2]" 1
1230 1 55 HIS HD2 1 95 GLU HG2 . . 3.650 2.714 2.003 3.650 . 3 0 "[ . 1 . 2]" 1
1231 1 55 HIS HD2 1 95 GLU QG . . 3.020 2.241 1.955 2.639 . 0 0 "[ . 1 . 2]" 1
1232 1 55 HIS HD2 1 95 GLU HG3 . . 3.650 2.891 2.008 3.642 . 0 0 "[ . 1 . 2]" 1
1233 1 55 HIS HE1 1 93 VAL MG2 . . 3.930 3.590 3.253 3.887 . 0 0 "[ . 1 . 2]" 1
1234 1 56 VAL H 1 56 VAL HB . . 2.830 2.759 2.702 2.795 . 0 0 "[ . 1 . 2]" 1
1235 1 56 VAL H 1 56 VAL MG1 . . 3.920 3.885 3.859 3.910 . 0 0 "[ . 1 . 2]" 1
1236 1 56 VAL H 1 56 VAL MG2 . . 2.950 2.906 2.818 2.972 0.022 15 0 "[ . 1 . 2]" 1
1237 1 56 VAL H 1 93 VAL HB . . 2.980 2.542 2.417 2.642 . 0 0 "[ . 1 . 2]" 1
1238 1 56 VAL H 1 93 VAL MG1 . . 3.860 2.844 2.621 3.113 . 0 0 "[ . 1 . 2]" 1
1239 1 56 VAL H 1 93 VAL MG2 . . 4.840 4.168 4.066 4.257 . 0 0 "[ . 1 . 2]" 1
1240 1 56 VAL H 1 94 THR MG . . 3.880 3.740 3.367 3.882 0.002 3 0 "[ . 1 . 2]" 1
1241 1 56 VAL HA 1 56 VAL MG1 . . 2.800 2.401 2.346 2.446 . 0 0 "[ . 1 . 2]" 1
1242 1 56 VAL HA 1 56 VAL MG2 . . 3.290 2.416 2.354 2.465 . 0 0 "[ . 1 . 2]" 1
1243 1 56 VAL HA 1 57 ILE H . . 2.520 2.156 2.147 2.165 . 0 0 "[ . 1 . 2]" 1
1244 1 56 VAL HA 1 57 ILE HA . . 4.440 4.423 4.410 4.436 . 0 0 "[ . 1 . 2]" 1
1245 1 56 VAL HA 1 57 ILE HB . . 4.800 4.697 4.627 4.770 . 0 0 "[ . 1 . 2]" 1
1246 1 56 VAL HA 1 93 VAL MG1 . . 5.030 4.130 3.976 4.424 . 0 0 "[ . 1 . 2]" 1
1247 1 56 VAL HB 1 57 ILE H . . 4.400 4.383 4.361 4.410 0.010 20 0 "[ . 1 . 2]" 1
1248 1 56 VAL HB 1 58 LEU MD2 . . 3.400 2.722 2.548 2.836 . 0 0 "[ . 1 . 2]" 1
1249 1 56 VAL HB 1 94 THR H . . 3.270 3.192 3.055 3.274 0.004 12 0 "[ . 1 . 2]" 1
1250 1 56 VAL HB 1 94 THR HB . . 5.470 5.107 4.731 5.458 . 0 0 "[ . 1 . 2]" 1
1251 1 56 VAL HB 1 94 THR MG . . 2.700 2.470 2.240 2.694 . 0 0 "[ . 1 . 2]" 1
1252 1 56 VAL HB 1 96 PHE H . . 4.890 4.411 3.775 4.886 . 0 0 "[ . 1 . 2]" 1
1253 1 56 VAL HB 1 96 PHE QD . . 3.960 3.525 3.263 3.906 . 0 0 "[ . 1 . 2]" 1
1254 1 56 VAL MG1 1 57 ILE H . . 3.000 2.874 2.776 2.960 . 0 0 "[ . 1 . 2]" 1
1255 1 56 VAL MG1 1 58 LEU HG . . 4.170 3.659 3.549 3.808 . 0 0 "[ . 1 . 2]" 1
1256 1 56 VAL MG1 1 94 THR MG . . 3.280 3.163 2.940 3.283 0.003 3 0 "[ . 1 . 2]" 1
1257 1 56 VAL MG1 1 96 PHE QD . . 4.410 3.584 3.264 3.816 . 0 0 "[ . 1 . 2]" 1
1258 1 56 VAL MG1 1 96 PHE QE . . 4.740 2.730 2.461 3.068 . 0 0 "[ . 1 . 2]" 1
1259 1 56 VAL MG2 1 57 ILE H . . 4.230 4.160 4.090 4.219 . 0 0 "[ . 1 . 2]" 1
1260 1 56 VAL MG2 1 94 THR H . . 4.380 4.285 4.121 4.387 0.007 6 0 "[ . 1 . 2]" 1
1261 1 56 VAL MG2 1 96 PHE H . . 4.050 3.709 3.025 4.051 0.001 5 0 "[ . 1 . 2]" 1
1262 1 56 VAL MG2 1 96 PHE QB . . 3.700 3.386 2.906 3.702 0.002 3 0 "[ . 1 . 2]" 1
1263 1 56 VAL MG2 1 96 PHE QD . . 4.300 2.178 1.978 2.421 . 0 0 "[ . 1 . 2]" 1
1264 1 56 VAL MG2 1 96 PHE QE . . 5.090 3.271 2.728 3.530 . 0 0 "[ . 1 . 2]" 1
1265 1 56 VAL MG2 1 96 PHE HZ . . 5.500 5.308 4.770 5.501 0.001 15 0 "[ . 1 . 2]" 1
1266 1 57 ILE H 1 57 ILE HB . . 3.060 2.585 2.509 2.654 . 0 0 "[ . 1 . 2]" 1
1267 1 57 ILE H 1 57 ILE HG12 . . 3.690 3.547 3.400 3.677 . 0 0 "[ . 1 . 2]" 1
1268 1 57 ILE H 1 57 ILE HG13 . . 3.690 2.063 1.915 2.210 . 0 0 "[ . 1 . 2]" 1
1269 1 57 ILE H 1 57 ILE MG . . 4.450 3.773 3.767 3.778 . 0 0 "[ . 1 . 2]" 1
1270 1 57 ILE H 1 93 VAL MG1 . . 4.370 3.636 3.470 3.863 . 0 0 "[ . 1 . 2]" 1
1271 1 57 ILE HA 1 57 ILE MD . . 3.950 3.915 3.881 3.944 . 0 0 "[ . 1 . 2]" 1
1272 1 57 ILE HA 1 57 ILE HG12 . . 3.310 2.795 2.685 2.866 . 0 0 "[ . 1 . 2]" 1
1273 1 57 ILE HA 1 57 ILE HG13 . . 3.310 2.846 2.757 2.945 . 0 0 "[ . 1 . 2]" 1
1274 1 57 ILE HA 1 57 ILE MG . . 2.740 2.397 2.359 2.453 . 0 0 "[ . 1 . 2]" 1
1275 1 57 ILE HA 1 58 LEU H . . 2.490 2.149 2.140 2.158 . 0 0 "[ . 1 . 2]" 1
1276 1 57 ILE HA 1 58 LEU HA . . 4.410 4.405 4.396 4.413 0.003 20 0 "[ . 1 . 2]" 1
1277 1 57 ILE HA 1 58 LEU QB . . 4.690 4.686 4.672 4.695 0.005 20 0 "[ . 1 . 2]" 1
1278 1 57 ILE HA 1 58 LEU MD2 . . 4.240 4.104 3.893 4.222 . 0 0 "[ . 1 . 2]" 1
1279 1 57 ILE HA 1 58 LEU HG . . 3.500 3.509 3.483 3.522 0.022 20 0 "[ . 1 . 2]" 1
1280 1 57 ILE HA 1 59 GLU H . . 3.730 3.551 3.481 3.697 . 0 0 "[ . 1 . 2]" 1
1281 1 57 ILE HA 1 91 PHE HB3 . . 4.730 4.586 4.423 4.711 . 0 0 "[ . 1 . 2]" 1
1282 1 57 ILE HA 1 91 PHE QD . . 4.860 4.440 4.211 4.687 . 0 0 "[ . 1 . 2]" 1
1283 1 57 ILE HA 1 92 LEU HG . . 5.500 4.695 4.493 5.000 . 0 0 "[ . 1 . 2]" 1
1284 1 57 ILE HA 1 93 VAL HA . . 3.300 3.151 2.992 3.264 . 0 0 "[ . 1 . 2]" 1
1285 1 57 ILE HA 1 93 VAL HB . . 4.880 4.799 4.660 4.884 0.004 6 0 "[ . 1 . 2]" 1
1286 1 57 ILE HA 1 93 VAL MG1 . . 2.830 2.682 2.528 2.829 . 0 0 "[ . 1 . 2]" 1
1287 1 57 ILE HA 1 93 VAL MG2 . . 5.500 5.054 4.962 5.119 . 0 0 "[ . 1 . 2]" 1
1288 1 57 ILE HB 1 57 ILE MD . . 3.550 2.182 2.118 2.276 . 0 0 "[ . 1 . 2]" 1
1289 1 57 ILE HB 1 58 LEU H . . 4.370 4.308 4.237 4.369 . 0 0 "[ . 1 . 2]" 1
1290 1 57 ILE HB 1 65 LEU MD1 . . 3.390 2.495 2.266 2.799 . 0 0 "[ . 1 . 2]" 1
1291 1 57 ILE MD 1 57 ILE MG . . 3.670 2.397 2.294 2.501 . 0 0 "[ . 1 . 2]" 1
1292 1 57 ILE MD 1 65 LEU MD1 . . 3.730 3.339 3.129 3.629 . 0 0 "[ . 1 . 2]" 1
1293 1 57 ILE MD 1 77 ILE MD . . 3.220 2.234 2.003 2.363 . 0 0 "[ . 1 . 2]" 1
1294 1 57 ILE MD 1 91 PHE QD . . 2.870 2.671 2.348 2.870 . 0 0 "[ . 1 . 2]" 1
1295 1 57 ILE MD 1 91 PHE QE . . 3.800 2.646 2.307 3.002 . 0 0 "[ . 1 . 2]" 1
1296 1 57 ILE QG 1 59 GLU H . . 5.340 5.076 4.924 5.202 . 0 0 "[ . 1 . 2]" 1
1297 1 57 ILE QG 1 91 PHE QD . . 4.170 2.433 2.267 2.697 . 0 0 "[ . 1 . 2]" 1
1298 1 57 ILE QG 1 92 LEU H . . 5.340 4.649 4.332 4.886 . 0 0 "[ . 1 . 2]" 1
1299 1 57 ILE QG 1 93 VAL MG1 . . 3.200 2.730 2.541 2.893 . 0 0 "[ . 1 . 2]" 1
1300 1 57 ILE QG 1 93 VAL MG2 . . 5.340 5.004 4.806 5.167 . 0 0 "[ . 1 . 2]" 1
1301 1 57 ILE HG12 1 57 ILE MG . . 3.600 2.130 2.071 2.213 . 0 0 "[ . 1 . 2]" 1
1302 1 57 ILE HG13 1 57 ILE MG . . 3.600 3.155 3.134 3.175 . 0 0 "[ . 1 . 2]" 1
1303 1 57 ILE MG 1 58 LEU H . . 3.090 2.914 2.707 3.084 . 0 0 "[ . 1 . 2]" 1
1304 1 57 ILE MG 1 58 LEU HA . . 4.480 3.931 3.784 4.035 . 0 0 "[ . 1 . 2]" 1
1305 1 57 ILE MG 1 59 GLU H . . 3.090 2.606 2.498 2.749 . 0 0 "[ . 1 . 2]" 1
1306 1 57 ILE MG 1 91 PHE HA . . 3.640 3.000 2.873 3.156 . 0 0 "[ . 1 . 2]" 1
1307 1 57 ILE MG 1 91 PHE HB2 . . 4.980 4.836 4.621 4.984 0.004 20 0 "[ . 1 . 2]" 1
1308 1 57 ILE MG 1 91 PHE HB3 . . 3.700 3.516 3.265 3.694 . 0 0 "[ . 1 . 2]" 1
1309 1 57 ILE MG 1 91 PHE QD . . 2.970 2.144 1.973 2.390 . 0 0 "[ . 1 . 2]" 1
1310 1 57 ILE MG 1 91 PHE QE . . 4.640 3.428 3.193 3.689 . 0 0 "[ . 1 . 2]" 1
1311 1 57 ILE MG 1 92 LEU H . . 3.750 3.136 3.017 3.291 . 0 0 "[ . 1 . 2]" 1
1312 1 57 ILE MG 1 93 VAL HA . . 5.000 4.845 4.686 4.961 . 0 0 "[ . 1 . 2]" 1
1313 1 58 LEU H 1 58 LEU QB . . 2.930 2.765 2.759 2.778 . 0 0 "[ . 1 . 2]" 1
1314 1 58 LEU H 1 58 LEU MD1 . . 4.170 3.493 3.410 3.614 . 0 0 "[ . 1 . 2]" 1
1315 1 58 LEU H 1 58 LEU MD2 . . 3.340 3.150 3.095 3.237 . 0 0 "[ . 1 . 2]" 1
1316 1 58 LEU H 1 58 LEU HG . . 2.830 1.974 1.918 2.071 . 0 0 "[ . 1 . 2]" 1
1317 1 58 LEU H 1 59 GLU H . . 2.710 2.150 2.071 2.229 . 0 0 "[ . 1 . 2]" 1
1318 1 58 LEU H 1 59 GLU HA . . 4.880 4.846 4.771 4.887 0.007 2 0 "[ . 1 . 2]" 1
1319 1 58 LEU H 1 59 GLU QB . . 5.240 4.333 4.273 4.424 . 0 0 "[ . 1 . 2]" 1
1320 1 58 LEU H 1 92 LEU H . . 4.630 4.054 3.854 4.184 . 0 0 "[ . 1 . 2]" 1
1321 1 58 LEU H 1 92 LEU HB3 . . 4.060 3.419 3.242 3.633 . 0 0 "[ . 1 . 2]" 1
1322 1 58 LEU H 1 92 LEU MD2 . . 4.430 3.677 3.356 4.213 . 0 0 "[ . 1 . 2]" 1
1323 1 58 LEU H 1 93 VAL HA . . 3.630 3.356 3.260 3.475 . 0 0 "[ . 1 . 2]" 1
1324 1 58 LEU H 1 93 VAL MG1 . . 4.090 4.004 3.899 4.090 . 0 0 "[ . 1 . 2]" 1
1325 1 58 LEU HA 1 58 LEU MD1 . . 4.040 4.026 4.012 4.038 . 0 0 "[ . 1 . 2]" 1
1326 1 58 LEU HA 1 58 LEU MD2 . . 2.650 2.494 2.382 2.607 . 0 0 "[ . 1 . 2]" 1
1327 1 58 LEU HA 1 59 GLU HA . . 4.920 4.520 4.515 4.530 . 0 0 "[ . 1 . 2]" 1
1328 1 58 LEU HA 1 59 GLU QB . . 5.260 4.717 4.662 4.812 . 0 0 "[ . 1 . 2]" 1
1329 1 58 LEU HA 1 65 LEU MD1 . . 4.110 3.593 3.347 3.869 . 0 0 "[ . 1 . 2]" 1
1330 1 58 LEU QB 1 58 LEU MD1 . . 2.620 2.032 1.982 2.097 . 0 0 "[ . 1 . 2]" 1
1331 1 58 LEU QB 1 58 LEU MD2 . . 3.000 2.220 2.153 2.267 . 0 0 "[ . 1 . 2]" 1
1332 1 58 LEU QB 1 59 GLU H . . 2.950 2.909 2.732 2.981 0.031 12 0 "[ . 1 . 2]" 1
1333 1 58 LEU QB 1 59 GLU HA . . 4.370 4.312 4.216 4.361 . 0 0 "[ . 1 . 2]" 1
1334 1 58 LEU QB 1 59 GLU QB . . 3.300 3.248 3.232 3.273 . 0 0 "[ . 1 . 2]" 1
1335 1 58 LEU QB 1 92 LEU H . . 5.500 5.277 5.061 5.394 . 0 0 "[ . 1 . 2]" 1
1336 1 58 LEU QB 1 92 LEU HB3 . . 3.860 3.554 3.244 3.763 . 0 0 "[ . 1 . 2]" 1
1337 1 58 LEU QB 1 92 LEU MD2 . . 2.820 2.008 1.807 2.497 . 0 0 "[ . 1 . 2]" 1
1338 1 58 LEU QB 1 92 LEU HG . . 4.180 2.580 2.397 2.864 . 0 0 "[ . 1 . 2]" 1
1339 1 58 LEU QB 1 93 VAL HA . . 5.030 4.850 4.739 4.942 . 0 0 "[ . 1 . 2]" 1
1340 1 58 LEU QB 1 94 THR MG . . 4.740 4.298 3.901 4.706 . 0 0 "[ . 1 . 2]" 1
1341 1 58 LEU MD1 1 92 LEU HG . . 3.520 2.230 1.998 2.393 . 0 0 "[ . 1 . 2]" 1
1342 1 58 LEU MD1 1 93 VAL H . . 4.870 4.589 4.393 4.794 . 0 0 "[ . 1 . 2]" 1
1343 1 58 LEU MD1 1 93 VAL HA . . 3.750 3.531 3.385 3.648 . 0 0 "[ . 1 . 2]" 1
1344 1 58 LEU MD1 1 94 THR H . . 4.000 3.660 3.338 3.821 . 0 0 "[ . 1 . 2]" 1
1345 1 58 LEU MD1 1 94 THR HB . . 2.780 2.282 2.033 2.510 . 0 0 "[ . 1 . 2]" 1
1346 1 58 LEU MD1 1 94 THR MG . . 2.690 2.150 1.781 2.582 . 0 0 "[ . 1 . 2]" 1
1347 1 58 LEU MD2 1 59 GLU H . . 4.640 4.576 4.515 4.633 . 0 0 "[ . 1 . 2]" 1
1348 1 58 LEU MD2 1 59 GLU QB . . 5.500 5.464 5.450 5.478 . 0 0 "[ . 1 . 2]" 1
1349 1 58 LEU MD2 1 94 THR MG . . 2.740 2.057 1.875 2.236 . 0 0 "[ . 1 . 2]" 1
1350 1 58 LEU HG 1 59 GLU H . . 4.670 3.732 3.644 3.782 . 0 0 "[ . 1 . 2]" 1
1351 1 58 LEU HG 1 93 VAL HA . . 3.200 2.945 2.851 3.006 . 0 0 "[ . 1 . 2]" 1
1352 1 58 LEU HG 1 93 VAL MG2 . . 5.500 5.493 5.430 5.506 0.006 5 0 "[ . 1 . 2]" 1
1353 1 58 LEU HG 1 94 THR H . . 4.290 4.000 3.704 4.171 . 0 0 "[ . 1 . 2]" 1
1354 1 58 LEU HG 1 94 THR HB . . 4.550 4.287 4.056 4.484 . 0 0 "[ . 1 . 2]" 1
1355 1 58 LEU HG 1 94 THR MG . . 3.740 3.303 3.004 3.679 . 0 0 "[ . 1 . 2]" 1
1356 1 59 GLU H 1 59 GLU QB . . 3.490 2.689 2.569 2.743 . 0 0 "[ . 1 . 2]" 1
1357 1 59 GLU H 1 59 GLU HG2 . . 4.870 4.469 4.166 4.649 . 0 0 "[ . 1 . 2]" 1
1358 1 59 GLU H 1 59 GLU QG . . 4.160 4.099 3.931 4.168 0.008 12 0 "[ . 1 . 2]" 1
1359 1 59 GLU H 1 59 GLU HG3 . . 4.870 4.781 4.677 4.878 0.008 9 0 "[ . 1 . 2]" 1
1360 1 59 GLU H 1 60 VAL H . . 4.380 4.334 4.250 4.377 . 0 0 "[ . 1 . 2]" 1
