NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
414521 |
2ctj   |
11135 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ctj
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 1633
_Distance_constraint_stats_list.Viol_count 492
_Distance_constraint_stats_list.Viol_total 99.760
_Distance_constraint_stats_list.Viol_max 0.155
_Distance_constraint_stats_list.Viol_rms 0.0026
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0101
_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 8 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 ILE 0.020 0.018 1 0 "[ . 1 . 2]"
1 10 GLN 0.002 0.002 3 0 "[ . 1 . 2]"
1 11 LYS 0.054 0.035 11 0 "[ . 1 . 2]"
1 12 ASP 0.014 0.009 5 0 "[ . 1 . 2]"
1 13 LEU 0.399 0.155 15 0 "[ . 1 . 2]"
1 14 ALA 0.125 0.064 6 0 "[ . 1 . 2]"
1 15 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 ILE 0.038 0.017 16 0 "[ . 1 . 2]"
1 17 ALA 0.019 0.017 16 0 "[ . 1 . 2]"
1 18 GLU 0.021 0.009 18 0 "[ . 1 . 2]"
1 19 VAL 0.027 0.010 7 0 "[ . 1 . 2]"
1 20 GLU 0.084 0.030 18 0 "[ . 1 . 2]"
1 21 VAL 0.090 0.014 17 0 "[ . 1 . 2]"
1 22 SER 0.044 0.019 17 0 "[ . 1 . 2]"
1 23 ILE 0.082 0.019 17 0 "[ . 1 . 2]"
1 24 PRO 0.131 0.058 12 0 "[ . 1 . 2]"
1 25 ALA 0.005 0.003 17 0 "[ . 1 . 2]"
1 26 LYS 0.200 0.058 12 0 "[ . 1 . 2]"
1 27 LEU 0.101 0.055 14 0 "[ . 1 . 2]"
1 28 HIS 0.026 0.010 12 0 "[ . 1 . 2]"
1 29 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 LEU 0.056 0.016 17 0 "[ . 1 . 2]"
1 32 ILE 0.213 0.025 17 0 "[ . 1 . 2]"
1 33 GLY 0.079 0.014 10 0 "[ . 1 . 2]"
1 34 THR 0.006 0.006 1 0 "[ . 1 . 2]"
1 35 LYS 0.006 0.006 1 0 "[ . 1 . 2]"
1 36 GLY 0.106 0.019 10 0 "[ . 1 . 2]"
1 37 ARG 0.112 0.037 10 0 "[ . 1 . 2]"
1 38 LEU 0.131 0.030 11 0 "[ . 1 . 2]"
1 39 ILE 0.281 0.025 17 0 "[ . 1 . 2]"
1 40 ARG 0.061 0.023 14 0 "[ . 1 . 2]"
1 41 SER 0.005 0.004 17 0 "[ . 1 . 2]"
1 42 ILE 0.026 0.011 20 0 "[ . 1 . 2]"
1 43 MET 0.033 0.009 11 0 "[ . 1 . 2]"
1 44 GLU 0.022 0.004 11 0 "[ . 1 . 2]"
1 45 GLU 0.113 0.106 18 0 "[ . 1 . 2]"