1361 1 59 GLU H 1 60 VAL MG2 . . 4.080 3.661 3.420 3.858 . 0 0 "[ . 1 . 2]" 1
1362 1 59 GLU H 1 92 LEU H . . 3.370 3.114 2.971 3.238 . 0 0 "[ . 1 . 2]" 1
1363 1 59 GLU H 1 92 LEU HB2 . . 4.230 3.963 3.794 4.193 . 0 0 "[ . 1 . 2]" 1
1364 1 59 GLU H 1 92 LEU HB3 . . 2.940 2.208 2.042 2.432 . 0 0 "[ . 1 . 2]" 1
1365 1 59 GLU H 1 92 LEU MD1 . . 4.740 4.603 4.465 4.745 0.005 6 0 "[ . 1 . 2]" 1
1366 1 59 GLU H 1 92 LEU MD2 . . 4.490 2.848 2.490 3.538 . 0 0 "[ . 1 . 2]" 1
1367 1 59 GLU H 1 92 LEU HG . . 4.800 3.379 3.120 3.678 . 0 0 "[ . 1 . 2]" 1
1368 1 59 GLU H 1 93 VAL HA . . 5.470 5.106 5.030 5.232 . 0 0 "[ . 1 . 2]" 1
1369 1 59 GLU H 1 93 VAL MG1 . . 5.500 5.137 5.002 5.247 . 0 0 "[ . 1 . 2]" 1
1370 1 59 GLU HA 1 59 GLU HG2 . . 3.440 3.179 2.957 3.377 . 0 0 "[ . 1 . 2]" 1
1371 1 59 GLU HA 1 59 GLU QG . . 2.840 2.475 2.331 2.687 . 0 0 "[ . 1 . 2]" 1
1372 1 59 GLU HA 1 59 GLU HG3 . . 3.440 2.594 2.380 2.870 . 0 0 "[ . 1 . 2]" 1
1373 1 59 GLU HA 1 60 VAL H . . 2.400 2.235 2.185 2.286 . 0 0 "[ . 1 . 2]" 1
1374 1 59 GLU HA 1 60 VAL HB . . 4.500 4.476 4.381 4.527 0.027 13 0 "[ . 1 . 2]" 1
1375 1 59 GLU HA 1 60 VAL MG2 . . 4.270 3.627 3.496 3.804 . 0 0 "[ . 1 . 2]" 1
1376 1 59 GLU HA 1 63 LEU H . . 5.330 5.256 5.118 5.334 0.004 17 0 "[ . 1 . 2]" 1
1377 1 59 GLU HA 1 64 THR HA . . 3.060 2.241 1.989 2.675 . 0 0 "[ . 1 . 2]" 1
1378 1 59 GLU HA 1 64 THR HB . . 5.440 4.541 4.020 5.194 . 0 0 "[ . 1 . 2]" 1
1379 1 59 GLU HA 1 65 LEU H . . 3.330 2.760 2.261 3.182 . 0 0 "[ . 1 . 2]" 1
1380 1 59 GLU HA 1 65 LEU HB2 . . 5.140 4.193 3.929 4.453 . 0 0 "[ . 1 . 2]" 1
1381 1 59 GLU HA 1 65 LEU MD1 . . 4.550 3.857 3.540 4.123 . 0 0 "[ . 1 . 2]" 1
1382 1 59 GLU HA 1 65 LEU MD2 . . 4.690 4.329 3.927 4.611 . 0 0 "[ . 1 . 2]" 1
1383 1 59 GLU HA 1 65 LEU HG . . 3.550 2.969 2.578 3.269 . 0 0 "[ . 1 . 2]" 1
1384 1 59 GLU HA 1 92 LEU MD2 . . 5.130 3.855 3.508 4.488 . 0 0 "[ . 1 . 2]" 1
1385 1 59 GLU QB 1 59 GLU HG2 . . 2.690 2.331 2.229 2.419 . 0 0 "[ . 1 . 2]" 1
1386 1 59 GLU QB 1 59 GLU HG3 . . 2.690 2.352 2.263 2.451 . 0 0 "[ . 1 . 2]" 1
1387 1 59 GLU QB 1 60 VAL H . . 3.650 3.546 3.460 3.647 . 0 0 "[ . 1 . 2]" 1
1388 1 59 GLU QB 1 62 GLY H . . 4.770 4.431 4.227 4.642 . 0 0 "[ . 1 . 2]" 1
1389 1 59 GLU QB 1 62 GLY HA2 . . 4.870 4.762 4.613 4.874 0.004 14 0 "[ . 1 . 2]" 1
1390 1 59 GLU QB 1 64 THR H . . 5.330 5.003 4.545 5.332 0.002 8 0 "[ . 1 . 2]" 1
1391 1 59 GLU QB 1 64 THR HA . . 3.050 2.880 2.423 3.051 0.001 2 0 "[ . 1 . 2]" 1
1392 1 59 GLU QB 1 64 THR HB . . 5.150 4.068 3.285 5.006 . 0 0 "[ . 1 . 2]" 1
1393 1 59 GLU QB 1 64 THR MG . . 5.150 4.007 2.847 4.890 . 0 0 "[ . 1 . 2]" 1
1394 1 59 GLU QB 1 65 LEU H . . 4.080 3.944 3.608 4.087 0.007 8 0 "[ . 1 . 2]" 1
1395 1 59 GLU QB 1 92 LEU HB2 . . 3.550 2.769 2.578 3.057 . 0 0 "[ . 1 . 2]" 1
1396 1 59 GLU QB 1 92 LEU HB3 . . 2.980 2.046 1.973 2.286 . 0 0 "[ . 1 . 2]" 1
1397 1 59 GLU QB 1 92 LEU MD2 . . 2.780 1.835 1.732 2.028 . 0 0 "[ . 1 . 2]" 1
1398 1 59 GLU QB 1 92 LEU HG . . 3.960 3.697 3.417 3.937 . 0 0 "[ . 1 . 2]" 1
1399 1 59 GLU QG 1 60 VAL H . . 2.790 2.338 2.148 2.522 . 0 0 "[ . 1 . 2]" 1
1400 1 59 GLU QG 1 62 GLY H . . 3.240 2.405 2.210 2.603 . 0 0 "[ . 1 . 2]" 1
1401 1 59 GLU QG 1 62 GLY HA2 . . 3.550 3.008 2.897 3.140 . 0 0 "[ . 1 . 2]" 1
1402 1 59 GLU QG 1 62 GLY HA3 . . 4.300 4.088 3.952 4.195 . 0 0 "[ . 1 . 2]" 1
1403 1 59 GLU QG 1 63 LEU H . . 3.540 3.407 3.263 3.551 0.011 8 0 "[ . 1 . 2]" 1
1404 1 59 GLU QG 1 64 THR HA . . 4.150 2.707 2.322 3.474 . 0 0 "[ . 1 . 2]" 1
1405 1 59 GLU QG 1 92 LEU MD2 . . 3.920 3.614 3.474 3.780 . 0 0 "[ . 1 . 2]" 1
1406 1 59 GLU HG2 1 60 VAL H . . 3.370 2.673 2.263 2.987 . 0 0 "[ . 1 . 2]" 1
1407 1 59 GLU HG2 1 62 GLY H . . 3.730 2.455 2.265 2.662 . 0 0 "[ . 1 . 2]" 1
1408 1 59 GLU HG2 1 62 GLY HA2 . . 4.370 3.279 3.122 3.583 . 0 0 "[ . 1 . 2]" 1
1409 1 59 GLU HG2 1 62 GLY HA3 . . 4.970 4.544 4.340 4.893 . 0 0 "[ . 1 . 2]" 1
1410 1 59 GLU HG2 1 63 LEU H . . 4.370 3.943 3.707 4.364 . 0 0 "[ . 1 . 2]" 1
1411 1 59 GLU HG2 1 64 THR HA . . 4.870 4.233 3.784 4.879 0.009 8 0 "[ . 1 . 2]" 1
1412 1 59 GLU HG2 1 92 LEU MD2 . . 4.610 3.975 3.832 4.165 . 0 0 "[ . 1 . 2]" 1
1413 1 59 GLU HG3 1 60 VAL H . . 3.370 2.656 2.290 3.136 . 0 0 "[ . 1 . 2]" 1
1414 1 59 GLU HG3 1 62 GLY H . . 3.730 3.514 3.076 3.734 0.004 14 0 "[ . 1 . 2]" 1
1415 1 59 GLU HG3 1 62 GLY HA2 . . 4.370 3.561 3.163 3.796 . 0 0 "[ . 1 . 2]" 1
1416 1 59 GLU HG3 1 62 GLY HA3 . . 4.970 4.666 4.341 4.848 . 0 0 "[ . 1 . 2]" 1
1417 1 59 GLU HG3 1 63 LEU H . . 4.370 3.758 3.470 4.011 . 0 0 "[ . 1 . 2]" 1
1418 1 59 GLU HG3 1 64 THR HA . . 4.870 2.741 2.340 3.556 . 0 0 "[ . 1 . 2]" 1
1419 1 59 GLU HG3 1 92 LEU MD2 . . 4.610 4.161 3.887 4.548 . 0 0 "[ . 1 . 2]" 1
1420 1 60 VAL H 1 60 VAL HB . . 3.060 2.770 2.670 2.859 . 0 0 "[ . 1 . 2]" 1
1421 1 60 VAL H 1 60 VAL MG1 . . 3.910 3.877 3.821 3.914 0.004 17 0 "[ . 1 . 2]" 1
1422 1 60 VAL H 1 60 VAL MG2 . . 3.140 3.048 2.850 3.160 0.020 14 0 "[ . 1 . 2]" 1
1423 1 60 VAL H 1 61 ASN H . . 4.240 4.089 3.949 4.246 0.006 8 0 "[ . 1 . 2]" 1
1424 1 60 VAL H 1 62 GLY H . . 4.040 3.695 3.525 3.796 . 0 0 "[ . 1 . 2]" 1
1425 1 60 VAL H 1 63 LEU H . . 3.540 3.481 3.431 3.551 0.011 1 0 "[ . 1 . 2]" 1
1426 1 60 VAL H 1 63 LEU QB . . 3.970 3.398 3.105 3.583 . 0 0 "[ . 1 . 2]" 1
1427 1 60 VAL H 1 65 LEU H . . 5.270 4.485 4.056 4.886 . 0 0 "[ . 1 . 2]" 1
1428 1 60 VAL H 1 65 LEU MD1 . . 5.500 4.289 3.986 4.582 . 0 0 "[ . 1 . 2]" 1
1429 1 60 VAL H 1 65 LEU MD2 . . 4.550 4.234 3.861 4.549 . 0 0 "[ . 1 . 2]" 1
1430 1 60 VAL H 1 65 LEU HG . . 4.080 3.593 3.323 3.875 . 0 0 "[ . 1 . 2]" 1
1431 1 60 VAL H 1 76 ILE MG . . 4.330 4.063 3.782 4.276 . 0 0 "[ . 1 . 2]" 1
1432 1 60 VAL HA 1 60 VAL MG1 . . 2.870 2.444 2.379 2.494 . 0 0 "[ . 1 . 2]" 1
1433 1 60 VAL HA 1 60 VAL MG2 . . 2.890 2.314 2.203 2.420 . 0 0 "[ . 1 . 2]" 1
1434 1 60 VAL HA 1 61 ASN H . . 2.530 2.147 2.140 2.161 . 0 0 "[ . 1 . 2]" 1
1435 1 60 VAL HA 1 76 ILE MG . . 5.120 4.869 4.607 5.080 . 0 0 "[ . 1 . 2]" 1
1436 1 60 VAL HA 1 89 ILE MG . . 4.990 3.827 3.495 4.139 . 0 0 "[ . 1 . 2]" 1
1437 1 60 VAL HA 1 91 PHE HA . . 3.380 3.262 3.077 3.343 . 0 0 "[ . 1 . 2]" 1
1438 1 60 VAL HA 1 91 PHE QD . . 4.520 4.430 4.166 4.530 0.010 12 0 "[ . 1 . 2]" 1
1439 1 60 VAL HB 1 65 LEU MD2 . . 3.810 3.499 3.174 3.755 . 0 0 "[ . 1 . 2]" 1
1440 1 60 VAL HB 1 76 ILE MG . . 2.750 2.460 2.241 2.678 . 0 0 "[ . 1 . 2]" 1
1441 1 60 VAL MG1 1 61 ASN H . . 3.220 2.809 2.475 3.067 . 0 0 "[ . 1 . 2]" 1
1442 1 60 VAL MG1 1 61 ASN HB2 . . 4.180 2.585 2.328 2.851 . 0 0 "[ . 1 . 2]" 1
1443 1 60 VAL MG1 1 61 ASN QB . . 3.430 2.546 2.311 2.805 . 0 0 "[ . 1 . 2]" 1
1444 1 60 VAL MG1 1 61 ASN HB3 . . 4.180 3.865 3.382 4.171 . 0 0 "[ . 1 . 2]" 1
1445 1 60 VAL MG1 1 61 ASN HD21 . . 4.980 4.322 3.794 4.845 . 0 0 "[ . 1 . 2]" 1
1446 1 60 VAL MG1 1 61 ASN HD22 . . 5.420 4.696 3.998 5.346 . 0 0 "[ . 1 . 2]" 1
1447 1 60 VAL MG1 1 63 LEU H . . 4.700 4.612 4.403 4.711 0.011 14 0 "[ . 1 . 2]" 1
1448 1 60 VAL MG1 1 76 ILE HB . . 4.500 4.175 3.690 4.493 . 0 0 "[ . 1 . 2]" 1
1449 1 60 VAL MG1 1 76 ILE MG . . 2.800 2.515 2.108 2.758 . 0 0 "[ . 1 . 2]" 1
1450 1 60 VAL MG1 1 77 ILE H . . 4.090 3.800 3.344 4.094 0.004 15 0 "[ . 1 . 2]" 1
1451 1 60 VAL MG1 1 77 ILE HA . . 2.890 2.033 1.821 2.385 . 0 0 "[ . 1 . 2]" 1
1452 1 60 VAL MG1 1 77 ILE HB . . 5.130 4.260 3.924 4.545 . 0 0 "[ . 1 . 2]" 1
1453 1 60 VAL MG1 1 77 ILE HG12 . . 4.330 2.506 2.054 2.870 . 0 0 "[ . 1 . 2]" 1
1454 1 60 VAL MG1 1 77 ILE HG13 . . 3.470 3.058 2.537 3.437 . 0 0 "[ . 1 . 2]" 1
1455 1 60 VAL MG1 1 80 ALA H . . 4.540 4.270 4.002 4.482 . 0 0 "[ . 1 . 2]" 1
1456 1 60 VAL MG1 1 80 ALA HA . . 5.420 4.940 4.677 5.232 . 0 0 "[ . 1 . 2]" 1
1457 1 60 VAL MG1 1 80 ALA MB . . 2.870 2.627 2.408 2.842 . 0 0 "[ . 1 . 2]" 1
1458 1 60 VAL MG1 1 89 ILE HA . . 4.590 4.308 3.996 4.580 . 0 0 "[ . 1 . 2]" 1
1459 1 60 VAL MG1 1 89 ILE MD . . 4.110 3.762 3.415 4.079 . 0 0 "[ . 1 . 2]" 1
1460 1 60 VAL MG1 1 89 ILE MG . . 2.800 2.162 1.994 2.301 . 0 0 "[ . 1 . 2]" 1
1461 1 60 VAL MG1 1 90 ASP H . . 5.500 4.029 3.699 4.298 . 0 0 "[ . 1 . 2]" 1
1462 1 60 VAL MG1 1 91 PHE HA . . 4.240 4.006 3.754 4.245 0.005 18 0 "[ . 1 . 2]" 1
1463 1 60 VAL MG1 1 91 PHE QD . . 3.920 3.759 3.487 3.921 0.001 9 0 "[ . 1 . 2]" 1
1464 1 60 VAL MG1 1 91 PHE QE . . 4.240 3.203 2.777 3.463 . 0 0 "[ . 1 . 2]" 1
1465 1 60 VAL MG2 1 61 ASN H . . 4.150 4.069 3.987 4.147 . 0 0 "[ . 1 . 2]" 1
1466 1 60 VAL MG2 1 65 LEU HG . . 4.050 3.033 2.639 3.345 . 0 0 "[ . 1 . 2]" 1
1467 1 60 VAL MG2 1 77 ILE H . . 4.640 4.328 3.988 4.587 . 0 0 "[ . 1 . 2]" 1
1468 1 60 VAL MG2 1 77 ILE HA . . 3.990 3.633 3.307 3.931 . 0 0 "[ . 1 . 2]" 1
1469 1 60 VAL MG2 1 77 ILE HG12 . . 2.550 2.075 1.906 2.276 . 0 0 "[ . 1 . 2]" 1
1470 1 60 VAL MG2 1 77 ILE HG13 . . 3.100 2.736 2.356 3.016 . 0 0 "[ . 1 . 2]" 1
1471 1 60 VAL MG2 1 89 ILE MG . . 3.690 3.523 3.254 3.691 0.001 13 0 "[ . 1 . 2]" 1
1472 1 60 VAL MG2 1 91 PHE HA . . 3.920 3.022 2.605 3.404 . 0 0 "[ . 1 . 2]" 1
1473 1 60 VAL MG2 1 91 PHE QD . . 3.060 2.611 2.301 2.915 . 0 0 "[ . 1 . 2]" 1
1474 1 60 VAL MG2 1 91 PHE QE . . 3.120 2.780 2.428 3.090 . 0 0 "[ . 1 . 2]" 1
1475 1 60 VAL MG2 1 92 LEU H . . 5.090 3.563 3.269 3.920 . 0 0 "[ . 1 . 2]" 1
1476 1 61 ASN H 1 61 ASN HA . . 2.770 2.275 2.273 2.282 . 0 0 "[ . 1 . 2]" 1
1477 1 61 ASN H 1 61 ASN QB . . 3.560 3.132 2.909 3.346 . 0 0 "[ . 1 . 2]" 1
1478 1 61 ASN H 1 62 GLY H . . 3.140 2.675 2.575 2.800 . 0 0 "[ . 1 . 2]" 1
1479 1 61 ASN H 1 89 ILE MG . . 4.080 3.614 3.056 4.081 0.001 1 0 "[ . 1 . 2]" 1
1480 1 61 ASN H 1 90 ASP H . . 3.600 3.235 2.903 3.427 . 0 0 "[ . 1 . 2]" 1
1481 1 61 ASN H 1 90 ASP QB . . 3.240 2.328 1.990 3.295 0.055 18 0 "[ . 1 . 2]" 1
1482 1 61 ASN H 1 91 PHE HA . . 4.600 4.495 4.362 4.604 0.004 7 0 "[ . 1 . 2]" 1
1483 1 61 ASN HA 1 62 GLY H . . 2.900 2.907 2.865 2.934 0.034 1 0 "[ . 1 . 2]" 1
1484 1 61 ASN HA 1 62 GLY HA3 . . 4.380 4.385 4.373 4.395 0.015 16 0 "[ . 1 . 2]" 1
1485 1 61 ASN HA 1 89 ILE MG . . 5.500 4.413 3.715 4.867 . 0 0 "[ . 1 . 2]" 1
1486 1 61 ASN HA 1 90 ASP H . . 4.330 3.265 2.909 3.492 . 0 0 "[ . 1 . 2]" 1
1487 1 61 ASN HA 1 90 ASP QB . . 3.200 2.471 2.046 3.212 0.012 18 0 "[ . 1 . 2]" 1
1488 1 61 ASN QB 1 61 ASN HD21 . . 2.860 2.156 2.089 2.290 . 0 0 "[ . 1 . 2]" 1
1489 1 61 ASN QB 1 61 ASN HD22 . . 3.310 3.244 3.213 3.319 0.009 19 0 "[ . 1 . 2]" 1
1490 1 61 ASN QB 1 63 LEU H . . 3.960 3.301 3.145 3.451 . 0 0 "[ . 1 . 2]" 1
1491 1 61 ASN QB 1 63 LEU QD . . 3.320 2.891 2.620 3.140 . 0 0 "[ . 1 . 2]" 1