1 46 CYS 0.091 0.054 11 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLY 0.006 0.003 17 0 "[ . 1 . 2]"
1 49 VAL 0.177 0.054 11 0 "[ . 1 . 2]"
1 50 HIS 0.036 0.016 17 0 "[ . 1 . 2]"
1 51 ILE 0.061 0.016 17 0 "[ . 1 . 2]"
1 52 HIS 0.166 0.046 17 0 "[ . 1 . 2]"
1 53 PHE 0.082 0.016 15 0 "[ . 1 . 2]"
1 54 PRO 0.024 0.008 17 0 "[ . 1 . 2]"
1 55 VAL 0.034 0.019 12 0 "[ . 1 . 2]"
1 56 GLU 0.451 0.130 16 0 "[ . 1 . 2]"
1 57 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 SER 0.030 0.010 13 0 "[ . 1 . 2]"
1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 SER 0.075 0.013 3 0 "[ . 1 . 2]"
1 61 ASP 0.024 0.005 15 0 "[ . 1 . 2]"
1 62 THR 0.147 0.054 17 0 "[ . 1 . 2]"
1 63 VAL 0.128 0.037 18 0 "[ . 1 . 2]"
1 64 VAL 0.257 0.037 18 0 "[ . 1 . 2]"
1 65 ILE 0.042 0.015 17 0 "[ . 1 . 2]"
1 66 ARG 0.088 0.019 15 0 "[ . 1 . 2]"
1 67 GLY 0.080 0.019 15 0 "[ . 1 . 2]"
1 68 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 SER 0.063 0.039 19 0 "[ . 1 . 2]"
1 70 SER 0.024 0.006 18 0 "[ . 1 . 2]"
1 71 ASP 0.092 0.049 11 0 "[ . 1 . 2]"
1 72 VAL 0.088 0.039 19 0 "[ . 1 . 2]"
1 73 GLU 0.046 0.011 20 0 "[ . 1 . 2]"
1 74 LYS 0.195 0.034 20 0 "[ . 1 . 2]"
1 75 ALA 0.147 0.021 17 0 "[ . 1 . 2]"
1 76 LYS 0.127 0.047 9 0 "[ . 1 . 2]"
1 77 LYS 0.291 0.071 20 0 "[ . 1 . 2]"
1 78 GLN 0.225 0.021 17 0 "[ . 1 . 2]"
1 79 LEU 0.461 0.034 17 0 "[ . 1 . 2]"
1 80 LEU 0.069 0.023 19 0 "[ . 1 . 2]"
1 81 HIS 0.170 0.057 19 0 "[ . 1 . 2]"
1 82 LEU 0.255 0.046 19 0 "[ . 1 . 2]"
1 83 ALA 0.003 0.003 18 0 "[ . 1 . 2]"
1 84 GLU 0.263 0.110 19 0 "[ . 1 . 2]"
1 85 GLU 0.305 0.100 16 0 "[ . 1 . 2]"
1 86 LYS 0.131 0.100 20 0 "[ . 1 . 2]"
1 87 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.048 0.027 6 0 "[ . 1 . 2]"
1 90 SER 0.048 0.027 6 0 "[ . 1 . 2]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 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 8 SER HA 1 9 ILE H . . 3.390 2.373 2.139 3.388 . 0 0 "[ . 1 . 2]" 1
2 1 8 SER QB 1 9 ILE H . . 4.400 3.344 2.174 4.047 . 0 0 "[ . 1 . 2]" 1
3 1 9 ILE H 1 9 ILE HB . . 3.760 3.293 2.500 3.778 0.018 1 0 "[ . 1 . 2]" 1
4 1 9 ILE H 1 9 ILE HG12 . . 4.320 2.879 1.961 4.120 . 0 0 "[ . 1 . 2]" 1
5 1 9 ILE H 1 9 ILE QG . . 3.790 2.275 1.834 3.107 . 0 0 "[ . 1 . 2]" 1
6 1 9 ILE H 1 9 ILE HG13 . . 4.320 2.772 1.957 3.844 . 0 0 "[ . 1 . 2]" 1
7 1 9 ILE H 1 9 ILE MG . . 4.340 3.055 1.947 3.950 . 0 0 "[ . 1 . 2]" 1
8 1 9 ILE H 1 10 GLN H . . 4.730 3.727 1.808 4.642 . 0 0 "[ . 1 . 2]" 1
9 1 9 ILE HA 1 9 ILE MD . . 4.750 3.880 2.068 4.177 . 0 0 "[ . 1 . 2]" 1
10 1 9 ILE HA 1 9 ILE MG . . 3.710 2.315 2.023 2.488 . 0 0 "[ . 1 . 2]" 1
11 1 9 ILE HA 1 10 GLN H . . 3.470 2.553 2.143 3.472 0.002 3 0 "[ . 1 . 2]" 1
12 1 9 ILE HB 1 10 GLN H . . 4.750 3.710 2.351 4.448 . 0 0 "[ . 1 . 2]" 1
13 1 9 ILE MG 1 10 GLN H . . 4.750 3.647 2.105 4.351 . 0 0 "[ . 1 . 2]" 1
14 1 10 GLN H 1 10 GLN QB . . 3.590 2.763 2.208 3.323 . 0 0 "[ . 1 . 2]" 1
15 1 10 GLN H 1 10 GLN QG . . 4.540 3.091 1.917 4.365 . 0 0 "[ . 1 . 2]" 1
16 1 10 GLN HB2 1 11 LYS H . . 5.160 3.563 2.234 4.626 . 0 0 "[ . 1 . 2]" 1
17 1 10 GLN HB3 1 11 LYS H . . 5.160 3.558 2.294 4.641 . 0 0 "[ . 1 . 2]" 1
18 1 11 LYS H 1 11 LYS QB . . 3.630 2.493 2.117 3.021 . 0 0 "[ . 1 . 2]" 1
19 1 11 LYS H 1 11 LYS QG . . 5.120 3.428 2.298 4.273 . 0 0 "[ . 1 . 2]" 1
20 1 11 LYS HA 1 11 LYS QD . . 3.940 3.107 2.106 3.975 0.035 11 0 "[ . 1 . 2]" 1
21 1 11 LYS HA 1 11 LYS QG . . 3.930 2.363 2.138 2.808 . 0 0 "[ . 1 . 2]" 1
22 1 11 LYS HA 1 12 ASP H . . 3.400 2.382 2.141 2.855 . 0 0 "[ . 1 . 2]" 1
23 1 11 LYS HB2 1 12 ASP H . . 4.600 4.192 3.402 4.583 . 0 0 "[ . 1 . 2]" 1
24 1 11 LYS HB3 1 12 ASP H . . 4.600 3.506 2.098 4.346 . 0 0 "[ . 1 . 2]" 1
25 1 11 LYS QE 1 11 LYS QG . . 3.420 2.186 2.044 2.437 . 0 0 "[ . 1 . 2]" 1
26 1 12 ASP H 1 12 ASP HB2 . . 4.100 3.061 2.491 4.053 . 0 0 "[ . 1 . 2]" 1
27 1 12 ASP H 1 12 ASP QB . . 3.550 2.776 2.426 3.375 . 0 0 "[ . 1 . 2]" 1
28 1 12 ASP H 1 12 ASP HB3 . . 4.100 3.492 2.578 4.009 . 0 0 "[ . 1 . 2]" 1
29 1 12 ASP H 1 13 LEU H . . 4.380 4.094 2.763 4.389 0.009 5 0 "[ . 1 . 2]" 1
30 1 12 ASP HA 1 13 LEU H . . 2.950 2.302 2.140 2.885 . 0 0 "[ . 1 . 2]" 1