1492 1 61 ASN QB 1 76 ILE MG . . 4.970 3.835 3.412 4.166 . 0 0 "[ . 1 . 2]" 1
1493 1 61 ASN QB 1 80 ALA MB . . 3.540 2.762 1.981 3.226 . 0 0 "[ . 1 . 2]" 1
1494 1 61 ASN HB2 1 61 ASN HD21 . . 3.500 2.765 2.124 3.412 . 0 0 "[ . 1 . 2]" 1
1495 1 61 ASN HB2 1 61 ASN HD22 . . 4.070 3.716 3.438 4.022 . 0 0 "[ . 1 . 2]" 1
1496 1 61 ASN HB2 1 63 LEU H . . 4.520 3.910 3.422 4.528 0.008 18 0 "[ . 1 . 2]" 1
1497 1 61 ASN HB2 1 80 ALA MB . . 4.080 2.872 2.006 3.440 . 0 0 "[ . 1 . 2]" 1
1498 1 61 ASN HB3 1 61 ASN HD21 . . 3.500 2.624 2.116 3.510 0.010 19 0 "[ . 1 . 2]" 1
1499 1 61 ASN HB3 1 61 ASN HD22 . . 4.070 3.664 3.435 4.076 0.006 19 0 "[ . 1 . 2]" 1
1500 1 61 ASN HB3 1 63 LEU H . . 4.520 3.812 3.208 4.345 . 0 0 "[ . 1 . 2]" 1
1501 1 61 ASN HB3 1 80 ALA MB . . 4.080 3.652 3.045 4.049 . 0 0 "[ . 1 . 2]" 1
1502 1 61 ASN HD21 1 80 ALA HA . . 4.500 3.659 2.867 4.483 . 0 0 "[ . 1 . 2]" 1
1503 1 61 ASN HD21 1 80 ALA MB . . 3.160 2.592 1.845 3.155 . 0 0 "[ . 1 . 2]" 1
1504 1 61 ASN HD21 1 86 ARG HD2 . . 3.850 2.888 1.930 3.836 . 0 0 "[ . 1 . 2]" 1
1505 1 61 ASN HD21 1 89 ILE MG . . 4.810 4.071 3.044 4.775 . 0 0 "[ . 1 . 2]" 1
1506 1 61 ASN HD22 1 80 ALA HA . . 4.060 3.599 3.052 3.960 . 0 0 "[ . 1 . 2]" 1
1507 1 61 ASN HD22 1 80 ALA MB . . 3.170 2.470 1.916 3.178 0.008 14 0 "[ . 1 . 2]" 1
1508 1 61 ASN HD22 1 86 ARG QB . . 5.340 3.767 2.830 4.955 . 0 0 "[ . 1 . 2]" 1
1509 1 61 ASN HD22 1 86 ARG HD2 . . 3.760 2.373 1.905 3.753 . 0 0 "[ . 1 . 2]" 1
1510 1 61 ASN HD22 1 86 ARG HD3 . . 5.290 3.515 2.395 4.361 . 0 0 "[ . 1 . 2]" 1
1511 1 61 ASN HD22 1 86 ARG QG . . 5.500 3.526 2.324 4.718 . 0 0 "[ . 1 . 2]" 1
1512 1 61 ASN HD22 1 89 ILE HA . . 4.280 3.291 2.001 4.226 . 0 0 "[ . 1 . 2]" 1
1513 1 61 ASN HD22 1 89 ILE HG12 . . 4.630 3.647 2.801 4.630 0.000 5 0 "[ . 1 . 2]" 1
1514 1 61 ASN HD22 1 89 ILE MG . . 4.680 3.943 3.042 4.683 0.003 20 0 "[ . 1 . 2]" 1
1515 1 62 GLY H 1 62 GLY HA2 . . 2.630 2.371 2.351 2.389 . 0 0 "[ . 1 . 2]" 1
1516 1 62 GLY H 1 62 GLY HA3 . . 2.930 2.930 2.918 2.939 0.009 16 0 "[ . 1 . 2]" 1
1517 1 62 GLY H 1 63 LEU H . . 2.930 2.903 2.845 2.940 0.010 11 0 "[ . 1 . 2]" 1
1518 1 62 GLY H 1 63 LEU QB . . 4.700 4.637 4.510 4.711 0.011 19 0 "[ . 1 . 2]" 1
1519 1 62 GLY H 1 90 ASP QB . . 4.030 3.594 3.349 3.995 . 0 0 "[ . 1 . 2]" 1
1520 1 62 GLY HA2 1 63 LEU H . . 3.510 3.501 3.470 3.521 0.011 16 0 "[ . 1 . 2]" 1
1521 1 62 GLY HA3 1 63 LEU H . . 3.300 2.934 2.882 3.007 . 0 0 "[ . 1 . 2]" 1
1522 1 63 LEU H 1 63 LEU HA . . 2.900 2.854 2.821 2.884 . 0 0 "[ . 1 . 2]" 1
1523 1 63 LEU H 1 63 LEU QB . . 2.480 2.204 2.166 2.313 . 0 0 "[ . 1 . 2]" 1
1524 1 63 LEU H 1 63 LEU MD1 . . 4.180 2.211 1.982 3.714 . 0 0 "[ . 1 . 2]" 1
1525 1 63 LEU H 1 63 LEU QD . . 3.500 2.112 1.855 2.232 . 0 0 "[ . 1 . 2]" 1
1526 1 63 LEU H 1 63 LEU MD2 . . 4.180 4.048 1.860 4.183 0.003 18 0 "[ . 1 . 2]" 1
1527 1 63 LEU H 1 63 LEU HG . . 3.700 3.688 3.589 3.741 0.041 8 0 "[ . 1 . 2]" 1
1528 1 63 LEU H 1 64 THR H . . 4.630 4.499 4.429 4.634 0.004 8 0 "[ . 1 . 2]" 1
1529 1 63 LEU HA 1 63 LEU QB . . 2.800 2.455 2.413 2.472 . 0 0 "[ . 1 . 2]" 1
1530 1 63 LEU HA 1 63 LEU MD1 . . 3.650 2.985 2.142 3.078 . 0 0 "[ . 1 . 2]" 1
1531 1 63 LEU HA 1 63 LEU QD . . 2.980 2.836 2.037 2.909 . 0 0 "[ . 1 . 2]" 1
1532 1 63 LEU HA 1 63 LEU MD2 . . 3.650 3.542 2.552 3.621 . 0 0 "[ . 1 . 2]" 1
1533 1 63 LEU HA 1 63 LEU HG . . 3.730 2.377 2.274 3.759 0.029 8 0 "[ . 1 . 2]" 1
1534 1 63 LEU HA 1 64 THR H . . 2.400 2.160 2.138 2.294 . 0 0 "[ . 1 . 2]" 1
1535 1 63 LEU QB 1 63 LEU MD1 . . 2.690 2.188 2.118 2.210 . 0 0 "[ . 1 . 2]" 1
1536 1 63 LEU QB 1 63 LEU MD2 . . 2.690 2.052 1.944 2.330 . 0 0 "[ . 1 . 2]" 1
1537 1 63 LEU QB 1 64 THR H . . 3.420 3.266 2.650 3.439 0.019 11 0 "[ . 1 . 2]" 1
1538 1 63 LEU QD 1 64 THR H . . 4.240 4.099 2.878 4.261 0.021 14 0 "[ . 1 . 2]" 1
1539 1 63 LEU QD 1 64 THR MG . . 5.440 4.994 4.642 5.458 0.018 9 0 "[ . 1 . 2]" 1
1540 1 63 LEU MD1 1 64 THR H . . 4.830 4.711 2.916 4.837 0.007 11 0 "[ . 1 . 2]" 1
1541 1 63 LEU MD1 1 76 ILE HA . . 5.460 5.326 4.738 5.463 0.003 11 0 "[ . 1 . 2]" 1
1542 1 63 LEU MD2 1 64 THR H . . 4.830 4.565 4.194 4.737 . 0 0 "[ . 1 . 2]" 1
1543 1 63 LEU MD2 1 76 ILE HA . . 5.460 4.126 3.642 5.338 . 0 0 "[ . 1 . 2]" 1
1544 1 63 LEU HG 1 64 THR H . . 4.870 4.094 3.831 4.913 0.043 8 0 "[ . 1 . 2]" 1
1545 1 64 THR H 1 64 THR HB . . 3.550 3.088 2.427 3.563 0.013 8 0 "[ . 1 . 2]" 1
1546 1 64 THR H 1 64 THR MG . . 3.130 2.420 1.807 3.160 0.030 8 0 "[ . 1 . 2]" 1
1547 1 64 THR H 1 65 LEU H . . 4.590 4.564 4.474 4.617 0.027 12 0 "[ . 1 . 2]" 1
1548 1 64 THR HA 1 64 THR HB . . 2.750 2.506 2.301 2.672 . 0 0 "[ . 1 . 2]" 1
1549 1 64 THR HA 1 64 THR MG . . 3.200 2.769 2.078 3.200 0.000 20 0 "[ . 1 . 2]" 1
1550 1 64 THR HA 1 65 LEU H . . 2.600 2.202 2.151 2.276 . 0 0 "[ . 1 . 2]" 1
1551 1 64 THR HA 1 65 LEU HG . . 4.060 3.812 3.661 4.001 . 0 0 "[ . 1 . 2]" 1
1552 1 64 THR HA 1 66 ARG H . . 3.740 3.660 3.497 3.770 0.030 12 0 "[ . 1 . 2]" 1
1553 1 64 THR HB 1 65 LEU H . . 4.320 3.637 2.883 4.294 . 0 0 "[ . 1 . 2]" 1
1554 1 64 THR HB 1 66 ARG H . . 4.270 3.418 2.353 4.269 . 0 0 "[ . 1 . 2]" 1
1555 1 64 THR HB 1 66 ARG QB . . 4.580 3.741 2.520 4.511 . 0 0 "[ . 1 . 2]" 1
1556 1 64 THR MG 1 65 LEU H . . 4.140 3.749 3.286 4.144 0.004 10 0 "[ . 1 . 2]" 1
1557 1 64 THR MG 1 65 LEU MD2 . . 5.500 5.278 4.787 5.501 0.001 8 0 "[ . 1 . 2]" 1
1558 1 64 THR MG 1 66 ARG H . . 3.650 3.226 2.295 3.652 0.002 13 0 "[ . 1 . 2]" 1
1559 1 64 THR MG 1 66 ARG HA . . 5.500 5.170 4.348 5.515 0.015 8 0 "[ . 1 . 2]" 1
1560 1 64 THR MG 1 66 ARG QB . . 3.680 3.174 1.984 3.680 0.000 3 0 "[ . 1 . 2]" 1
1561 1 64 THR MG 1 66 ARG HD2 . . 5.320 3.686 1.900 4.759 . 0 0 "[ . 1 . 2]" 1
1562 1 64 THR MG 1 66 ARG QD . . 4.670 2.778 1.885 4.441 . 0 0 "[ . 1 . 2]" 1
1563 1 64 THR MG 1 66 ARG HD3 . . 5.320 3.155 1.946 5.318 . 0 0 "[ . 1 . 2]" 1
1564 1 64 THR MG 1 92 LEU MD2 . . 5.500 5.052 4.278 5.545 0.045 12 0 "[ . 1 . 2]" 1
1565 1 65 LEU H 1 65 LEU HB2 . . 3.110 2.471 2.379 2.579 . 0 0 "[ . 1 . 2]" 1
1566 1 65 LEU H 1 65 LEU HB3 . . 3.730 3.651 3.597 3.733 0.003 8 0 "[ . 1 . 2]" 1
1567 1 65 LEU H 1 65 LEU MD1 . . 3.950 3.799 3.602 3.948 . 0 0 "[ . 1 . 2]" 1
1568 1 65 LEU H 1 65 LEU MD2 . . 3.900 3.645 3.393 3.825 . 0 0 "[ . 1 . 2]" 1
1569 1 65 LEU H 1 65 LEU HG . . 3.110 2.661 2.463 2.873 . 0 0 "[ . 1 . 2]" 1
1570 1 65 LEU H 1 66 ARG H . . 2.710 2.445 2.120 2.717 0.007 14 0 "[ . 1 . 2]" 1
1571 1 65 LEU HA 1 65 LEU MD1 . . 4.600 3.878 3.803 3.913 . 0 0 "[ . 1 . 2]" 1
1572 1 65 LEU HA 1 65 LEU MD2 . . 2.470 2.158 1.979 2.358 . 0 0 "[ . 1 . 2]" 1
1573 1 65 LEU HA 1 65 LEU HG . . 3.340 3.095 2.997 3.232 . 0 0 "[ . 1 . 2]" 1
1574 1 65 LEU HA 1 66 ARG H . . 3.330 3.175 3.066 3.306 . 0 0 "[ . 1 . 2]" 1
1575 1 65 LEU HA 1 66 ARG QB . . 5.270 5.027 4.828 5.243 . 0 0 "[ . 1 . 2]" 1
1576 1 65 LEU HA 1 68 LYS H . . 4.750 4.011 3.211 4.745 . 0 0 "[ . 1 . 2]" 1
1577 1 65 LEU HA 1 68 LYS HB2 . . 3.890 2.619 2.094 2.907 . 0 0 "[ . 1 . 2]" 1
1578 1 65 LEU HA 1 68 LYS HB3 . . 4.100 3.817 3.490 4.062 . 0 0 "[ . 1 . 2]" 1
1579 1 65 LEU HA 1 68 LYS HD2 . . 5.270 4.480 4.271 4.694 . 0 0 "[ . 1 . 2]" 1
1580 1 65 LEU HA 1 68 LYS QD . . 4.470 4.153 3.989 4.384 . 0 0 "[ . 1 . 2]" 1
1581 1 65 LEU HA 1 68 LYS HD3 . . 5.270 4.946 4.485 5.265 . 0 0 "[ . 1 . 2]" 1
1582 1 65 LEU HA 1 68 LYS HE2 . . 4.870 4.357 3.264 4.875 0.005 16 0 "[ . 1 . 2]" 1
1583 1 65 LEU HA 1 68 LYS HE3 . . 4.870 4.344 3.705 4.861 . 0 0 "[ . 1 . 2]" 1
1584 1 65 LEU HA 1 68 LYS QG . . 3.090 2.080 1.906 2.306 . 0 0 "[ . 1 . 2]" 1
1585 1 65 LEU HA 1 73 ALA MB . . 4.890 4.358 4.039 4.622 . 0 0 "[ . 1 . 2]" 1
1586 1 65 LEU HA 1 76 ILE MD . . 4.130 3.516 3.175 3.978 . 0 0 "[ . 1 . 2]" 1
1587 1 65 LEU HB2 1 65 LEU MD1 . . 3.030 2.258 2.130 2.441 . 0 0 "[ . 1 . 2]" 1
1588 1 65 LEU HB2 1 66 ARG H . . 4.080 3.691 3.431 3.884 . 0 0 "[ . 1 . 2]" 1
1589 1 65 LEU HB2 1 73 ALA MB . . 4.590 4.251 3.905 4.534 . 0 0 "[ . 1 . 2]" 1
1590 1 65 LEU HB3 1 65 LEU MD1 . . 2.980 2.388 2.217 2.503 . 0 0 "[ . 1 . 2]" 1
1591 1 65 LEU HB3 1 65 LEU MD2 . . 3.160 2.286 2.158 2.412 . 0 0 "[ . 1 . 2]" 1
1592 1 65 LEU HB3 1 66 ARG H . . 4.400 4.323 4.187 4.406 0.006 16 0 "[ . 1 . 2]" 1
1593 1 65 LEU HB3 1 68 LYS H . . 4.390 4.160 3.639 4.398 0.008 20 0 "[ . 1 . 2]" 1
1594 1 65 LEU HB3 1 73 ALA MB . . 4.400 3.090 2.682 3.356 . 0 0 "[ . 1 . 2]" 1
1595 1 65 LEU MD1 1 66 ARG H . . 5.500 5.303 5.168 5.437 . 0 0 "[ . 1 . 2]" 1
1596 1 65 LEU MD1 1 73 ALA H . . 5.500 4.914 4.528 5.166 . 0 0 "[ . 1 . 2]" 1
1597 1 65 LEU MD1 1 73 ALA MB . . 2.900 2.046 1.761 2.411 . 0 0 "[ . 1 . 2]" 1
1598 1 65 LEU MD2 1 66 ARG H . . 4.810 4.712 4.578 4.829 0.019 19 0 "[ . 1 . 2]" 1
1599 1 65 LEU MD2 1 68 LYS H . . 5.460 4.851 4.188 5.343 . 0 0 "[ . 1 . 2]" 1
1600 1 65 LEU MD2 1 68 LYS HB2 . . 4.050 2.761 1.977 3.233 . 0 0 "[ . 1 . 2]" 1
1601 1 65 LEU MD2 1 68 LYS HE2 . . 5.500 4.686 3.698 5.419 . 0 0 "[ . 1 . 2]" 1
1602 1 65 LEU MD2 1 68 LYS HE3 . . 5.500 4.068 3.297 4.805 . 0 0 "[ . 1 . 2]" 1
1603 1 65 LEU MD2 1 68 LYS QG . . 3.820 2.722 1.996 3.254 . 0 0 "[ . 1 . 2]" 1
1604 1 65 LEU MD2 1 73 ALA H . . 4.160 3.870 3.675 4.102 . 0 0 "[ . 1 . 2]" 1
1605 1 65 LEU MD2 1 73 ALA HA . . 2.810 2.196 1.921 2.501 . 0 0 "[ . 1 . 2]" 1
1606 1 65 LEU MD2 1 73 ALA MB . . 3.530 1.968 1.821 2.277 . 0 0 "[ . 1 . 2]" 1
1607 1 65 LEU MD2 1 76 ILE MD . . 3.000 1.847 1.748 2.050 . 0 0 "[ . 1 . 2]" 1
1608 1 66 ARG H 1 66 ARG HA . . 2.920 2.773 2.682 2.833 . 0 0 "[ . 1 . 2]" 1
1609 1 66 ARG H 1 66 ARG QB . . 2.420 2.217 2.108 2.360 . 0 0 "[ . 1 . 2]" 1
1610 1 66 ARG H 1 66 ARG HD2 . . 5.100 4.012 2.214 5.105 0.005 13 0 "[ . 1 . 2]" 1
1611 1 66 ARG H 1 66 ARG HD3 . . 5.100 3.778 2.383 5.005 . 0 0 "[ . 1 . 2]" 1
1612 1 66 ARG H 1 66 ARG HG2 . . 4.360 3.500 2.455 4.368 0.008 13 0 "[ . 1 . 2]" 1
1613 1 66 ARG H 1 66 ARG QG . . 3.560 2.889 2.427 3.665 0.105 13 0 "[ . 1 . 2]" 1
1614 1 66 ARG H 1 66 ARG HG3 . . 4.360 3.527 2.532 4.130 . 0 0 "[ . 1 . 2]" 1
1615 1 66 ARG H 1 67 GLY H . . 4.620 3.878 2.723 4.607 . 0 0 "[ . 1 . 2]" 1
1616 1 66 ARG H 1 68 LYS HB2 . . 5.440 4.887 4.486 5.184 . 0 0 "[ . 1 . 2]" 1
1617 1 66 ARG H 1 68 LYS QG . . 5.500 4.007 3.609 4.239 . 0 0 "[ . 1 . 2]" 1
1618 1 66 ARG HA 1 66 ARG QB . . 2.640 2.337 2.161 2.505 . 0 0 "[ . 1 . 2]" 1
1619 1 66 ARG HA 1 66 ARG HD2 . . 5.310 4.340 2.629 4.702 . 0 0 "[ . 1 . 2]" 1
1620 1 66 ARG HA 1 66 ARG QD . . 4.460 3.921 2.549 4.271 . 0 0 "[ . 1 . 2]" 1
1621 1 66 ARG HA 1 66 ARG HD3 . . 5.310 4.526 3.424 5.043 . 0 0 "[ . 1 . 2]" 1