31 1 12 ASP QB 1 13 LEU H . . 3.920 3.258 2.119 3.890 . 0 0 "[ . 1 . 2]" 1
32 1 12 ASP HB2 1 13 LEU H . . 4.490 3.944 2.133 4.492 0.002 12 0 "[ . 1 . 2]" 1
33 1 12 ASP HB3 1 13 LEU H . . 4.490 3.665 2.378 4.463 . 0 0 "[ . 1 . 2]" 1
34 1 13 LEU H 1 13 LEU QB . . 3.490 2.540 2.086 3.256 . 0 0 "[ . 1 . 2]" 1
35 1 13 LEU H 1 13 LEU MD1 . . 4.750 3.500 2.185 4.390 . 0 0 "[ . 1 . 2]" 1
36 1 13 LEU H 1 13 LEU QD . . 4.040 2.935 1.870 3.930 . 0 0 "[ . 1 . 2]" 1
37 1 13 LEU H 1 13 LEU MD2 . . 4.750 3.869 1.872 4.556 . 0 0 "[ . 1 . 2]" 1
38 1 13 LEU H 1 13 LEU HG . . 4.200 3.533 2.396 4.355 0.155 15 0 "[ . 1 . 2]" 1
39 1 13 LEU HA 1 13 LEU MD1 . . 4.450 3.485 2.018 4.128 . 0 0 "[ . 1 . 2]" 1
40 1 13 LEU HA 1 13 LEU QD . . 3.260 2.775 1.850 3.348 0.088 6 0 "[ . 1 . 2]" 1
41 1 13 LEU HA 1 13 LEU MD2 . . 4.450 3.197 1.869 4.089 . 0 0 "[ . 1 . 2]" 1
42 1 13 LEU HA 1 13 LEU HG . . 3.960 2.932 2.252 3.740 . 0 0 "[ . 1 . 2]" 1
43 1 13 LEU HA 1 14 ALA H . . 3.230 2.419 2.140 3.272 0.042 6 0 "[ . 1 . 2]" 1
44 1 13 LEU HA 1 14 ALA MB . . 4.610 4.096 3.776 4.603 . 0 0 "[ . 1 . 2]" 1
45 1 13 LEU QB 1 13 LEU QD . . 2.780 1.846 1.753 1.994 . 0 0 "[ . 1 . 2]" 1
46 1 13 LEU QB 1 14 ALA H . . 3.730 3.292 2.725 3.794 0.064 6 0 "[ . 1 . 2]" 1
47 1 13 LEU QB 1 14 ALA MB . . 4.840 4.277 3.705 4.848 0.008 15 0 "[ . 1 . 2]" 1
48 1 13 LEU HB2 1 13 LEU MD1 . . 3.580 2.215 1.992 3.147 . 0 0 "[ . 1 . 2]" 1
49 1 13 LEU HB2 1 13 LEU MD2 . . 3.580 2.833 2.300 3.175 . 0 0 "[ . 1 . 2]" 1
50 1 13 LEU HB2 1 14 ALA H . . 4.600 4.003 2.846 4.517 . 0 0 "[ . 1 . 2]" 1
51 1 13 LEU HB3 1 13 LEU MD1 . . 3.580 2.833 2.162 3.183 . 0 0 "[ . 1 . 2]" 1
52 1 13 LEU HB3 1 13 LEU MD2 . . 3.580 2.172 1.982 3.172 . 0 0 "[ . 1 . 2]" 1
53 1 13 LEU HB3 1 14 ALA H . . 4.600 3.693 2.770 4.280 . 0 0 "[ . 1 . 2]" 1
54 1 13 LEU QD 1 14 ALA H . . 5.440 3.770 2.306 4.582 . 0 0 "[ . 1 . 2]" 1
55 1 13 LEU HG 1 14 ALA H . . 5.170 4.583 3.594 5.125 . 0 0 "[ . 1 . 2]" 1
56 1 14 ALA H 1 14 ALA MB . . 2.970 2.689 2.112 2.875 . 0 0 "[ . 1 . 2]" 1
57 1 14 ALA HA 1 16 ILE H . . 4.790 4.392 3.952 4.780 . 0 0 "[ . 1 . 2]" 1