1622 1 66 ARG HA 1 66 ARG QG . . 3.510 2.796 2.167 3.434 . 0 0 "[ . 1 . 2]" 1
1623 1 66 ARG HA 1 67 GLY QA . . 4.480 4.068 3.917 4.294 . 0 0 "[ . 1 . 2]" 1
1624 1 66 ARG HA 1 68 LYS H . . 4.380 3.786 3.344 4.334 . 0 0 "[ . 1 . 2]" 1
1625 1 66 ARG HA 1 68 LYS QG . . 5.500 4.947 4.398 5.507 0.007 5 0 "[ . 1 . 2]" 1
1626 1 66 ARG QB 1 67 GLY H . . 3.600 3.270 2.299 3.551 . 0 0 "[ . 1 . 2]" 1
1627 1 66 ARG QB 1 67 GLY QA . . 4.670 3.930 3.472 4.296 . 0 0 "[ . 1 . 2]" 1
1628 1 66 ARG QG 1 67 GLY H . . 4.210 3.086 1.876 4.076 . 0 0 "[ . 1 . 2]" 1
1629 1 66 ARG QG 1 67 GLY QA . . 4.740 3.947 2.903 4.807 0.067 18 0 "[ . 1 . 2]" 1
1630 1 66 ARG HG2 1 67 GLY H . . 4.990 3.510 1.898 4.998 0.008 12 0 "[ . 1 . 2]" 1
1631 1 66 ARG HG3 1 67 GLY H . . 4.990 3.784 1.974 4.970 . 0 0 "[ . 1 . 2]" 1
1632 1 67 GLY H 1 68 LYS H . . 2.940 2.683 2.452 2.946 0.006 13 0 "[ . 1 . 2]" 1
1633 1 67 GLY QA 1 68 LYS HB2 . . 5.310 4.933 4.847 5.022 . 0 0 "[ . 1 . 2]" 1
1634 1 67 GLY HA2 1 68 LYS H . . 3.550 2.976 2.786 3.351 . 0 0 "[ . 1 . 2]" 1
1635 1 67 GLY HA3 1 68 LYS H . . 3.550 3.468 3.193 3.546 . 0 0 "[ . 1 . 2]" 1
1636 1 68 LYS H 1 68 LYS HB2 . . 2.690 2.576 2.388 2.693 0.003 19 0 "[ . 1 . 2]" 1
1637 1 68 LYS H 1 68 LYS HB3 . . 3.790 3.732 3.623 3.800 0.010 5 0 "[ . 1 . 2]" 1
1638 1 68 LYS H 1 68 LYS HD2 . . 5.460 5.096 4.870 5.186 . 0 0 "[ . 1 . 2]" 1
1639 1 68 LYS H 1 68 LYS QD . . 4.680 4.239 4.018 4.474 . 0 0 "[ . 1 . 2]" 1
1640 1 68 LYS H 1 68 LYS HD3 . . 5.460 4.539 4.280 4.919 . 0 0 "[ . 1 . 2]" 1
1641 1 68 LYS H 1 68 LYS QG . . 3.220 2.810 2.435 2.996 . 0 0 "[ . 1 . 2]" 1
1642 1 68 LYS H 1 69 GLU H . . 4.580 4.474 4.394 4.566 . 0 0 "[ . 1 . 2]" 1
1643 1 68 LYS HA 1 68 LYS HD2 . . 4.110 3.258 2.990 3.462 . 0 0 "[ . 1 . 2]" 1
1644 1 68 LYS HA 1 68 LYS QD . . 3.540 2.445 2.272 2.671 . 0 0 "[ . 1 . 2]" 1
1645 1 68 LYS HA 1 68 LYS HD3 . . 4.110 2.532 2.320 2.846 . 0 0 "[ . 1 . 2]" 1
1646 1 68 LYS HA 1 68 LYS QG . . 3.340 2.722 2.562 2.856 . 0 0 "[ . 1 . 2]" 1
1647 1 68 LYS HA 1 69 GLU H . . 2.550 2.242 2.156 2.432 . 0 0 "[ . 1 . 2]" 1
1648 1 68 LYS HA 1 69 GLU HB2 . . 4.900 4.824 4.708 4.876 . 0 0 "[ . 1 . 2]" 1
1649 1 68 LYS HA 1 69 GLU HG2 . . 5.250 4.357 4.122 4.592 . 0 0 "[ . 1 . 2]" 1
1650 1 68 LYS HA 1 69 GLU HG3 . . 4.080 3.750 3.594 3.852 . 0 0 "[ . 1 . 2]" 1
1651 1 68 LYS HA 1 72 GLU HB3 . . 4.120 3.646 3.263 3.977 . 0 0 "[ . 1 . 2]" 1
1652 1 68 LYS HA 1 72 GLU QG . . 4.250 3.823 3.082 4.257 0.007 11 0 "[ . 1 . 2]" 1
1653 1 68 LYS HA 1 76 ILE MD . . 5.420 5.100 4.615 5.410 . 0 0 "[ . 1 . 2]" 1
1654 1 68 LYS HB2 1 68 LYS HE2 . . 5.100 4.710 4.204 5.216 0.116 16 0 "[ . 1 . 2]" 1
1655 1 68 LYS HB2 1 68 LYS QE . . 4.430 4.172 4.022 4.483 0.053 16 0 "[ . 1 . 2]" 1
1656 1 68 LYS HB2 1 68 LYS HE3 . . 5.100 4.692 4.371 5.129 0.029 10 0 "[ . 1 . 2]" 1
1657 1 68 LYS HB2 1 69 GLU H . . 4.260 3.959 3.517 4.242 . 0 0 "[ . 1 . 2]" 1
1658 1 68 LYS HB2 1 72 GLU QG . . 5.120 4.598 4.202 4.868 . 0 0 "[ . 1 . 2]" 1
1659 1 68 LYS HB2 1 73 ALA H . . 5.500 4.636 4.302 5.081 . 0 0 "[ . 1 . 2]" 1
1660 1 68 LYS HB2 1 73 ALA HA . . 5.500 4.685 4.205 5.092 . 0 0 "[ . 1 . 2]" 1
1661 1 68 LYS HB3 1 68 LYS QD . . 3.270 2.150 2.024 2.243 . 0 0 "[ . 1 . 2]" 1
1662 1 68 LYS HB3 1 69 GLU H . . 3.350 2.898 2.382 3.272 . 0 0 "[ . 1 . 2]" 1
1663 1 68 LYS HB3 1 72 GLU HB3 . . 3.400 2.180 2.026 2.424 . 0 0 "[ . 1 . 2]" 1
1664 1 68 LYS HB3 1 72 GLU QG . . 3.470 3.087 2.689 3.412 . 0 0 "[ . 1 . 2]" 1
1665 1 68 LYS HB3 1 73 ALA H . . 4.060 3.712 3.470 4.056 . 0 0 "[ . 1 . 2]" 1
1666 1 68 LYS HB3 1 73 ALA HA . . 4.550 4.175 3.799 4.557 0.007 12 0 "[ . 1 . 2]" 1
1667 1 68 LYS QD 1 69 GLU H . . 3.920 3.622 3.382 3.766 . 0 0 "[ . 1 . 2]" 1
1668 1 68 LYS QD 1 72 GLU HB2 . . 4.330 3.716 3.460 3.965 . 0 0 "[ . 1 . 2]" 1
1669 1 68 LYS QD 1 72 GLU HB3 . . 3.750 2.753 2.487 3.065 . 0 0 "[ . 1 . 2]" 1
1670 1 68 LYS QD 1 72 GLU QG . . 3.000 1.945 1.757 2.044 . 0 0 "[ . 1 . 2]" 1
1671 1 68 LYS QD 1 76 ILE MD . . 2.810 2.589 2.087 2.815 0.005 16 0 "[ . 1 . 2]" 1
1672 1 68 LYS HD2 1 69 GLU H . . 4.590 4.088 3.789 4.417 . 0 0 "[ . 1 . 2]" 1
1673 1 68 LYS HD2 1 72 GLU HB2 . . 4.970 3.924 3.692 4.257 . 0 0 "[ . 1 . 2]" 1
1674 1 68 LYS HD2 1 72 GLU HB3 . . 4.370 2.814 2.515 3.191 . 0 0 "[ . 1 . 2]" 1
1675 1 68 LYS HD2 1 72 GLU QG . . 3.470 1.990 1.845 2.118 . 0 0 "[ . 1 . 2]" 1
1676 1 68 LYS HD3 1 69 GLU H . . 4.590 4.068 3.646 4.314 . 0 0 "[ . 1 . 2]" 1
1677 1 68 LYS HD3 1 72 GLU HB2 . . 4.970 4.625 4.126 4.941 . 0 0 "[ . 1 . 2]" 1
1678 1 68 LYS HD3 1 72 GLU HB3 . . 4.370 3.936 3.541 4.312 . 0 0 "[ . 1 . 2]" 1
1679 1 68 LYS HD3 1 72 GLU QG . . 3.470 2.842 2.207 3.479 0.009 11 0 "[ . 1 . 2]" 1
1680 1 68 LYS QE 1 72 GLU QG . . 3.810 3.394 2.903 3.669 . 0 0 "[ . 1 . 2]" 1
1681 1 68 LYS QE 1 76 ILE MD . . 3.390 2.416 2.025 2.755 . 0 0 "[ . 1 . 2]" 1
1682 1 68 LYS HE2 1 68 LYS QG . . 3.320 2.380 2.057 3.294 . 0 0 "[ . 1 . 2]" 1
1683 1 68 LYS HE2 1 72 GLU QG . . 4.580 4.306 2.967 4.590 0.010 11 0 "[ . 1 . 2]" 1
1684 1 68 LYS HE2 1 76 ILE MD . . 4.130 3.668 2.440 4.089 . 0 0 "[ . 1 . 2]" 1
1685 1 68 LYS HE3 1 68 LYS QG . . 3.320 2.541 2.179 3.225 . 0 0 "[ . 1 . 2]" 1
1686 1 68 LYS HE3 1 72 GLU QG . . 4.580 3.608 3.027 4.118 . 0 0 "[ . 1 . 2]" 1
1687 1 68 LYS HE3 1 76 ILE MD . . 4.130 2.508 2.036 3.744 . 0 0 "[ . 1 . 2]" 1
1688 1 68 LYS QG 1 69 GLU H . . 4.490 4.425 4.269 4.501 0.011 5 0 "[ . 1 . 2]" 1
1689 1 68 LYS QG 1 72 GLU HB3 . . 4.170 4.135 4.014 4.173 0.003 11 0 "[ . 1 . 2]" 1
1690 1 68 LYS QG 1 72 GLU QG . . 3.950 3.869 3.621 3.952 0.002 10 0 "[ . 1 . 2]" 1
1691 1 68 LYS QG 1 76 ILE MD . . 3.560 2.908 2.375 3.314 . 0 0 "[ . 1 . 2]" 1
1692 1 69 GLU H 1 69 GLU HB2 . . 3.340 2.623 2.518 2.691 . 0 0 "[ . 1 . 2]" 1
1693 1 69 GLU H 1 69 GLU HB3 . . 3.740 3.635 3.589 3.714 . 0 0 "[ . 1 . 2]" 1
1694 1 69 GLU H 1 69 GLU HG2 . . 3.480 3.087 2.852 3.410 . 0 0 "[ . 1 . 2]" 1
1695 1 69 GLU H 1 69 GLU HG3 . . 3.120 2.294 2.060 2.716 . 0 0 "[ . 1 . 2]" 1
1696 1 69 GLU H 1 72 GLU H . . 4.080 3.654 3.428 3.950 . 0 0 "[ . 1 . 2]" 1
1697 1 69 GLU H 1 72 GLU HB2 . . 3.590 2.656 2.329 2.969 . 0 0 "[ . 1 . 2]" 1
1698 1 69 GLU H 1 72 GLU HB3 . . 3.520 2.721 2.130 3.184 . 0 0 "[ . 1 . 2]" 1
1699 1 69 GLU H 1 72 GLU QG . . 4.110 3.684 3.102 4.013 . 0 0 "[ . 1 . 2]" 1
1700 1 69 GLU HA 1 69 GLU HG2 . . 3.110 2.567 2.484 2.647 . 0 0 "[ . 1 . 2]" 1
1701 1 69 GLU HA 1 69 GLU HG3 . . 3.510 3.417 3.305 3.503 . 0 0 "[ . 1 . 2]" 1
1702 1 69 GLU HA 1 70 HIS H . . 3.140 2.241 2.199 2.304 . 0 0 "[ . 1 . 2]" 1
1703 1 69 GLU HA 1 70 HIS HB2 . . 5.500 4.995 4.978 5.018 . 0 0 "[ . 1 . 2]" 1
1704 1 69 GLU HA 1 70 HIS HB3 . . 5.500 4.510 4.453 4.600 . 0 0 "[ . 1 . 2]" 1
1705 1 69 GLU HA 1 71 ARG H . . 5.300 4.256 4.127 4.436 . 0 0 "[ . 1 . 2]" 1
1706 1 69 GLU HA 1 72 GLU H . . 4.670 4.506 4.374 4.666 . 0 0 "[ . 1 . 2]" 1
1707 1 69 GLU HB2 1 69 GLU HG3 . . 2.670 2.342 2.291 2.391 . 0 0 "[ . 1 . 2]" 1
1708 1 69 GLU HB2 1 70 HIS H . . 3.890 3.814 3.705 3.893 0.003 20 0 "[ . 1 . 2]" 1
1709 1 69 GLU HB2 1 71 ARG H . . 3.730 3.246 3.089 3.401 . 0 0 "[ . 1 . 2]" 1
1710 1 69 GLU HB2 1 71 ARG QD . . 5.500 4.288 2.922 5.093 . 0 0 "[ . 1 . 2]" 1
1711 1 69 GLU HB2 1 71 ARG QG . . 5.340 4.482 2.045 5.341 0.001 18 0 "[ . 1 . 2]" 1
1712 1 69 GLU HB2 1 72 GLU H . . 2.950 2.549 2.469 2.645 . 0 0 "[ . 1 . 2]" 1
1713 1 69 GLU HB2 1 72 GLU HB2 . . 3.380 2.853 2.629 2.975 . 0 0 "[ . 1 . 2]" 1
1714 1 69 GLU HB3 1 69 GLU HG2 . . 2.780 2.554 2.496 2.624 . 0 0 "[ . 1 . 2]" 1
1715 1 69 GLU HB3 1 69 GLU HG3 . . 2.990 2.993 2.971 3.006 0.016 18 0 "[ . 1 . 2]" 1
1716 1 69 GLU HB3 1 70 HIS H . . 4.080 2.895 2.698 3.051 . 0 0 "[ . 1 . 2]" 1
1717 1 69 GLU HB3 1 71 ARG H . . 4.760 3.185 3.074 3.356 . 0 0 "[ . 1 . 2]" 1
1718 1 69 GLU HB3 1 72 GLU H . . 3.890 3.842 3.670 3.897 0.007 16 0 "[ . 1 . 2]" 1
1719 1 69 GLU HG2 1 70 HIS H . . 5.240 4.458 4.244 4.568 . 0 0 "[ . 1 . 2]" 1
1720 1 69 GLU HG2 1 72 GLU H . . 5.470 5.391 5.314 5.478 0.008 12 0 "[ . 1 . 2]" 1
1721 1 69 GLU HG3 1 72 GLU H . . 4.690 4.547 4.405 4.681 . 0 0 "[ . 1 . 2]" 1
1722 1 69 GLU HG3 1 72 GLU HB3 . . 4.880 4.604 4.298 4.810 . 0 0 "[ . 1 . 2]" 1
1723 1 70 HIS H 1 70 HIS HB2 . . 3.750 2.821 2.794 2.851 . 0 0 "[ . 1 . 2]" 1
1724 1 70 HIS H 1 70 HIS QB . . 3.080 2.233 2.201 2.254 . 0 0 "[ . 1 . 2]" 1
1725 1 70 HIS H 1 70 HIS HB3 . . 3.750 2.342 2.291 2.377 . 0 0 "[ . 1 . 2]" 1
1726 1 70 HIS H 1 71 ARG H . . 3.790 3.021 2.959 3.093 . 0 0 "[ . 1 . 2]" 1
1727 1 70 HIS HA 1 70 HIS HD2 . . 4.730 4.451 4.206 4.656 . 0 0 "[ . 1 . 2]" 1
1728 1 70 HIS HA 1 71 ARG HA . . 5.500 4.790 4.757 4.818 . 0 0 "[ . 1 . 2]" 1
1729 1 70 HIS HA 1 73 ALA H . . 3.690 3.593 3.427 3.690 . 0 0 "[ . 1 . 2]" 1
1730 1 70 HIS HA 1 73 ALA MB . . 2.980 2.749 2.576 2.965 . 0 0 "[ . 1 . 2]" 1
1731 1 70 HIS HA 1 74 ALA H . . 4.430 4.143 3.942 4.426 . 0 0 "[ . 1 . 2]" 1
1732 1 70 HIS QB 1 73 ALA MB . . 5.180 4.361 4.237 4.524 . 0 0 "[ . 1 . 2]" 1
1733 1 70 HIS HB2 1 71 ARG H . . 4.090 4.037 3.970 4.082 . 0 0 "[ . 1 . 2]" 1
1734 1 70 HIS HB3 1 71 ARG H . . 4.090 2.742 2.642 2.807 . 0 0 "[ . 1 . 2]" 1
1735 1 70 HIS HD2 1 71 ARG HA . . 3.550 2.814 2.284 3.381 . 0 0 "[ . 1 . 2]" 1
1736 1 70 HIS HD2 1 71 ARG HG2 . . 5.310 4.455 3.904 5.084 . 0 0 "[ . 1 . 2]" 1
1737 1 70 HIS HD2 1 71 ARG QG . . 4.630 4.079 3.703 4.372 . 0 0 "[ . 1 . 2]" 1
1738 1 70 HIS HD2 1 71 ARG HG3 . . 5.310 4.835 4.519 5.238 . 0 0 "[ . 1 . 2]" 1
1739 1 70 HIS HD2 1 74 ALA MB . . 4.980 4.299 3.660 4.794 . 0 0 "[ . 1 . 2]" 1
1740 1 70 HIS HE1 1 74 ALA MB . . 4.300 4.167 3.912 4.304 0.004 12 0 "[ . 1 . 2]" 1
1741 1 71 ARG H 1 71 ARG HB2 . . 3.590 2.716 2.276 3.593 0.003 19 0 "[ . 1 . 2]" 1
1742 1 71 ARG H 1 71 ARG QB . . 2.850 2.296 2.182 2.619 . 0 0 "[ . 1 . 2]" 1
1743 1 71 ARG H 1 71 ARG HB3 . . 3.590 2.615 2.397 2.798 . 0 0 "[ . 1 . 2]" 1
1744 1 71 ARG H 1 71 ARG QD . . 4.560 4.244 3.735 4.565 0.005 12 0 "[ . 1 . 2]" 1
1745 1 71 ARG H 1 71 ARG HG2 . . 4.590 3.983 2.194 4.424 . 0 0 "[ . 1 . 2]" 1
1746 1 71 ARG H 1 71 ARG QG . . 4.010 3.510 2.059 4.012 0.002 1 0 "[ . 1 . 2]" 1
1747 1 71 ARG H 1 71 ARG HG3 . . 4.590 4.017 2.081 4.596 0.006 3 0 "[ . 1 . 2]" 1
1748 1 71 ARG H 1 72 GLU H . . 3.050 2.729 2.627 2.860 . 0 0 "[ . 1 . 2]" 1
1749 1 71 ARG H 1 73 ALA H . . 4.320 4.124 3.994 4.312 . 0 0 "[ . 1 . 2]" 1
1750 1 71 ARG HA 1 71 ARG HB2 . . 3.020 2.499 2.388 2.590 . 0 0 "[ . 1 . 2]" 1
1751 1 71 ARG HA 1 71 ARG QB . . 2.470 2.340 2.177 2.445 . 0 0 "[ . 1 . 2]" 1
1752 1 71 ARG HA 1 71 ARG HB3 . . 3.020 2.872 2.379 3.023 0.003 1 0 "[ . 1 . 2]" 1