58 1 14 ALA MB 1 15 ASN H . . 4.220 2.673 2.069 3.200 . 0 0 "[ . 1 . 2]" 1
59 1 14 ALA MB 1 16 ILE H . . 3.340 3.044 2.513 3.338 . 0 0 "[ . 1 . 2]" 1
60 1 15 ASN H 1 16 ILE H . . 3.860 2.633 1.965 3.045 . 0 0 "[ . 1 . 2]" 1
61 1 15 ASN HA 1 16 ILE HA . . 5.010 4.877 4.562 4.993 . 0 0 "[ . 1 . 2]" 1
62 1 15 ASN QB 1 16 ILE H . . 3.690 3.042 2.446 3.478 . 0 0 "[ . 1 . 2]" 1
63 1 15 ASN HB2 1 16 ILE H . . 4.210 3.499 2.538 4.084 . 0 0 "[ . 1 . 2]" 1
64 1 15 ASN HB3 1 16 ILE H . . 4.210 3.613 2.474 4.049 . 0 0 "[ . 1 . 2]" 1
65 1 15 ASN QD 1 16 ILE H . . 4.060 3.128 2.299 3.898 . 0 0 "[ . 1 . 2]" 1
66 1 15 ASN HD21 1 16 ILE H . . 4.860 3.512 2.390 4.606 . 0 0 "[ . 1 . 2]" 1
67 1 15 ASN HD22 1 16 ILE H . . 4.860 3.732 2.883 4.814 . 0 0 "[ . 1 . 2]" 1
68 1 16 ILE H 1 16 ILE HB . . 2.880 2.625 2.390 2.740 . 0 0 "[ . 1 . 2]" 1
69 1 16 ILE H 1 16 ILE MD . . 3.660 3.046 2.670 3.660 . 0 0 "[ . 1 . 2]" 1
70 1 16 ILE H 1 16 ILE QG . . 3.190 2.156 1.911 2.750 . 0 0 "[ . 1 . 2]" 1
71 1 16 ILE H 1 16 ILE MG . . 3.960 3.779 3.733 3.829 . 0 0 "[ . 1 . 2]" 1
72 1 16 ILE H 1 17 ALA H . . 4.630 4.596 4.509 4.647 0.017 16 0 "[ . 1 . 2]" 1
73 1 16 ILE HA 1 16 ILE MD . . 3.420 2.019 1.902 2.243 . 0 0 "[ . 1 . 2]" 1
74 1 16 ILE HA 1 16 ILE HG12 . . 4.220 3.072 2.973 3.231 . 0 0 "[ . 1 . 2]" 1
75 1 16 ILE HA 1 16 ILE HG13 . . 4.220 3.674 3.578 3.750 . 0 0 "[ . 1 . 2]" 1
76 1 16 ILE HA 1 16 ILE MG . . 3.410 2.424 2.325 2.494 . 0 0 "[ . 1 . 2]" 1
77 1 16 ILE HA 1 17 ALA H . . 2.780 2.228 2.188 2.326 . 0 0 "[ . 1 . 2]" 1
78 1 16 ILE HA 1 17 ALA HA . . 5.280 4.403 4.384 4.434 . 0 0 "[ . 1 . 2]" 1
79 1 16 ILE HA 1 17 ALA MB . . 4.300 3.884 3.815 3.948 . 0 0 "[ . 1 . 2]" 1
80 1 16 ILE HA 1 67 GLY H . . 4.950 3.956 3.810 4.140 . 0 0 "[ . 1 . 2]" 1
81 1 16 ILE HA 1 67 GLY HA3 . . 5.350 5.295 5.138 5.359 0.009 7 0 "[ . 1 . 2]" 1
82 1 16 ILE HA 1 68 PRO HA . . 3.990 3.565 3.379 3.723 . 0 0 "[ . 1 . 2]" 1
83 1 16 ILE HA 1 69 SER H . . 4.600 4.537 4.388 4.601 0.001 11 0 "[ . 1 . 2]" 1
84 1 16 ILE HB 1 16 ILE MD . . 3.290 3.220 3.202 3.229 . 0 0 "[ . 1 . 2]" 1
85 1 16 ILE HB 1 17 ALA H . . 4.220 3.978 3.720 4.092 . 0 0 "[ . 1 . 2]" 1
86 1 16 ILE HB 1 17 ALA HA . . 5.000 4.810 4.666 4.888 . 0 0 "[ . 1 . 2]" 1
87 1 16 ILE MD 1 17 ALA H . . 4.770 3.337 3.093 3.567 . 0 0 "[ . 1 . 2]" 1
88 1 16 ILE MD 1 67 GLY H . . 3.270 3.196 2.922 3.275 0.005 4 0 "[ . 1 . 2]" 1
89 1 16 ILE MD 1 67 GLY HA2 . . 3.980 2.326 2.157 2.505 . 0 0 "[ . 1 . 2]" 1
90 1 16 ILE MD 1 67 GLY HA3 . . 4.160 3.828 3.688 3.936 . 0 0 "[ . 1 . 2]" 1
91 1 16 ILE MD 1 68 PRO HA . . 4.590 3.829 3.560 4.016 . 0 0 "[ . 1 . 2]" 1
92 1 16 ILE MD 1 68 PRO HD2 . . 4.470 4.385 4.244 4.470 . 0 0 "[ . 1 . 2]" 1
93 1 16 ILE MD 1 68 PRO HD3 . . 4.300 3.366 3.158 3.470 . 0 0 "[ . 1 . 2]" 1
94 1 16 ILE QG 1 17 ALA H . . 5.180 4.465 4.358 4.563 . 0 0 "[ . 1 . 2]" 1
95 1 16 ILE QG 1 67 GLY H . . 5.060 4.463 4.294 4.618 . 0 0 "[ . 1 . 2]" 1
96 1 16 ILE HG12 1 16 ILE MG . . 3.430 3.192 3.155 3.202 . 0 0 "[ . 1 . 2]" 1
97 1 16 ILE HG13 1 16 ILE MG . . 3.430 2.321 2.121 2.435 . 0 0 "[ . 1 . 2]" 1
98 1 16 ILE MG 1 17 ALA H . . 3.280 2.175 1.874 2.292 . 0 0 "[ . 1 . 2]" 1
99 1 16 ILE MG 1 17 ALA HA . . 4.830 3.504 3.324 3.675 . 0 0 "[ . 1 . 2]" 1
100 1 16 ILE MG 1 18 GLU H . . 3.810 3.612 3.383 3.801 . 0 0 "[ . 1 . 2]" 1
101 1 16 ILE MG 1 66 ARG HA . . 3.870 3.150 2.992 3.310 . 0 0 "[ . 1 . 2]" 1
102 1 16 ILE MG 1 66 ARG HB2 . . 4.370 4.237 4.030 4.372 0.002 16 0 "[ . 1 . 2]" 1
103 1 16 ILE MG 1 66 ARG QB . . 3.820 2.816 2.621 2.966 . 0 0 "[ . 1 . 2]" 1
104 1 16 ILE MG 1 66 ARG HB3 . . 4.370 2.859 2.656 3.018 . 0 0 "[ . 1 . 2]" 1
105 1 16 ILE MG 1 66 ARG HG2 . . 3.800 2.654 2.385 2.906 . 0 0 "[ . 1 . 2]" 1
106 1 16 ILE MG 1 66 ARG HG3 . . 4.060 3.918 3.738 4.060 0.000 16 0 "[ . 1 . 2]" 1
107 1 16 ILE MG 1 67 GLY H . . 2.910 1.855 1.791 1.941 . 0 0 "[ . 1 . 2]" 1
108 1 16 ILE MG 1 67 GLY HA2 . . 4.030 2.844 2.584 3.236 . 0 0 "[ . 1 . 2]" 1
109 1 16 ILE MG 1 67 GLY HA3 . . 4.760 3.905 3.688 4.160 . 0 0 "[ . 1 . 2]" 1
110 1 17 ALA H 1 17 ALA MB . . 3.160 2.430 2.304 2.509 . 0 0 "[ . 1 . 2]" 1