1753 1 71 ARG HA 1 71 ARG QD . . 4.300 3.484 2.644 4.305 0.005 9 0 "[ . 1 . 2]" 1
1754 1 71 ARG HA 1 71 ARG HG2 . . 4.230 2.839 2.244 4.227 . 0 0 "[ . 1 . 2]" 1
1755 1 71 ARG HA 1 71 ARG QG . . 3.450 2.616 2.219 3.435 . 0 0 "[ . 1 . 2]" 1
1756 1 71 ARG HA 1 71 ARG HG3 . . 4.230 3.523 2.929 3.686 . 0 0 "[ . 1 . 2]" 1
1757 1 71 ARG HA 1 72 GLU H . . 3.570 3.550 3.518 3.569 . 0 0 "[ . 1 . 2]" 1
1758 1 71 ARG HA 1 74 ALA H . . 3.660 3.563 3.424 3.654 . 0 0 "[ . 1 . 2]" 1
1759 1 71 ARG HA 1 74 ALA MB . . 2.830 2.702 2.465 2.811 . 0 0 "[ . 1 . 2]" 1
1760 1 71 ARG HA 1 75 ARG H . . 4.870 4.675 4.568 4.865 . 0 0 "[ . 1 . 2]" 1
1761 1 71 ARG QB 1 71 ARG QD . . 2.870 2.191 2.037 2.359 . 0 0 "[ . 1 . 2]" 1
1762 1 71 ARG QB 1 72 GLU H . . 3.820 2.642 2.291 3.430 . 0 0 "[ . 1 . 2]" 1
1763 1 71 ARG HB2 1 71 ARG QD . . 3.420 2.981 2.077 3.400 . 0 0 "[ . 1 . 2]" 1
1764 1 71 ARG HB2 1 74 ALA MB . . 5.170 4.730 4.082 5.011 . 0 0 "[ . 1 . 2]" 1
1765 1 71 ARG HB3 1 71 ARG QD . . 3.420 2.452 2.089 3.417 . 0 0 "[ . 1 . 2]" 1
1766 1 71 ARG HB3 1 74 ALA MB . . 5.170 5.004 4.484 5.176 0.006 12 0 "[ . 1 . 2]" 1
1767 1 71 ARG QD 1 72 GLU H . . 3.990 3.185 2.389 3.844 . 0 0 "[ . 1 . 2]" 1
1768 1 71 ARG QD 1 72 GLU QG . . 5.350 4.709 3.870 5.352 0.002 12 0 "[ . 1 . 2]" 1
1769 1 71 ARG QD 1 74 ALA MB . . 5.500 4.408 3.196 5.505 0.005 11 0 "[ . 1 . 2]" 1
1770 1 71 ARG QG 1 72 GLU H . . 4.280 3.529 1.882 4.280 0.000 3 0 "[ . 1 . 2]" 1
1771 1 71 ARG QG 1 72 GLU HA . . 5.340 4.371 3.265 4.940 . 0 0 "[ . 1 . 2]" 1
1772 1 71 ARG HG2 1 72 GLU H . . 4.930 4.182 3.103 4.882 . 0 0 "[ . 1 . 2]" 1
1773 1 71 ARG HG3 1 72 GLU H . . 4.930 4.081 1.898 4.931 0.001 2 0 "[ . 1 . 2]" 1
1774 1 72 GLU H 1 72 GLU HB2 . . 2.740 2.231 2.175 2.296 . 0 0 "[ . 1 . 2]" 1
1775 1 72 GLU H 1 72 GLU HB3 . . 2.960 2.867 2.782 2.962 0.002 4 0 "[ . 1 . 2]" 1
1776 1 72 GLU H 1 72 GLU QG . . 4.050 4.018 3.909 4.055 0.005 17 0 "[ . 1 . 2]" 1
1777 1 72 GLU H 1 73 ALA H . . 2.830 2.713 2.581 2.822 . 0 0 "[ . 1 . 2]" 1
1778 1 72 GLU H 1 73 ALA MB . . 4.470 4.343 4.166 4.464 . 0 0 "[ . 1 . 2]" 1
1779 1 72 GLU H 1 74 ALA H . . 4.520 4.375 4.069 4.526 0.006 5 0 "[ . 1 . 2]" 1
1780 1 72 GLU HA 1 72 GLU HB2 . . 2.780 2.625 2.577 2.649 . 0 0 "[ . 1 . 2]" 1
1781 1 72 GLU HA 1 72 GLU HB3 . . 3.000 2.993 2.983 3.008 0.008 8 0 "[ . 1 . 2]" 1
1782 1 72 GLU HA 1 72 GLU QG . . 3.030 2.526 2.168 2.748 . 0 0 "[ . 1 . 2]" 1
1783 1 72 GLU HA 1 73 ALA H . . 3.540 3.528 3.511 3.546 0.006 15 0 "[ . 1 . 2]" 1
1784 1 72 GLU HA 1 75 ARG H . . 3.840 3.773 3.685 3.819 . 0 0 "[ . 1 . 2]" 1
1785 1 72 GLU HA 1 75 ARG HB3 . . 3.400 3.350 3.251 3.416 0.016 11 0 "[ . 1 . 2]" 1
1786 1 72 GLU HA 1 75 ARG QD . . 4.240 3.966 3.820 4.137 . 0 0 "[ . 1 . 2]" 1
1787 1 72 GLU HA 1 76 ILE H . . 4.680 4.572 4.474 4.652 . 0 0 "[ . 1 . 2]" 1
1788 1 72 GLU HA 1 76 ILE MD . . 4.570 4.412 4.220 4.530 . 0 0 "[ . 1 . 2]" 1
1789 1 72 GLU HB2 1 72 GLU QG . . 2.540 2.404 2.320 2.471 . 0 0 "[ . 1 . 2]" 1
1790 1 72 GLU HB2 1 73 ALA H . . 3.720 3.641 3.546 3.706 . 0 0 "[ . 1 . 2]" 1
1791 1 72 GLU HB2 1 76 ILE MD . . 4.830 4.741 4.609 4.836 0.006 16 0 "[ . 1 . 2]" 1
1792 1 72 GLU HB3 1 72 GLU QG . . 2.490 2.168 2.142 2.228 . 0 0 "[ . 1 . 2]" 1
1793 1 72 GLU HB3 1 73 ALA H . . 3.200 2.665 2.530 2.778 . 0 0 "[ . 1 . 2]" 1
1794 1 72 GLU HB3 1 73 ALA HA . . 4.370 3.989 3.944 4.032 . 0 0 "[ . 1 . 2]" 1
1795 1 72 GLU HB3 1 73 ALA MB . . 4.370 3.902 3.831 3.966 . 0 0 "[ . 1 . 2]" 1
1796 1 72 GLU HB3 1 76 ILE MD . . 4.590 3.458 3.281 3.599 . 0 0 "[ . 1 . 2]" 1
1797 1 72 GLU QG 1 73 ALA H . . 4.200 4.085 3.899 4.204 0.004 12 0 "[ . 1 . 2]" 1
1798 1 72 GLU QG 1 73 ALA HA . . 4.450 4.324 4.105 4.438 . 0 0 "[ . 1 . 2]" 1
1799 1 72 GLU QG 1 73 ALA MB . . 4.980 4.839 4.687 4.966 . 0 0 "[ . 1 . 2]" 1
1800 1 72 GLU QG 1 75 ARG HD2 . . 5.500 5.103 4.474 5.462 . 0 0 "[ . 1 . 2]" 1
1801 1 72 GLU QG 1 75 ARG HD3 . . 5.500 4.366 3.861 4.829 . 0 0 "[ . 1 . 2]" 1
1802 1 72 GLU QG 1 76 ILE H . . 4.820 4.619 4.399 4.788 . 0 0 "[ . 1 . 2]" 1
1803 1 72 GLU QG 1 76 ILE MD . . 2.960 2.636 2.457 2.855 . 0 0 "[ . 1 . 2]" 1
1804 1 72 GLU QG 1 76 ILE HG12 . . 4.530 4.353 4.169 4.535 0.005 16 0 "[ . 1 . 2]" 1
1805 1 72 GLU QG 1 76 ILE HG13 . . 3.640 3.427 3.250 3.632 . 0 0 "[ . 1 . 2]" 1
1806 1 73 ALA H 1 73 ALA MB . . 2.480 2.152 2.027 2.238 . 0 0 "[ . 1 . 2]" 1
1807 1 73 ALA H 1 74 ALA MB . . 4.330 4.255 4.165 4.321 . 0 0 "[ . 1 . 2]" 1
1808 1 73 ALA H 1 75 ARG H . . 4.210 4.126 4.058 4.186 . 0 0 "[ . 1 . 2]" 1
1809 1 73 ALA H 1 76 ILE MD . . 4.350 3.949 3.839 4.036 . 0 0 "[ . 1 . 2]" 1
1810 1 73 ALA HA 1 76 ILE H . . 3.460 3.175 3.096 3.233 . 0 0 "[ . 1 . 2]" 1
1811 1 73 ALA HA 1 76 ILE HA . . 5.470 5.123 5.078 5.177 . 0 0 "[ . 1 . 2]" 1
1812 1 73 ALA HA 1 76 ILE HB . . 2.890 2.553 2.462 2.618 . 0 0 "[ . 1 . 2]" 1
1813 1 73 ALA HA 1 76 ILE MD . . 2.850 2.055 1.965 2.297 . 0 0 "[ . 1 . 2]" 1
1814 1 73 ALA HA 1 76 ILE HG12 . . 4.520 4.468 4.404 4.515 . 0 0 "[ . 1 . 2]" 1
1815 1 73 ALA HA 1 76 ILE HG13 . . 3.550 3.352 3.208 3.425 . 0 0 "[ . 1 . 2]" 1
1816 1 73 ALA HA 1 76 ILE MG . . 4.010 3.963 3.884 4.010 . 0 0 "[ . 1 . 2]" 1
1817 1 73 ALA HA 1 77 ILE H . . 4.060 3.934 3.791 4.014 . 0 0 "[ . 1 . 2]" 1
1818 1 73 ALA HA 1 77 ILE HG13 . . 4.250 4.115 3.936 4.241 . 0 0 "[ . 1 . 2]" 1
1819 1 73 ALA MB 1 74 ALA H . . 2.820 2.453 2.319 2.651 . 0 0 "[ . 1 . 2]" 1
1820 1 73 ALA MB 1 75 ARG H . . 4.430 4.350 4.281 4.431 0.001 9 0 "[ . 1 . 2]" 1
1821 1 73 ALA MB 1 76 ILE H . . 4.470 4.415 4.323 4.473 0.003 11 0 "[ . 1 . 2]" 1
1822 1 73 ALA MB 1 76 ILE HB . . 3.900 3.784 3.715 3.832 . 0 0 "[ . 1 . 2]" 1
1823 1 74 ALA H 1 74 ALA MB . . 2.510 2.193 2.090 2.243 . 0 0 "[ . 1 . 2]" 1
1824 1 74 ALA H 1 75 ARG H . . 2.920 2.861 2.729 2.914 . 0 0 "[ . 1 . 2]" 1
1825 1 74 ALA H 1 75 ARG HB3 . . 5.200 5.059 4.906 5.173 . 0 0 "[ . 1 . 2]" 1
1826 1 74 ALA HA 1 75 ARG H . . 3.550 3.520 3.506 3.533 . 0 0 "[ . 1 . 2]" 1
1827 1 74 ALA HA 1 76 ILE H . . 4.760 4.679 4.553 4.755 . 0 0 "[ . 1 . 2]" 1
1828 1 74 ALA HA 1 77 ILE H . . 3.970 3.918 3.834 3.967 . 0 0 "[ . 1 . 2]" 1
1829 1 74 ALA HA 1 77 ILE HB . . 3.390 3.313 3.217 3.374 . 0 0 "[ . 1 . 2]" 1
1830 1 74 ALA HA 1 77 ILE MD . . 2.980 2.527 2.360 2.811 . 0 0 "[ . 1 . 2]" 1
1831 1 74 ALA HA 1 77 ILE HG13 . . 4.310 4.237 4.137 4.316 0.006 14 0 "[ . 1 . 2]" 1
1832 1 74 ALA HA 1 77 ILE MG . . 4.830 4.560 4.454 4.650 . 0 0 "[ . 1 . 2]" 1
1833 1 74 ALA HA 1 78 ALA H . . 4.270 4.184 4.037 4.271 0.001 2 0 "[ . 1 . 2]" 1
1834 1 74 ALA HA 1 78 ALA MB . . 4.700 4.581 4.438 4.699 . 0 0 "[ . 1 . 2]" 1
1835 1 74 ALA MB 1 75 ARG H . . 2.780 2.702 2.615 2.775 . 0 0 "[ . 1 . 2]" 1
1836 1 74 ALA MB 1 75 ARG HA . . 3.880 3.847 3.791 3.883 0.003 9 0 "[ . 1 . 2]" 1
1837 1 74 ALA MB 1 75 ARG HB2 . . 4.160 4.106 3.973 4.175 0.015 11 0 "[ . 1 . 2]" 1
1838 1 74 ALA MB 1 75 ARG HB3 . . 5.450 4.593 4.505 4.666 . 0 0 "[ . 1 . 2]" 1
1839 1 74 ALA MB 1 76 ILE H . . 4.710 4.661 4.566 4.713 0.003 11 0 "[ . 1 . 2]" 1
1840 1 74 ALA MB 1 77 ILE HB . . 4.700 4.667 4.608 4.697 . 0 0 "[ . 1 . 2]" 1
1841 1 74 ALA MB 1 78 ALA MB . . 4.350 4.223 4.061 4.308 . 0 0 "[ . 1 . 2]" 1
1842 1 75 ARG H 1 75 ARG HA . . 2.870 2.864 2.851 2.881 0.011 9 0 "[ . 1 . 2]" 1
1843 1 75 ARG H 1 75 ARG HB2 . . 2.780 2.689 2.590 2.780 . 0 0 "[ . 1 . 2]" 1
1844 1 75 ARG H 1 75 ARG HB3 . . 2.620 2.417 2.357 2.493 . 0 0 "[ . 1 . 2]" 1
1845 1 75 ARG H 1 75 ARG QD . . 4.460 4.332 4.266 4.394 . 0 0 "[ . 1 . 2]" 1
1846 1 75 ARG H 1 75 ARG HG2 . . 4.420 4.368 4.311 4.414 . 0 0 "[ . 1 . 2]" 1
1847 1 75 ARG H 1 75 ARG HG3 . . 4.620 4.571 4.532 4.608 . 0 0 "[ . 1 . 2]" 1
1848 1 75 ARG H 1 76 ILE H . . 2.830 2.531 2.420 2.594 . 0 0 "[ . 1 . 2]" 1
1849 1 75 ARG H 1 76 ILE HB . . 4.720 4.641 4.592 4.710 . 0 0 "[ . 1 . 2]" 1
1850 1 75 ARG H 1 78 ALA MB . . 4.850 4.699 4.630 4.815 . 0 0 "[ . 1 . 2]" 1
1851 1 75 ARG HA 1 75 ARG HB2 . . 2.910 2.422 2.391 2.458 . 0 0 "[ . 1 . 2]" 1
1852 1 75 ARG HA 1 75 ARG HB3 . . 3.020 3.021 3.017 3.024 0.004 20 0 "[ . 1 . 2]" 1
1853 1 75 ARG HA 1 75 ARG HD2 . . 4.870 4.549 4.396 4.719 . 0 0 "[ . 1 . 2]" 1
1854 1 75 ARG HA 1 75 ARG QD . . 4.210 4.108 4.057 4.137 . 0 0 "[ . 1 . 2]" 1
1855 1 75 ARG HA 1 75 ARG HD3 . . 4.870 4.692 4.552 4.801 . 0 0 "[ . 1 . 2]" 1
1856 1 75 ARG HA 1 75 ARG HG2 . . 3.120 2.986 2.831 3.095 . 0 0 "[ . 1 . 2]" 1
1857 1 75 ARG HA 1 75 ARG HG3 . . 3.200 2.794 2.640 2.927 . 0 0 "[ . 1 . 2]" 1
1858 1 75 ARG HA 1 76 ILE HA . . 4.850 4.832 4.790 4.853 0.003 13 0 "[ . 1 . 2]" 1
1859 1 75 ARG HA 1 77 ILE H . . 4.620 4.573 4.450 4.623 0.003 14 0 "[ . 1 . 2]" 1
1860 1 75 ARG HA 1 78 ALA H . . 3.760 3.645 3.545 3.738 . 0 0 "[ . 1 . 2]" 1
1861 1 75 ARG HA 1 78 ALA MB . . 3.410 2.702 2.548 2.899 . 0 0 "[ . 1 . 2]" 1
1862 1 75 ARG HA 1 79 GLU H . . 4.210 4.021 3.847 4.116 . 0 0 "[ . 1 . 2]" 1
1863 1 75 ARG HA 1 79 GLU HG2 . . 5.420 4.680 3.976 5.217 . 0 0 "[ . 1 . 2]" 1
1864 1 75 ARG HB2 1 75 ARG HD2 . . 3.530 2.665 2.441 2.948 . 0 0 "[ . 1 . 2]" 1
1865 1 75 ARG HB2 1 75 ARG QD . . 2.970 2.540 2.377 2.724 . 0 0 "[ . 1 . 2]" 1
1866 1 75 ARG HB2 1 75 ARG HD3 . . 3.530 3.311 2.810 3.522 . 0 0 "[ . 1 . 2]" 1
1867 1 75 ARG HB2 1 75 ARG HG3 . . 3.000 2.338 2.276 2.410 . 0 0 "[ . 1 . 2]" 1
1868 1 75 ARG HB2 1 76 ILE H . . 4.120 3.894 3.807 3.984 . 0 0 "[ . 1 . 2]" 1
1869 1 75 ARG HB3 1 75 ARG HD2 . . 3.400 2.766 2.516 3.293 . 0 0 "[ . 1 . 2]" 1
1870 1 75 ARG HB3 1 75 ARG QD . . 2.890 2.261 2.103 2.395 . 0 0 "[ . 1 . 2]" 1
1871 1 75 ARG HB3 1 75 ARG HD3 . . 3.400 2.459 2.156 2.674 . 0 0 "[ . 1 . 2]" 1
1872 1 75 ARG HB3 1 75 ARG HG3 . . 3.010 2.991 2.962 3.010 . 0 0 "[ . 1 . 2]" 1
1873 1 75 ARG HB3 1 76 ILE H . . 3.290 2.559 2.465 2.700 . 0 0 "[ . 1 . 2]" 1
1874 1 75 ARG QD 1 76 ILE H . . 5.100 4.087 3.763 4.440 . 0 0 "[ . 1 . 2]" 1
1875 1 75 ARG QD 1 79 GLU HG2 . . 5.340 5.042 4.810 5.344 0.004 11 0 "[ . 1 . 2]" 1
1876 1 75 ARG QD 1 79 GLU HG3 . . 5.210 4.197 3.922 4.464 . 0 0 "[ . 1 . 2]" 1
1877 1 75 ARG HD2 1 75 ARG HG2 . . 3.000 2.997 2.970 3.007 0.007 1 0 "[ . 1 . 2]" 1
1878 1 75 ARG HD2 1 75 ARG HG3 . . 3.000 2.489 2.286 2.619 . 0 0 "[ . 1 . 2]" 1
1879 1 75 ARG HD3 1 75 ARG HG2 . . 3.000 2.420 2.302 2.647 . 0 0 "[ . 1 . 2]" 1
1880 1 75 ARG HD3 1 75 ARG HG3 . . 3.000 2.998 2.971 3.009 0.009 1 0 "[ . 1 . 2]" 1
1881 1 75 ARG HG2 1 76 ILE H . . 4.080 3.618 3.425 3.737 . 0 0 "[ . 1 . 2]" 1
1882 1 75 ARG HG2 1 79 GLU HG2 . . 3.930 3.378 2.886 3.783 . 0 0 "[ . 1 . 2]" 1
1883 1 75 ARG HG2 1 79 GLU HG3 . . 3.750 2.534 2.271 2.924 . 0 0 "[ . 1 . 2]" 1
1884 1 75 ARG HG3 1 76 ILE H . . 4.830 4.753 4.629 4.831 0.001 18 0 "[ . 1 . 2]" 1
1885 1 75 ARG HG3 1 76 ILE HA . . 5.500 5.251 5.057 5.464 . 0 0 "[ . 1 . 2]" 1
1886 1 75 ARG HG3 1 79 GLU HG2 . . 4.590 4.015 3.493 4.582 . 0 0 "[ . 1 . 2]" 1
1887 1 75 ARG HG3 1 79 GLU HG3 . . 4.280 3.767 3.355 4.102 . 0 0 "[ . 1 . 2]" 1
1888 1 76 ILE H 1 76 ILE HB . . 2.560 2.495 2.455 2.537 . 0 0 "[ . 1 . 2]" 1
1889 1 76 ILE H 1 76 ILE MD . . 3.450 3.340 3.244 3.429 . 0 0 "[ . 1 . 2]" 1
1890 1 76 ILE H 1 76 ILE HG12 . . 3.700 3.609 3.502 3.701 0.001 1 0 "[ . 1 . 2]" 1
1891 1 76 ILE H 1 76 ILE HG13 . . 2.720 2.177 2.090 2.261 . 0 0 "[ . 1 . 2]" 1
1892 1 76 ILE H 1 76 ILE MG . . 3.760 3.758 3.750 3.763 0.003 6 0 "[ . 1 . 2]" 1
1893 1 76 ILE H 1 77 ILE H . . 2.980 2.823 2.692 2.895 . 0 0 "[ . 1 . 2]" 1
1894 1 76 ILE H 1 77 ILE HB . . 5.070 5.027 4.907 5.071 0.001 5 0 "[ . 1 . 2]" 1
1895 1 76 ILE H 1 78 ALA H . . 4.490 4.396 4.289 4.481 . 0 0 "[ . 1 . 2]" 1
1896 1 76 ILE H 1 78 ALA MB . . 5.500 4.866 4.804 4.966 . 0 0 "[ . 1 . 2]" 1
1897 1 76 ILE HA 1 76 ILE HB . . 3.020 3.018 3.016 3.020 . 0 0 "[ . 1 . 2]" 1
1898 1 76 ILE HA 1 76 ILE MD . . 3.880 3.850 3.839 3.867 . 0 0 "[ . 1 . 2]" 1
1899 1 76 ILE HA 1 76 ILE HG12 . . 2.780 2.657 2.606 2.742 . 0 0 "[ . 1 . 2]" 1
1900 1 76 ILE HA 1 76 ILE HG13 . . 2.840 2.736 2.638 2.818 . 0 0 "[ . 1 . 2]" 1
1901 1 76 ILE HA 1 76 ILE MG . . 2.610 2.448 2.373 2.493 . 0 0 "[ . 1 . 2]" 1
1902 1 76 ILE HA 1 78 ALA MB . . 5.500 5.171 5.088 5.239 . 0 0 "[ . 1 . 2]" 1
1903 1 76 ILE HA 1 79 GLU H . . 3.890 3.741 3.674 3.852 . 0 0 "[ . 1 . 2]" 1
1904 1 76 ILE HA 1 79 GLU QB . . 2.980 2.862 2.787 2.981 0.001 11 0 "[ . 1 . 2]" 1
1905 1 76 ILE HA 1 79 GLU HG2 . . 4.870 4.541 4.040 4.858 . 0 0 "[ . 1 . 2]" 1
1906 1 76 ILE HA 1 79 GLU HG3 . . 4.080 3.255 3.103 3.466 . 0 0 "[ . 1 . 2]" 1
1907 1 76 ILE HA 1 80 ALA H . . 4.810 4.709 4.625 4.811 0.001 11 0 "[ . 1 . 2]" 1
1908 1 76 ILE HB 1 76 ILE MD . . 2.640 2.231 2.121 2.359 . 0 0 "[ . 1 . 2]" 1
1909 1 76 ILE HB 1 76 ILE HG13 . . 2.950 2.582 2.547 2.632 . 0 0 "[ . 1 . 2]" 1
1910 1 76 ILE HB 1 77 ILE H . . 3.120 2.469 2.423 2.541 . 0 0 "[ . 1 . 2]" 1
1911 1 76 ILE HG12 1 76 ILE MG . . 2.770 2.269 2.187 2.346 . 0 0 "[ . 1 . 2]" 1
1912 1 76 ILE HG12 1 77 ILE H . . 5.050 5.013 4.969 5.052 0.002 11 0 "[ . 1 . 2]" 1
1913 1 76 ILE HG12 1 79 GLU QB . . 5.470 5.059 4.954 5.166 . 0 0 "[ . 1 . 2]" 1
1914 1 76 ILE HG13 1 77 ILE H . . 4.370 4.322 4.271 4.363 . 0 0 "[ . 1 . 2]" 1
1915 1 76 ILE MG 1 77 ILE H . . 3.340 3.154 3.048 3.264 . 0 0 "[ . 1 . 2]" 1
1916 1 76 ILE MG 1 77 ILE HA . . 3.330 3.192 3.109 3.290 . 0 0 "[ . 1 . 2]" 1
1917 1 76 ILE MG 1 77 ILE HG13 . . 4.230 3.444 3.319 3.676 . 0 0 "[ . 1 . 2]" 1
1918 1 76 ILE MG 1 78 ALA H . . 5.100 5.044 4.958 5.090 . 0 0 "[ . 1 . 2]" 1
1919 1 76 ILE MG 1 79 GLU QB . . 4.080 3.829 3.700 3.986 . 0 0 "[ . 1 . 2]" 1
1920 1 76 ILE MG 1 80 ALA H . . 4.580 4.471 4.378 4.578 . 0 0 "[ . 1 . 2]" 1
1921 1 76 ILE MG 1 80 ALA MB . . 3.810 3.741 3.591 3.810 . 0 0 "[ . 1 . 2]" 1
1922 1 77 ILE H 1 77 ILE HB . . 2.600 2.562 2.532 2.591 . 0 0 "[ . 1 . 2]" 1
1923 1 77 ILE H 1 77 ILE MD . . 3.390 3.184 3.081 3.360 . 0 0 "[ . 1 . 2]" 1
1924 1 77 ILE H 1 77 ILE HG12 . . 3.600 3.549 3.473 3.596 . 0 0 "[ . 1 . 2]" 1
1925 1 77 ILE H 1 77 ILE HG13 . . 2.630 2.057 1.999 2.102 . 0 0 "[ . 1 . 2]" 1
1926 1 77 ILE H 1 77 ILE MG . . 3.770 3.764 3.762 3.765 . 0 0 "[ . 1 . 2]" 1
1927 1 77 ILE H 1 78 ALA H . . 2.890 2.806 2.743 2.875 . 0 0 "[ . 1 . 2]" 1
1928 1 77 ILE H 1 78 ALA MB . . 4.410 4.316 4.246 4.392 . 0 0 "[ . 1 . 2]" 1
1929 1 77 ILE H 1 79 GLU H . . 4.320 4.231 4.151 4.292 . 0 0 "[ . 1 . 2]" 1
1930 1 77 ILE HA 1 77 ILE MD . . 3.900 3.887 3.871 3.899 . 0 0 "[ . 1 . 2]" 1
1931 1 77 ILE HA 1 77 ILE HG12 . . 3.120 2.768 2.671 2.837 . 0 0 "[ . 1 . 2]" 1
1932 1 77 ILE HA 1 77 ILE HG13 . . 2.880 2.760 2.712 2.845 . 0 0 "[ . 1 . 2]" 1
1933 1 77 ILE HA 1 77 ILE MG . . 2.750 2.399 2.311 2.467 . 0 0 "[ . 1 . 2]" 1
1934 1 77 ILE HA 1 78 ALA H . . 3.570 3.564 3.559 3.568 . 0 0 "[ . 1 . 2]" 1
1935 1 77 ILE HA 1 78 ALA MB . . 5.030 5.019 5.015 5.031 0.001 20 0 "[ . 1 . 2]" 1
1936 1 77 ILE HA 1 79 GLU H . . 4.600 4.479 4.392 4.575 . 0 0 "[ . 1 . 2]" 1
1937 1 77 ILE HA 1 80 ALA H . . 3.550 3.489 3.426 3.533 . 0 0 "[ . 1 . 2]" 1
1938 1 77 ILE HA 1 80 ALA HA . . 5.500 5.473 5.392 5.504 0.004 18 0 "[ . 1 . 2]" 1
1939 1 77 ILE HA 1 80 ALA MB . . 2.890 2.833 2.733 2.892 0.002 17 0 "[ . 1 . 2]" 1
1940 1 77 ILE HA 1 89 ILE MD . . 4.080 3.804 3.450 4.083 0.003 20 0 "[ . 1 . 2]" 1
1941 1 77 ILE HA 1 89 ILE MG . . 4.370 3.327 3.059 3.554 . 0 0 "[ . 1 . 2]" 1
1942 1 77 ILE HA 1 91 PHE QE . . 4.430 4.245 4.081 4.380 . 0 0 "[ . 1 . 2]" 1
1943 1 77 ILE HA 1 91 PHE HZ . . 5.500 4.641 4.319 4.830 . 0 0 "[ . 1 . 2]" 1
1944 1 77 ILE HB 1 77 ILE MD . . 2.720 2.238 2.150 2.313 . 0 0 "[ . 1 . 2]" 1
1945 1 77 ILE HB 1 77 ILE HG13 . . 3.000 2.620 2.574 2.651 . 0 0 "[ . 1 . 2]" 1
1946 1 77 ILE HB 1 78 ALA H . . 2.780 2.362 2.294 2.417 . 0 0 "[ . 1 . 2]" 1
1947 1 77 ILE HB 1 78 ALA HA . . 4.370 4.173 4.135 4.215 . 0 0 "[ . 1 . 2]" 1
1948 1 77 ILE HB 1 78 ALA MB . . 3.920 3.866 3.800 3.922 0.002 11 0 "[ . 1 . 2]" 1
1949 1 77 ILE HB 1 79 GLU H . . 5.050 4.960 4.889 5.005 . 0 0 "[ . 1 . 2]" 1
1950 1 77 ILE MD 1 77 ILE MG . . 2.400 2.309 2.158 2.398 . 0 0 "[ . 1 . 2]" 1
1951 1 77 ILE MD 1 78 ALA H . . 4.260 4.124 4.006 4.246 . 0 0 "[ . 1 . 2]" 1
1952 1 77 ILE MD 1 91 PHE QD . . 5.020 4.038 3.695 4.248 . 0 0 "[ . 1 . 2]" 1
1953 1 77 ILE MD 1 91 PHE QE . . 3.440 2.628 2.240 2.866 . 0 0 "[ . 1 . 2]" 1
1954 1 77 ILE MD 1 91 PHE HZ . . 4.250 4.108 3.882 4.226 . 0 0 "[ . 1 . 2]" 1
1955 1 77 ILE HG12 1 80 ALA MB . . 4.930 4.844 4.690 4.925 . 0 0 "[ . 1 . 2]" 1
1956 1 77 ILE HG12 1 91 PHE QE . . 3.460 2.236 2.000 2.349 . 0 0 "[ . 1 . 2]" 1
1957 1 77 ILE HG13 1 77 ILE MG . . 3.180 3.157 3.140 3.179 . 0 0 "[ . 1 . 2]" 1
1958 1 77 ILE HG13 1 78 ALA H . . 4.280 4.199 4.142 4.231 . 0 0 "[ . 1 . 2]" 1
1959 1 77 ILE HG13 1 91 PHE QE . . 4.020 3.941 3.721 4.024 0.004 16 0 "[ . 1 . 2]" 1
1960 1 77 ILE MG 1 78 ALA H . . 3.310 3.254 3.170 3.310 0.000 5 0 "[ . 1 . 2]" 1
1961 1 77 ILE MG 1 78 ALA HA . . 3.460 3.370 3.310 3.443 . 0 0 "[ . 1 . 2]" 1
1962 1 77 ILE MG 1 78 ALA MB . . 4.250 4.075 4.020 4.126 . 0 0 "[ . 1 . 2]" 1
1963 1 77 ILE MG 1 80 ALA H . . 5.060 4.309 4.245 4.398 . 0 0 "[ . 1 . 2]" 1
1964 1 77 ILE MG 1 81 PHE H . . 4.640 4.478 4.165 4.628 . 0 0 "[ . 1 . 2]" 1
1965 1 77 ILE MG 1 81 PHE HB2 . . 4.200 3.976 3.792 4.174 . 0 0 "[ . 1 . 2]" 1
1966 1 77 ILE MG 1 81 PHE HB3 . . 5.460 5.262 5.040 5.460 0.000 5 0 "[ . 1 . 2]" 1
1967 1 77 ILE MG 1 89 ILE MG . . 4.890 2.532 2.102 2.732 . 0 0 "[ . 1 . 2]" 1
1968 1 77 ILE MG 1 91 PHE QD . . 4.100 4.039 3.927 4.103 0.003 18 0 "[ . 1 . 2]" 1
1969 1 77 ILE MG 1 91 PHE QE . . 3.030 2.083 1.974 2.224 . 0 0 "[ . 1 . 2]" 1
1970 1 77 ILE MG 1 91 PHE HZ . . 3.100 2.011 1.824 2.171 . 0 0 "[ . 1 . 2]" 1
1971 1 78 ALA H 1 78 ALA HA . . 2.890 2.764 2.745 2.779 . 0 0 "[ . 1 . 2]" 1
1972 1 78 ALA H 1 78 ALA MB . . 2.400 2.040 2.024 2.085 . 0 0 "[ . 1 . 2]" 1
1973 1 78 ALA H 1 79 GLU H . . 2.910 2.840 2.798 2.907 . 0 0 "[ . 1 . 2]" 1
1974 1 78 ALA H 1 79 GLU HA . . 5.500 5.406 5.374 5.458 . 0 0 "[ . 1 . 2]" 1
1975 1 78 ALA HA 1 79 GLU QB . . 5.460 5.393 5.359 5.419 . 0 0 "[ . 1 . 2]" 1
1976 1 78 ALA HA 1 80 ALA MB . . 4.810 4.668 4.576 4.746 . 0 0 "[ . 1 . 2]" 1
1977 1 78 ALA HA 1 81 PHE H . . 3.470 3.376 3.293 3.455 . 0 0 "[ . 1 . 2]" 1
1978 1 78 ALA HA 1 81 PHE HB2 . . 3.470 3.145 3.018 3.294 . 0 0 "[ . 1 . 2]" 1
1979 1 78 ALA HA 1 81 PHE HB3 . . 3.580 3.462 3.276 3.582 0.002 17 0 "[ . 1 . 2]" 1
1980 1 78 ALA MB 1 79 GLU H . . 2.740 2.596 2.450 2.671 . 0 0 "[ . 1 . 2]" 1
1981 1 78 ALA MB 1 79 GLU HA . . 3.680 3.670 3.644 3.686 0.006 11 0 "[ . 1 . 2]" 1
1982 1 78 ALA MB 1 79 GLU QB . . 4.520 4.299 4.211 4.345 . 0 0 "[ . 1 . 2]" 1
1983 1 78 ALA MB 1 79 GLU HG2 . . 4.130 3.713 3.354 4.062 . 0 0 "[ . 1 . 2]" 1
1984 1 78 ALA MB 1 79 GLU HG3 . . 4.810 4.332 3.856 4.812 0.002 10 0 "[ . 1 . 2]" 1
1985 1 78 ALA MB 1 80 ALA H . . 4.410 4.329 4.249 4.381 . 0 0 "[ . 1 . 2]" 1
1986 1 78 ALA MB 1 81 PHE H . . 4.390 4.353 4.293 4.387 . 0 0 "[ . 1 . 2]" 1
1987 1 78 ALA MB 1 81 PHE HB2 . . 4.660 4.550 4.450 4.639 . 0 0 "[ . 1 . 2]" 1
1988 1 78 ALA MB 1 81 PHE HB3 . . 4.380 4.333 4.203 4.380 0.000 3 0 "[ . 1 . 2]" 1
1989 1 78 ALA MB 1 82 LYS QE . . 4.870 2.964 2.105 4.768 . 0 0 "[ . 1 . 2]" 1
1990 1 78 ALA MB 1 89 ILE MD . . 5.170 5.060 4.914 5.173 0.003 18 0 "[ . 1 . 2]" 1
1991 1 79 GLU H 1 79 GLU HA . . 2.910 2.784 2.774 2.797 . 0 0 "[ . 1 . 2]" 1
1992 1 79 GLU H 1 79 GLU QB . . 2.590 2.359 2.298 2.415 . 0 0 "[ . 1 . 2]" 1
1993 1 79 GLU H 1 79 GLU HG2 . . 3.300 2.827 2.415 3.226 . 0 0 "[ . 1 . 2]" 1
1994 1 79 GLU H 1 79 GLU HG3 . . 3.540 2.979 2.488 3.465 . 0 0 "[ . 1 . 2]" 1
1995 1 79 GLU H 1 80 ALA H . . 2.830 2.702 2.663 2.733 . 0 0 "[ . 1 . 2]" 1
1996 1 79 GLU H 1 80 ALA HA . . 5.340 5.300 5.265 5.331 . 0 0 "[ . 1 . 2]" 1
1997 1 79 GLU H 1 80 ALA MB . . 4.420 4.372 4.299 4.417 . 0 0 "[ . 1 . 2]" 1
1998 1 79 GLU HA 1 79 GLU QB . . 2.460 2.421 2.399 2.449 . 0 0 "[ . 1 . 2]" 1
1999 1 79 GLU HA 1 79 GLU HG2 . . 2.950 2.437 2.268 2.612 . 0 0 "[ . 1 . 2]" 1
2000 1 79 GLU HA 1 79 GLU HG3 . . 3.750 3.507 3.271 3.721 . 0 0 "[ . 1 . 2]" 1
2001 1 79 GLU HA 1 80 ALA H . . 3.510 3.490 3.469 3.508 . 0 0 "[ . 1 . 2]" 1
2002 1 79 GLU HA 1 81 PHE H . . 4.370 3.891 3.718 4.084 . 0 0 "[ . 1 . 2]" 1
2003 1 79 GLU HA 1 82 LYS H . . 3.870 3.358 3.226 3.537 . 0 0 "[ . 1 . 2]" 1
2004 1 79 GLU HA 1 82 LYS QB . . 2.940 2.758 2.470 2.908 . 0 0 "[ . 1 . 2]" 1
2005 1 79 GLU HA 1 82 LYS QD . . 4.060 3.095 2.067 4.055 . 0 0 "[ . 1 . 2]" 1
2006 1 79 GLU HA 1 82 LYS QE . . 4.230 3.115 1.938 4.230 0.000 7 0 "[ . 1 . 2]" 1
2007 1 79 GLU HA 1 82 LYS QG . . 4.430 3.471 2.699 4.236 . 0 0 "[ . 1 . 2]" 1
2008 1 79 GLU HA 1 83 THR H . . 4.370 3.904 3.638 4.214 . 0 0 "[ . 1 . 2]" 1
2009 1 79 GLU QB 1 79 GLU HG2 . . 2.670 2.467 2.459 2.474 . 0 0 "[ . 1 . 2]" 1
2010 1 79 GLU QB 1 79 GLU HG3 . . 2.630 2.176 2.140 2.221 . 0 0 "[ . 1 . 2]" 1
2011 1 79 GLU QB 1 80 ALA H . . 2.880 2.802 2.713 2.882 0.002 16 0 "[ . 1 . 2]" 1
2012 1 79 GLU QB 1 80 ALA HA . . 3.960 3.933 3.911 3.963 0.003 16 0 "[ . 1 . 2]" 1
2013 1 79 GLU QB 1 80 ALA MB . . 3.920 3.883 3.832 3.920 0.000 7 0 "[ . 1 . 2]" 1
2014 1 79 GLU QB 1 83 THR MG . . 4.740 4.463 4.161 4.718 . 0 0 "[ . 1 . 2]" 1