111 1 17 ALA H 1 18 GLU H . . 4.370 4.178 4.051 4.237 . 0 0 "[ . 1 . 2]" 1
112 1 17 ALA H 1 18 GLU HA . . 5.410 4.797 4.641 4.919 . 0 0 "[ . 1 . 2]" 1
113 1 17 ALA H 1 66 ARG HA . . 4.630 4.550 4.256 4.630 . 18 0 "[ . 1 . 2]" 1
114 1 17 ALA H 1 67 GLY H . . 3.460 2.910 2.647 3.104 . 0 0 "[ . 1 . 2]" 1
115 1 17 ALA H 1 67 GLY HA3 . . 5.410 4.702 4.551 4.908 . 0 0 "[ . 1 . 2]" 1
116 1 17 ALA H 1 68 PRO HA . . 4.120 3.593 3.458 3.917 . 0 0 "[ . 1 . 2]" 1
117 1 17 ALA H 1 72 VAL MG2 . . 4.550 3.635 3.500 3.701 . 0 0 "[ . 1 . 2]" 1
118 1 17 ALA HA 1 18 GLU H . . 2.680 2.151 2.145 2.158 . 0 0 "[ . 1 . 2]" 1
119 1 17 ALA MB 1 18 GLU H . . 3.400 3.362 3.329 3.399 . 0 0 "[ . 1 . 2]" 1
120 1 17 ALA MB 1 19 VAL QG . . 3.330 2.821 2.589 2.994 . 0 0 "[ . 1 . 2]" 1
121 1 17 ALA MB 1 67 GLY H . . 4.710 4.309 4.127 4.569 . 0 0 "[ . 1 . 2]" 1
122 1 17 ALA MB 1 69 SER H . . 4.080 2.306 1.963 2.717 . 0 0 "[ . 1 . 2]" 1
123 1 17 ALA MB 1 69 SER QB . . 3.180 2.163 1.985 2.451 . 0 0 "[ . 1 . 2]" 1
124 1 17 ALA MB 1 72 VAL H . . 5.320 4.917 4.651 5.125 . 0 0 "[ . 1 . 2]" 1
125 1 17 ALA MB 1 72 VAL HB . . 4.070 3.711 3.459 3.895 . 0 0 "[ . 1 . 2]" 1
126 1 17 ALA MB 1 72 VAL MG1 . . 3.790 3.642 3.261 3.792 0.002 18 0 "[ . 1 . 2]" 1
127 1 17 ALA MB 1 72 VAL MG2 . . 3.320 2.682 2.326 2.884 . 0 0 "[ . 1 . 2]" 1
128 1 18 GLU H 1 18 GLU QB . . 3.090 2.296 2.248 2.339 . 0 0 "[ . 1 . 2]" 1
129 1 18 GLU H 1 18 GLU HG2 . . 4.820 4.503 4.419 4.620 . 0 0 "[ . 1 . 2]" 1
130 1 18 GLU H 1 18 GLU QG . . 4.200 4.023 3.948 4.090 . 0 0 "[ . 1 . 2]" 1
131 1 18 GLU H 1 18 GLU HG3 . . 4.820 4.542 4.314 4.702 . 0 0 "[ . 1 . 2]" 1
132 1 18 GLU H 1 19 VAL H . . 4.430 4.375 4.315 4.427 . 0 0 "[ . 1 . 2]" 1
133 1 18 GLU H 1 19 VAL QG . . 4.360 3.950 3.771 4.232 . 0 0 "[ . 1 . 2]" 1
134 1 18 GLU HA 1 19 VAL H . . 2.820 2.143 2.138 2.149 . 0 0 "[ . 1 . 2]" 1
135 1 18 GLU HA 1 19 VAL QG . . 4.440 3.706 3.585 3.954 . 0 0 "[ . 1 . 2]" 1
136 1 18 GLU HA 1 64 VAL MG1 . . 4.840 4.012 3.777 4.209 . 0 0 "[ . 1 . 2]" 1