2015 1 79 GLU HG2 1 80 ALA H . . 5.000 4.768 4.580 4.944 . 0 0 "[ . 1 . 2]" 1
2016 1 79 GLU HG2 1 82 LYS QD . . 5.280 4.025 2.859 5.089 . 0 0 "[ . 1 . 2]" 1
2017 1 79 GLU HG3 1 80 ALA H . . 5.100 4.822 4.520 5.102 0.002 16 0 "[ . 1 . 2]" 1
2018 1 80 ALA H 1 80 ALA HA . . 2.870 2.849 2.832 2.872 0.002 11 0 "[ . 1 . 2]" 1
2019 1 80 ALA H 1 80 ALA MB . . 2.490 2.215 2.067 2.251 . 0 0 "[ . 1 . 2]" 1
2020 1 80 ALA H 1 81 PHE H . . 2.860 2.513 2.436 2.564 . 0 0 "[ . 1 . 2]" 1
2021 1 80 ALA H 1 81 PHE HB2 . . 4.630 4.535 4.425 4.620 . 0 0 "[ . 1 . 2]" 1
2022 1 80 ALA H 1 83 THR MG . . 5.310 4.428 4.114 4.641 . 0 0 "[ . 1 . 2]" 1
2023 1 80 ALA H 1 89 ILE MD . . 4.980 3.866 3.580 4.220 . 0 0 "[ . 1 . 2]" 1
2024 1 80 ALA HA 1 83 THR MG . . 2.810 2.356 2.029 2.586 . 0 0 "[ . 1 . 2]" 1
2025 1 80 ALA HA 1 89 ILE MD . . 4.710 4.278 3.973 4.596 . 0 0 "[ . 1 . 2]" 1
2026 1 80 ALA MB 1 81 PHE H . . 3.100 2.936 2.810 3.068 . 0 0 "[ . 1 . 2]" 1
2027 1 80 ALA MB 1 81 PHE HA . . 4.490 3.932 3.798 4.005 . 0 0 "[ . 1 . 2]" 1
2028 1 80 ALA MB 1 81 PHE HB2 . . 4.080 3.975 3.899 4.087 0.007 18 0 "[ . 1 . 2]" 1
2029 1 80 ALA MB 1 81 PHE HB3 . . 5.100 5.051 4.997 5.101 0.001 2 0 "[ . 1 . 2]" 1
2030 1 80 ALA MB 1 82 LYS H . . 4.830 4.778 4.700 4.832 0.002 15 0 "[ . 1 . 2]" 1
2031 1 80 ALA MB 1 89 ILE HA . . 4.010 3.255 2.885 3.590 . 0 0 "[ . 1 . 2]" 1
2032 1 80 ALA MB 1 89 ILE MD . . 2.720 2.199 1.915 2.559 . 0 0 "[ . 1 . 2]" 1
2033 1 80 ALA MB 1 89 ILE HG12 . . 3.200 2.075 1.860 2.453 . 0 0 "[ . 1 . 2]" 1
2034 1 80 ALA MB 1 89 ILE MG . . 2.740 2.130 1.901 2.386 . 0 0 "[ . 1 . 2]" 1
2035 1 80 ALA MB 1 90 ASP H . . 5.030 4.294 3.989 4.620 . 0 0 "[ . 1 . 2]" 1
2036 1 81 PHE H 1 81 PHE HB2 . . 2.840 2.419 2.339 2.497 . 0 0 "[ . 1 . 2]" 1
2037 1 81 PHE H 1 81 PHE HB3 . . 2.890 2.811 2.721 2.847 . 0 0 "[ . 1 . 2]" 1
2038 1 81 PHE H 1 81 PHE QD . . 4.210 4.114 4.044 4.182 . 0 0 "[ . 1 . 2]" 1
2039 1 81 PHE H 1 82 LYS H . . 2.820 2.353 2.222 2.560 . 0 0 "[ . 1 . 2]" 1
2040 1 81 PHE H 1 89 ILE MD . . 3.470 2.798 2.546 3.082 . 0 0 "[ . 1 . 2]" 1
2041 1 81 PHE HA 1 81 PHE HB2 . . 3.000 2.632 2.583 2.650 . 0 0 "[ . 1 . 2]" 1
2042 1 81 PHE HA 1 81 PHE QD . . 2.860 2.340 2.063 2.672 . 0 0 "[ . 1 . 2]" 1
2043 1 81 PHE HA 1 82 LYS H . . 3.540 3.534 3.518 3.554 0.014 19 0 "[ . 1 . 2]" 1
2044 1 81 PHE HA 1 89 ILE MD . . 2.810 2.355 2.041 2.724 . 0 0 "[ . 1 . 2]" 1
2045 1 81 PHE HA 1 89 ILE HG12 . . 3.890 3.598 3.316 3.767 . 0 0 "[ . 1 . 2]" 1
2046 1 81 PHE HA 1 89 ILE HG13 . . 3.890 3.532 3.310 3.819 . 0 0 "[ . 1 . 2]" 1
2047 1 81 PHE HA 1 89 ILE MG . . 5.150 5.037 4.842 5.152 0.002 2 0 "[ . 1 . 2]" 1
2048 1 81 PHE HB2 1 82 LYS H . . 3.730 3.608 3.543 3.649 . 0 0 "[ . 1 . 2]" 1
2049 1 81 PHE HB2 1 82 LYS HA . . 5.460 5.478 5.468 5.519 0.059 18 0 "[ . 1 . 2]" 1
2050 1 81 PHE HB2 1 89 ILE MD . . 3.090 2.125 1.946 2.222 . 0 0 "[ . 1 . 2]" 1
2051 1 81 PHE HB2 1 89 ILE MG . . 5.500 4.746 4.556 4.870 . 0 0 "[ . 1 . 2]" 1
2052 1 81 PHE HB3 1 82 LYS H . . 3.070 2.621 2.426 2.741 . 0 0 "[ . 1 . 2]" 1
2053 1 81 PHE HB3 1 82 LYS QG . . 4.900 3.400 3.017 3.785 . 0 0 "[ . 1 . 2]" 1
2054 1 81 PHE HB3 1 89 ILE MD . . 3.560 3.524 3.327 3.565 0.005 18 0 "[ . 1 . 2]" 1
2055 1 81 PHE QD 1 82 LYS H . . 4.450 4.255 3.980 4.399 . 0 0 "[ . 1 . 2]" 1
2056 1 81 PHE QD 1 82 LYS HA . . 4.630 4.341 4.036 4.631 0.001 15 0 "[ . 1 . 2]" 1
2057 1 81 PHE QD 1 82 LYS QG . . 5.220 4.238 3.772 4.703 . 0 0 "[ . 1 . 2]" 1
2058 1 81 PHE QD 1 89 ILE MD . . 3.170 1.893 1.792 1.991 . 0 0 "[ . 1 . 2]" 1
2059 1 81 PHE QD 1 89 ILE HG12 . . 4.370 3.752 3.223 4.123 . 0 0 "[ . 1 . 2]" 1
2060 1 81 PHE QD 1 89 ILE HG13 . . 4.350 2.809 2.371 3.254 . 0 0 "[ . 1 . 2]" 1
2061 1 81 PHE QD 1 89 ILE MG . . 5.400 4.616 4.337 4.837 . 0 0 "[ . 1 . 2]" 1
2062 1 81 PHE HZ 1 89 ILE MD . . 5.500 5.299 5.001 5.495 . 0 0 "[ . 1 . 2]" 1
2063 1 82 LYS H 1 82 LYS HA . . 2.930 2.798 2.762 2.833 . 0 0 "[ . 1 . 2]" 1
2064 1 82 LYS H 1 82 LYS QB . . 2.540 2.380 2.210 2.511 . 0 0 "[ . 1 . 2]" 1
2065 1 82 LYS H 1 82 LYS QD . . 4.550 3.874 3.200 4.434 . 0 0 "[ . 1 . 2]" 1
2066 1 82 LYS H 1 82 LYS QE . . 5.020 4.015 3.184 4.875 . 0 0 "[ . 1 . 2]" 1
2067 1 82 LYS H 1 82 LYS QG . . 3.830 2.334 2.099 2.694 . 0 0 "[ . 1 . 2]" 1
2068 1 82 LYS H 1 83 THR H . . 2.920 2.892 2.687 2.928 0.008 1 0 "[ . 1 . 2]" 1
2069 1 82 LYS H 1 83 THR HB . . 5.320 5.202 4.994 5.318 . 0 0 "[ . 1 . 2]" 1
2070 1 82 LYS H 1 83 THR MG . . 4.050 3.802 3.585 4.041 . 0 0 "[ . 1 . 2]" 1
2071 1 82 LYS H 1 89 ILE MD . . 5.500 4.495 4.320 4.701 . 0 0 "[ . 1 . 2]" 1
2072 1 82 LYS HA 1 82 LYS QB . . 2.560 2.407 2.348 2.480 . 0 0 "[ . 1 . 2]" 1
2073 1 82 LYS HA 1 82 LYS QG . . 3.030 2.394 2.243 2.535 . 0 0 "[ . 1 . 2]" 1
2074 1 82 LYS QB 1 82 LYS QE . . 3.640 2.948 2.188 3.550 . 0 0 "[ . 1 . 2]" 1
2075 1 82 LYS QB 1 82 LYS QG . . 2.490 2.081 2.064 2.087 . 0 0 "[ . 1 . 2]" 1
2076 1 82 LYS QB 1 83 THR H . . 3.240 2.234 2.047 2.404 . 0 0 "[ . 1 . 2]" 1
2077 1 82 LYS QB 1 83 THR HA . . 3.840 3.751 3.711 3.808 . 0 0 "[ . 1 . 2]" 1
2078 1 82 LYS QB 1 83 THR MG . . 4.280 3.995 3.751 4.250 . 0 0 "[ . 1 . 2]" 1
2079 1 82 LYS QE 1 82 LYS QG . . 2.940 2.148 2.080 2.281 . 0 0 "[ . 1 . 2]" 1
2080 1 82 LYS QG 1 83 THR H . . 4.180 4.036 3.819 4.197 0.017 1 0 "[ . 1 . 2]" 1
2081 1 82 LYS QG 1 83 THR MG . . 5.420 5.241 4.873 5.421 0.001 4 0 "[ . 1 . 2]" 1
2082 1 83 THR H 1 83 THR HA . . 2.890 2.691 2.660 2.738 . 0 0 "[ . 1 . 2]" 1
2083 1 83 THR H 1 83 THR HB . . 2.810 2.491 2.332 2.551 . 0 0 "[ . 1 . 2]" 1
2084 1 83 THR H 1 83 THR MG . . 2.770 2.307 2.135 2.583 . 0 0 "[ . 1 . 2]" 1
2085 1 83 THR H 1 84 LYS H . . 4.650 4.625 4.580 4.648 . 0 0 "[ . 1 . 2]" 1
2086 1 83 THR HA 1 83 THR HB . . 2.620 2.449 2.414 2.545 . 0 0 "[ . 1 . 2]" 1
2087 1 83 THR HA 1 83 THR MG . . 3.210 3.198 3.189 3.207 . 0 0 "[ . 1 . 2]" 1
2088 1 83 THR HA 1 84 LYS H . . 2.630 2.256 2.187 2.345 . 0 0 "[ . 1 . 2]" 1
2089 1 83 THR HA 1 84 LYS QB . . 4.600 4.202 3.944 4.430 . 0 0 "[ . 1 . 2]" 1
2090 1 83 THR HA 1 85 ASP H . . 4.140 3.951 3.718 4.121 . 0 0 "[ . 1 . 2]" 1
2091 1 83 THR HB 1 84 LYS H . . 4.280 3.967 3.801 4.143 . 0 0 "[ . 1 . 2]" 1
2092 1 83 THR HB 1 85 ASP H . . 4.980 4.519 4.180 4.907 . 0 0 "[ . 1 . 2]" 1
2093 1 83 THR MG 1 84 LYS H . . 4.080 3.719 3.539 3.893 . 0 0 "[ . 1 . 2]" 1
2094 1 83 THR MG 1 84 LYS QB . . 5.340 5.030 4.818 5.192 . 0 0 "[ . 1 . 2]" 1
2095 1 83 THR MG 1 85 ASP H . . 4.100 3.348 2.120 4.090 . 0 0 "[ . 1 . 2]" 1
2096 1 83 THR MG 1 85 ASP QB . . 4.100 3.341 2.402 4.099 . 0 0 "[ . 1 . 2]" 1
2097 1 83 THR MG 1 86 ARG H . . 3.200 2.781 2.213 3.201 0.001 19 0 "[ . 1 . 2]" 1
2098 1 83 THR MG 1 86 ARG HD2 . . 4.870 4.388 3.378 4.869 . 0 0 "[ . 1 . 2]" 1
2099 1 84 LYS H 1 84 LYS QB . . 2.980 2.419 2.222 2.787 . 0 0 "[ . 1 . 2]" 1
2100 1 84 LYS H 1 84 LYS QD . . 4.630 4.002 2.478 4.632 0.002 11 0 "[ . 1 . 2]" 1
2101 1 84 LYS H 1 84 LYS HG2 . . 4.730 3.697 1.894 4.533 . 0 0 "[ . 1 . 2]" 1
2102 1 84 LYS H 1 84 LYS QG . . 4.150 3.095 1.885 4.060 . 0 0 "[ . 1 . 2]" 1
2103 1 84 LYS H 1 84 LYS HG3 . . 4.730 3.580 2.788 4.738 0.008 18 0 "[ . 1 . 2]" 1
2104 1 84 LYS H 1 85 ASP H . . 3.200 2.308 1.949 2.738 . 0 0 "[ . 1 . 2]" 1
2105 1 84 LYS HA 1 84 LYS QD . . 4.090 3.591 2.259 4.172 0.082 10 0 "[ . 1 . 2]" 1
2106 1 84 LYS HA 1 84 LYS QE . . 5.460 4.468 3.663 5.324 . 0 0 "[ . 1 . 2]" 1
2107 1 84 LYS HA 1 84 LYS HG2 . . 3.910 2.888 2.254 3.964 0.054 8 0 "[ . 1 . 2]" 1
2108 1 84 LYS HA 1 84 LYS QG . . 3.340 2.527 2.147 3.343 0.003 7 0 "[ . 1 . 2]" 1
2109 1 84 LYS HA 1 84 LYS HG3 . . 3.910 3.136 2.168 3.944 0.034 7 0 "[ . 1 . 2]" 1
2110 1 84 LYS QB 1 84 LYS QD . . 3.260 2.162 2.002 2.478 . 0 0 "[ . 1 . 2]" 1
2111 1 84 LYS QB 1 85 ASP H . . 3.770 3.284 2.628 3.768 . 0 0 "[ . 1 . 2]" 1
2112 1 84 LYS HB2 1 85 ASP H . . 4.370 3.655 2.700 4.413 0.043 18 0 "[ . 1 . 2]" 1
2113 1 84 LYS HB3 1 85 ASP H . . 4.370 3.893 2.691 4.317 . 0 0 "[ . 1 . 2]" 1
2114 1 84 LYS QD 1 84 LYS QG . . 2.390 2.058 2.023 2.092 . 0 0 "[ . 1 . 2]" 1
2115 1 84 LYS QE 1 84 LYS QG . . 3.460 2.193 2.014 2.610 . 0 0 "[ . 1 . 2]" 1
2116 1 85 ASP H 1 85 ASP QB . . 3.040 2.344 2.146 2.676 . 0 0 "[ . 1 . 2]" 1
2117 1 85 ASP H 1 86 ARG H . . 3.160 2.921 2.469 3.166 0.006 2 0 "[ . 1 . 2]" 1
2118 1 85 ASP HA 1 85 ASP QB . . 2.500 2.392 2.167 2.482 . 0 0 "[ . 1 . 2]" 1
2119 1 85 ASP HA 1 86 ARG H . . 3.570 3.564 3.514 3.571 0.001 7 0 "[ . 1 . 2]" 1
2120 1 85 ASP QB 1 86 ARG H . . 3.250 2.285 1.971 3.166 . 0 0 "[ . 1 . 2]" 1
2121 1 85 ASP QB 1 86 ARG QB . . 4.530 3.516 3.187 4.186 . 0 0 "[ . 1 . 2]" 1
2122 1 86 ARG H 1 86 ARG QB . . 3.600 2.592 2.154 3.259 . 0 0 "[ . 1 . 2]" 1
2123 1 86 ARG H 1 86 ARG QG . . 3.980 3.244 1.891 4.029 0.049 15 0 "[ . 1 . 2]" 1
2124 1 86 ARG HA 1 86 ARG HD2 . . 5.460 4.768 3.303 5.492 0.032 13 0 "[ . 1 . 2]" 1
2125 1 86 ARG HA 1 86 ARG QG . . 3.400 2.701 2.150 3.341 . 0 0 "[ . 1 . 2]" 1
2126 1 86 ARG HA 1 88 TYR H . . 4.090 3.953 3.698 4.096 0.006 18 0 "[ . 1 . 2]" 1
2127 1 86 ARG HA 1 88 TYR QE . . 5.500 4.592 4.027 5.230 . 0 0 "[ . 1 . 2]" 1
2128 1 86 ARG QB 1 86 ARG HD2 . . 3.440 2.594 2.057 3.284 . 0 0 "[ . 1 . 2]" 1
2129 1 86 ARG QB 1 86 ARG HD3 . . 3.630 2.856 2.142 3.294 . 0 0 "[ . 1 . 2]" 1
2130 1 86 ARG QB 1 88 TYR H . . 4.190 2.930 2.475 3.454 . 0 0 "[ . 1 . 2]" 1
2131 1 86 ARG HB2 1 88 TYR H . . 4.830 3.789 2.494 4.540 . 0 0 "[ . 1 . 2]" 1
2132 1 86 ARG HB3 1 88 TYR H . . 4.830 3.578 2.793 4.466 . 0 0 "[ . 1 . 2]" 1
2133 1 86 ARG HD2 1 88 TYR QE . . 4.870 4.026 2.754 4.871 0.001 15 0 "[ . 1 . 2]" 1
2134 1 86 ARG HD3 1 88 TYR QD . . 5.100 3.502 2.504 4.788 . 0 0 "[ . 1 . 2]" 1
2135 1 86 ARG HD3 1 88 TYR QE . . 3.730 2.835 2.072 3.733 0.003 1 0 "[ . 1 . 2]" 1
2136 1 86 ARG QG 1 88 TYR H . . 4.250 2.408 1.886 3.134 . 0 0 "[ . 1 . 2]" 1
2137 1 86 ARG QG 1 88 TYR HA . . 5.500 4.624 3.844 5.485 . 0 0 "[ . 1 . 2]" 1
2138 1 87 ASP HA 1 87 ASP QB . . 2.570 2.292 2.170 2.476 . 0 0 "[ . 1 . 2]" 1
2139 1 88 TYR H 1 88 TYR QD . . 3.540 3.435 3.057 3.537 . 0 0 "[ . 1 . 2]" 1
2140 1 88 TYR HA 1 88 TYR HB2 . . 2.980 2.441 2.382 2.484 . 0 0 "[ . 1 . 2]" 1
2141 1 88 TYR HA 1 88 TYR HB3 . . 3.000 2.466 2.424 2.528 . 0 0 "[ . 1 . 2]" 1
2142 1 88 TYR HA 1 88 TYR QD . . 3.740 3.714 3.658 3.742 0.002 14 0 "[ . 1 . 2]" 1
2143 1 88 TYR HA 1 89 ILE H . . 2.740 2.522 2.428 2.614 . 0 0 "[ . 1 . 2]" 1
2144 1 88 TYR HA 1 89 ILE HG13 . . 4.550 3.396 3.218 3.575 . 0 0 "[ . 1 . 2]" 1
2145 1 88 TYR HB2 1 89 ILE H . . 2.990 2.220 2.035 2.423 . 0 0 "[ . 1 . 2]" 1
2146 1 88 TYR HB2 1 89 ILE HB . . 5.100 4.987 4.810 5.101 0.001 11 0 "[ . 1 . 2]" 1
2147 1 88 TYR HB2 1 90 ASP H . . 5.500 5.287 5.024 5.480 . 0 0 "[ . 1 . 2]" 1
2148 1 88 TYR HB3 1 89 ILE H . . 3.830 3.670 3.543 3.828 . 0 0 "[ . 1 . 2]" 1
2149 1 88 TYR QD 1 89 ILE H . . 3.210 2.805 2.491 3.145 . 0 0 "[ . 1 . 2]" 1
2150 1 88 TYR QD 1 89 ILE HA . . 3.320 3.094 2.789 3.316 . 0 0 "[ . 1 . 2]" 1
2151 1 88 TYR QD 1 90 ASP H . . 3.470 3.195 2.857 3.433 . 0 0 "[ . 1 . 2]" 1
2152 1 88 TYR QD 1 90 ASP HA . . 4.200 3.851 3.445 4.201 0.001 1 0 "[ . 1 . 2]" 1
2153 1 88 TYR QE 1 89 ILE H . . 5.500 5.098 4.744 5.427 . 0 0 "[ . 1 . 2]" 1
2154 1 88 TYR QE 1 89 ILE HA . . 4.850 4.496 4.158 4.835 . 0 0 "[ . 1 . 2]" 1
2155 1 88 TYR QE 1 90 ASP H . . 4.060 3.719 3.026 4.047 . 0 0 "[ . 1 . 2]" 1
2156 1 89 ILE H 1 89 ILE HB . . 3.140 2.776 2.656 2.865 . 0 0 "[ . 1 . 2]" 1
2157 1 89 ILE H 1 89 ILE HG12 . . 4.370 4.068 3.802 4.328 . 0 0 "[ . 1 . 2]" 1
2158 1 89 ILE H 1 89 ILE HG13 . . 3.890 3.050 2.794 3.209 . 0 0 "[ . 1 . 2]" 1
2159 1 89 ILE H 1 89 ILE MG . . 3.920 3.890 3.819 3.933 0.013 3 0 "[ . 1 . 2]" 1
2160 1 89 ILE H 1 90 ASP H . . 5.130 4.136 4.050 4.246 . 0 0 "[ . 1 . 2]" 1
2161 1 89 ILE HA 1 89 ILE HG12 . . 3.400 2.529 2.389 2.628 . 0 0 "[ . 1 . 2]" 1
2162 1 89 ILE HA 1 89 ILE HG13 . . 3.470 3.031 2.797 3.276 . 0 0 "[ . 1 . 2]" 1
2163 1 89 ILE HA 1 89 ILE MG . . 3.030 2.369 2.243 2.463 . 0 0 "[ . 1 . 2]" 1
2164 1 89 ILE HA 1 90 ASP H . . 2.670 2.142 2.139 2.153 . 0 0 "[ . 1 . 2]" 1
2165 1 89 ILE HA 1 90 ASP HA . . 4.440 4.394 4.372 4.421 . 0 0 "[ . 1 . 2]" 1
2166 1 89 ILE HA 1 90 ASP QB . . 4.400 4.202 4.041 4.380 . 0 0 "[ . 1 . 2]" 1
2167 1 89 ILE HB 1 89 ILE MD . . 3.030 2.453 2.355 2.612 . 0 0 "[ . 1 . 2]" 1
2168 1 89 ILE HB 1 90 ASP H . . 4.420 4.293 4.173 4.405 . 0 0 "[ . 1 . 2]" 1
2169 1 89 ILE HB 1 91 PHE QD . . 3.910 3.668 3.379 3.913 0.003 17 0 "[ . 1 . 2]" 1
2170 1 89 ILE HB 1 91 PHE QE . . 2.940 2.306 2.015 2.542 . 0 0 "[ . 1 . 2]" 1
2171 1 89 ILE HB 1 91 PHE HZ . . 4.930 3.546 3.170 3.940 . 0 0 "[ . 1 . 2]" 1
2172 1 89 ILE MD 1 89 ILE MG . . 2.670 1.946 1.872 2.084 . 0 0 "[ . 1 . 2]" 1
2173 1 89 ILE MD 1 90 ASP H . . 5.420 5.209 4.891 5.369 . 0 0 "[ . 1 . 2]" 1
2174 1 89 ILE MD 1 91 PHE QE . . 3.760 3.236 2.988 3.444 . 0 0 "[ . 1 . 2]" 1
2175 1 89 ILE MD 1 91 PHE HZ . . 3.930 2.914 2.482 3.197 . 0 0 "[ . 1 . 2]" 1
2176 1 89 ILE HG12 1 89 ILE MG . . 2.980 2.372 2.240 2.520 . 0 0 "[ . 1 . 2]" 1
2177 1 89 ILE HG12 1 90 ASP H . . 4.630 4.477 4.350 4.630 . 0 0 "[ . 1 . 2]" 1
2178 1 89 ILE HG12 1 91 PHE QE . . 5.500 4.966 4.741 5.158 . 0 0 "[ . 1 . 2]" 1
2179 1 89 ILE HG12 1 91 PHE HZ . . 5.500 5.236 4.952 5.436 . 0 0 "[ . 1 . 2]" 1
2180 1 89 ILE HG13 1 90 ASP H . . 5.500 5.086 4.890 5.297 . 0 0 "[ . 1 . 2]" 1
2181 1 89 ILE HG13 1 91 PHE QE . . 5.220 4.453 4.095 4.828 . 0 0 "[ . 1 . 2]" 1
2182 1 89 ILE MG 1 90 ASP H . . 3.240 2.737 2.511 2.965 . 0 0 "[ . 1 . 2]" 1
2183 1 89 ILE MG 1 90 ASP HA . . 4.370 4.104 3.947 4.293 . 0 0 "[ . 1 . 2]" 1
2184 1 89 ILE MG 1 91 PHE HA . . 5.500 4.050 3.724 4.280 . 0 0 "[ . 1 . 2]" 1
2185 1 89 ILE MG 1 91 PHE QD . . 3.450 3.310 3.106 3.459 0.009 18 0 "[ . 1 . 2]" 1
2186 1 89 ILE MG 1 91 PHE QE . . 2.980 2.649 2.495 2.813 . 0 0 "[ . 1 . 2]" 1
2187 1 89 ILE MG 1 91 PHE HZ . . 3.400 2.523 2.089 2.864 . 0 0 "[ . 1 . 2]" 1
2188 1 90 ASP H 1 90 ASP HB2 . . 3.590 2.629 2.256 3.547 . 0 0 "[ . 1 . 2]" 1
2189 1 90 ASP H 1 90 ASP QB . . 2.960 2.243 2.114 2.400 . 0 0 "[ . 1 . 2]" 1
2190 1 90 ASP H 1 90 ASP HB3 . . 3.590 3.019 2.158 3.615 0.025 11 0 "[ . 1 . 2]" 1
2191 1 90 ASP H 1 91 PHE H . . 5.100 4.477 4.313 4.591 . 0 0 "[ . 1 . 2]" 1
2192 1 90 ASP HA 1 91 PHE H . . 2.530 2.152 2.138 2.185 . 0 0 "[ . 1 . 2]" 1
2193 1 90 ASP HA 1 91 PHE HB2 . . 4.520 4.411 4.317 4.492 . 0 0 "[ . 1 . 2]" 1
2194 1 90 ASP HA 1 91 PHE QD . . 4.450 4.288 4.029 4.452 0.002 12 0 "[ . 1 . 2]" 1
2195 1 90 ASP QB 1 91 PHE H . . 3.900 3.492 3.166 3.695 . 0 0 "[ . 1 . 2]" 1
2196 1 90 ASP QB 1 91 PHE HA . . 5.340 4.471 4.171 4.805 . 0 0 "[ . 1 . 2]" 1
2197 1 91 PHE H 1 91 PHE HB2 . . 2.970 2.495 2.353 2.656 . 0 0 "[ . 1 . 2]" 1
2198 1 91 PHE H 1 91 PHE HB3 . . 3.790 3.683 3.598 3.774 . 0 0 "[ . 1 . 2]" 1
2199 1 91 PHE H 1 91 PHE QD . . 3.500 3.326 3.019 3.504 0.004 14 0 "[ . 1 . 2]" 1
2200 1 91 PHE H 1 92 LEU H . . 4.220 4.092 3.899 4.235 0.015 12 0 "[ . 1 . 2]" 1
2201 1 91 PHE H 1 93 VAL MG1 . . 5.500 5.363 5.238 5.504 0.004 15 0 "[ . 1 . 2]" 1
2202 1 91 PHE HA 1 91 PHE QD . . 2.940 2.574 2.460 2.665 . 0 0 "[ . 1 . 2]" 1
2203 1 91 PHE HA 1 92 LEU H . . 2.500 2.168 2.154 2.183 . 0 0 "[ . 1 . 2]" 1
2204 1 91 PHE HA 1 92 LEU HB3 . . 4.480 4.392 4.344 4.468 . 0 0 "[ . 1 . 2]" 1
2205 1 91 PHE HB2 1 92 LEU H . . 4.520 4.503 4.475 4.523 0.003 17 0 "[ . 1 . 2]" 1
2206 1 91 PHE HB2 1 93 VAL MG1 . . 4.060 3.927 3.764 4.057 . 0 0 "[ . 1 . 2]" 1
2207 1 91 PHE HB2 1 93 VAL MG2 . . 4.910 4.824 4.724 4.912 0.002 5 0 "[ . 1 . 2]" 1
2208 1 91 PHE HB3 1 92 LEU H . . 3.820 3.784 3.717 3.845 0.025 15 0 "[ . 1 . 2]" 1
2209 1 91 PHE HB3 1 93 VAL MG1 . . 2.980 2.836 2.705 2.984 0.004 8 0 "[ . 1 . 2]" 1
2210 1 91 PHE HB3 1 93 VAL MG2 . . 4.570 4.385 4.256 4.534 . 0 0 "[ . 1 . 2]" 1
2211 1 91 PHE QD 1 92 LEU H . . 4.200 4.083 3.964 4.203 0.003 15 0 "[ . 1 . 2]" 1
2212 1 91 PHE QD 1 93 VAL MG1 . . 4.380 4.179 3.993 4.360 . 0 0 "[ . 1 . 2]" 1
2213 1 92 LEU H 1 92 LEU HB2 . . 3.140 2.970 2.904 3.048 . 0 0 "[ . 1 . 2]" 1
2214 1 92 LEU H 1 92 LEU HB3 . . 2.920 2.249 2.212 2.336 . 0 0 "[ . 1 . 2]" 1
2215 1 92 LEU H 1 92 LEU HG . . 4.430 4.195 4.136 4.300 . 0 0 "[ . 1 . 2]" 1
2216 1 92 LEU H 1 93 VAL H . . 5.140 4.305 4.243 4.374 . 0 0 "[ . 1 . 2]" 1
2217 1 92 LEU H 1 93 VAL MG1 . . 4.270 4.174 4.070 4.272 0.002 15 0 "[ . 1 . 2]" 1
2218 1 92 LEU HA 1 92 LEU MD1 . . 2.530 2.361 1.988 2.523 . 0 0 "[ . 1 . 2]" 1
2219 1 92 LEU HA 1 92 LEU HG . . 3.460 3.315 3.228 3.461 0.001 9 0 "[ . 1 . 2]" 1
2220 1 92 LEU HA 1 93 VAL H . . 2.410 2.160 2.144 2.177 . 0 0 "[ . 1 . 2]" 1
2221 1 92 LEU HA 1 93 VAL HA . . 4.400 4.400 4.393 4.412 0.012 15 0 "[ . 1 . 2]" 1
2222 1 92 LEU HA 1 93 VAL MG1 . . 4.000 3.930 3.838 4.003 0.003 15 0 "[ . 1 . 2]" 1
2223 1 92 LEU HA 1 93 VAL MG2 . . 3.800 3.772 3.711 3.805 0.005 15 0 "[ . 1 . 2]" 1
2224 1 92 LEU HB2 1 92 LEU MD1 . . 2.540 2.286 2.191 2.489 . 0 0 "[ . 1 . 2]" 1
2225 1 92 LEU HB2 1 92 LEU MD2 . . 3.180 2.468 2.225 2.568 . 0 0 "[ . 1 . 2]" 1
2226 1 92 LEU HB2 1 93 VAL H . . 4.320 4.281 4.214 4.325 0.005 3 0 "[ . 1 . 2]" 1
2227 1 92 LEU HB3 1 92 LEU MD2 . . 2.550 2.227 2.136 2.396 . 0 0 "[ . 1 . 2]" 1
2228 1 92 LEU HB3 1 92 LEU HG . . 2.930 2.516 2.409 2.584 . 0 0 "[ . 1 . 2]" 1
2229 1 92 LEU MD1 1 93 VAL H . . 2.980 2.863 2.281 2.988 0.008 15 0 "[ . 1 . 2]" 1
2230 1 92 LEU MD1 1 93 VAL HA . . 4.750 4.163 3.763 4.322 . 0 0 "[ . 1 . 2]" 1
2231 1 92 LEU HG 1 93 VAL H . . 4.070 3.777 3.596 4.056 . 0 0 "[ . 1 . 2]" 1
2232 1 93 VAL H 1 93 VAL HB . . 3.890 3.753 3.701 3.781 . 0 0 "[ . 1 . 2]" 1
2233 1 93 VAL H 1 93 VAL MG1 . . 3.030 2.802 2.732 2.867 . 0 0 "[ . 1 . 2]" 1
2234 1 93 VAL H 1 93 VAL MG2 . . 2.740 2.020 1.879 2.199 . 0 0 "[ . 1 . 2]" 1
2235 1 93 VAL HA 1 93 VAL HB . . 2.750 2.469 2.447 2.488 . 0 0 "[ . 1 . 2]" 1
2236 1 93 VAL HA 1 93 VAL MG1 . . 2.690 2.328 2.261 2.400 . 0 0 "[ . 1 . 2]" 1
2237 1 93 VAL HA 1 93 VAL MG2 . . 3.240 3.197 3.184 3.203 . 0 0 "[ . 1 . 2]" 1
2238 1 93 VAL HA 1 94 THR H . . 2.490 2.365 2.277 2.411 . 0 0 "[ . 1 . 2]" 1
2239 1 93 VAL HA 1 94 THR HA . . 4.520 4.459 4.405 4.521 0.001 10 0 "[ . 1 . 2]" 1
2240 1 93 VAL HA 1 94 THR HB . . 4.560 4.458 4.340 4.562 0.002 12 0 "[ . 1 . 2]" 1
2241 1 93 VAL HA 1 94 THR MG . . 3.790 3.566 3.456 3.704 . 0 0 "[ . 1 . 2]" 1
2242 1 93 VAL HB 1 94 THR H . . 2.730 2.472 2.358 2.708 . 0 0 "[ . 1 . 2]" 1
2243 1 93 VAL HB 1 94 THR MG . . 4.450 4.253 3.988 4.440 . 0 0 "[ . 1 . 2]" 1
2244 1 93 VAL MG1 1 94 THR H . . 3.780 3.656 3.582 3.762 . 0 0 "[ . 1 . 2]" 1
2245 1 93 VAL MG2 1 94 THR H . . 3.730 3.515 3.395 3.688 . 0 0 "[ . 1 . 2]" 1
2246 1 94 THR H 1 94 THR HB . . 3.470 3.297 3.144 3.439 . 0 0 "[ . 1 . 2]" 1
2247 1 94 THR H 1 94 THR MG . . 2.810 2.097 1.885 2.292 . 0 0 "[ . 1 . 2]" 1
2248 1 94 THR HA 1 94 THR HB . . 2.780 2.417 2.373 2.463 . 0 0 "[ . 1 . 2]" 1
2249 1 94 THR HB 1 95 GLU H . . 4.420 4.352 4.227 4.424 0.004 2 0 "[ . 1 . 2]" 1
2250 1 94 THR MG 1 95 GLU H . . 4.200 3.413 2.318 4.204 0.004 17 0 "[ . 1 . 2]" 1
2251 1 94 THR MG 1 95 GLU HA . . 4.990 4.194 3.692 4.547 . 0 0 "[ . 1 . 2]" 1
2252 1 94 THR MG 1 96 PHE H . . 4.190 2.942 2.065 3.804 . 0 0 "[ . 1 . 2]" 1
2253 1 94 THR MG 1 96 PHE HA . . 5.260 3.787 3.246 4.180 . 0 0 "[ . 1 . 2]" 1
2254 1 94 THR MG 1 96 PHE QB . . 4.810 3.739 3.286 4.251 . 0 0 "[ . 1 . 2]" 1
2255 1 94 THR MG 1 96 PHE QD . . 4.570 3.011 2.697 3.413 . 0 0 "[ . 1 . 2]" 1
2256 1 94 THR MG 1 96 PHE QE . . 3.700 2.721 2.426 3.059 . 0 0 "[ . 1 . 2]" 1
2257 1 94 THR MG 1 96 PHE HZ . . 5.080 2.896 2.432 3.326 . 0 0 "[ . 1 . 2]" 1
2258 1 95 GLU H 1 95 GLU HB2 . . 4.060 2.792 2.193 3.811 . 0 0 "[ . 1 . 2]" 1
2259 1 95 GLU H 1 95 GLU QB . . 3.480 2.670 2.172 3.438 . 0 0 "[ . 1 . 2]" 1
2260 1 95 GLU H 1 95 GLU HB3 . . 4.060 3.641 3.498 3.944 . 0 0 "[ . 1 . 2]" 1
2261 1 95 GLU H 1 95 GLU HG2 . . 4.840 3.732 2.942 4.632 . 0 0 "[ . 1 . 2]" 1
2262 1 95 GLU H 1 95 GLU QG . . 4.170 2.941 2.293 4.106 . 0 0 "[ . 1 . 2]" 1
2263 1 95 GLU H 1 95 GLU HG3 . . 4.840 3.226 2.314 4.842 0.002 15 0 "[ . 1 . 2]" 1
2264 1 95 GLU H 1 96 PHE H . . 4.360 3.532 2.725 4.172 . 0 0 "[ . 1 . 2]" 1
2265 1 95 GLU HA 1 95 GLU HG2 . . 3.640 2.704 2.204 3.571 . 0 0 "[ . 1 . 2]" 1
2266 1 95 GLU HA 1 95 GLU QG . . 3.160 2.431 2.181 2.767 . 0 0 "[ . 1 . 2]" 1
2267 1 95 GLU HA 1 95 GLU HG3 . . 3.640 3.024 2.357 3.622 . 0 0 "[ . 1 . 2]" 1
2268 1 95 GLU HA 1 96 PHE H . . 3.040 2.472 2.240 2.735 . 0 0 "[ . 1 . 2]" 1
2269 1 95 GLU QB 1 96 PHE H . . 4.110 3.871 3.733 3.975 . 0 0 "[ . 1 . 2]" 1
2270 1 96 PHE H 1 96 PHE HB2 . . 3.620 2.340 2.204 2.469 . 0 0 "[ . 1 . 2]" 1
2271 1 96 PHE H 1 96 PHE HB3 . . 3.620 3.566 3.508 3.614 . 0 0 "[ . 1 . 2]" 1
2272 1 96 PHE H 1 96 PHE QD . . 3.960 3.243 3.136 3.377 . 0 0 "[ . 1 . 2]" 1
2273 1 96 PHE HA 1 96 PHE QD . . 3.620 2.093 1.998 2.198 . 0 0 "[ . 1 . 2]" 1
2274 1 96 PHE HA 1 96 PHE QE . . 4.250 4.214 4.149 4.254 0.004 15 0 "[ . 1 . 2]" 1
2275 1 97 ASN QB 1 97 ASN QD . . 3.040 2.155 2.067 2.465 . 0 0 "[ . 1 . 2]" 1
2276 1 99 GLY QA 1 100 PRO QD . . 2.490 1.976 1.859 2.136 . 0 0 "[ . 1 . 2]" 1
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