137 1 18 GLU HA 1 65 ILE H . . 4.890 4.650 4.357 4.892 0.002 17 0 "[ . 1 . 2]" 1
138 1 18 GLU HA 1 66 ARG HA . . 3.610 2.810 2.586 2.964 . 0 0 "[ . 1 . 2]" 1
139 1 18 GLU HA 1 66 ARG HG2 . . 4.640 3.877 3.221 4.174 . 0 0 "[ . 1 . 2]" 1
140 1 18 GLU HA 1 66 ARG HG3 . . 4.920 3.414 3.142 3.696 . 0 0 "[ . 1 . 2]" 1
141 1 18 GLU HA 1 67 GLY H . . 4.530 4.154 4.022 4.329 . 0 0 "[ . 1 . 2]" 1
142 1 18 GLU HA 1 72 VAL MG1 . . 4.920 4.414 4.147 4.597 . 0 0 "[ . 1 . 2]" 1
143 1 18 GLU QB 1 19 VAL H . . 4.500 3.856 3.785 3.900 . 0 0 "[ . 1 . 2]" 1
144 1 18 GLU QB 1 64 VAL MG1 . . 4.030 3.937 3.738 4.036 0.006 6 0 "[ . 1 . 2]" 1
145 1 18 GLU QB 1 66 ARG HA . . 4.470 4.227 3.875 4.448 . 0 0 "[ . 1 . 2]" 1
146 1 18 GLU QB 1 66 ARG HG2 . . 4.050 3.613 3.104 3.984 . 0 0 "[ . 1 . 2]" 1
147 1 18 GLU QB 1 66 ARG HG3 . . 4.090 3.746 3.286 4.062 . 0 0 "[ . 1 . 2]" 1
148 1 18 GLU QG 1 19 VAL H . . 3.990 3.111 2.904 3.333 . 0 0 "[ . 1 . 2]" 1
149 1 18 GLU QG 1 64 VAL MG1 . . 2.860 2.206 2.001 2.355 . 0 0 "[ . 1 . 2]" 1
150 1 18 GLU QG 1 65 ILE H . . 4.690 3.882 3.317 4.323 . 0 0 "[ . 1 . 2]" 1
151 1 18 GLU QG 1 66 ARG HG2 . . 4.110 3.392 2.692 4.108 . 0 0 "[ . 1 . 2]" 1
152 1 18 GLU QG 1 66 ARG HG3 . . 4.600 2.600 2.082 3.356 . 0 0 "[ . 1 . 2]" 1
153 1 18 GLU HG2 1 19 VAL H . . 4.760 3.210 2.936 3.665 . 0 0 "[ . 1 . 2]" 1
154 1 18 GLU HG2 1 64 VAL MG1 . . 3.300 2.324 2.092 2.656 . 0 0 "[ . 1 . 2]" 1
155 1 18 GLU HG2 1 66 ARG HG2 . . 4.880 4.458 3.587 4.877 . 0 0 "[ . 1 . 2]" 1
156 1 18 GLU HG3 1 19 VAL H . . 4.760 4.361 3.759 4.769 0.009 18 0 "[ . 1 . 2]" 1
157 1 18 GLU HG3 1 64 VAL MG1 . . 3.300 2.789 2.506 3.008 . 0 0 "[ . 1 . 2]" 1
158 1 18 GLU HG3 1 66 ARG HG2 . . 4.880 3.691 2.714 4.637 . 0 0 "[ . 1 . 2]" 1
159 1 19 VAL H 1 19 VAL HB . . 3.220 2.700 2.565 2.826 . 0 0 "[ . 1 . 2]" 1
160 1 19 VAL H 1 19 VAL QG . . 3.190 2.774 2.667 2.916 . 0 0 "[ . 1 . 2]" 1
161 1 19 VAL H 1 20 GLU H . . 4.460 4.227 4.020 4.417 . 0 0 "[ . 1 . 2]" 1
162 1 19 VAL H 1 64 VAL HA . . 5.000 4.924 4.762 5.010 0.010 7 0 "[ . 1 . 2]" 1
163 1 19 VAL H 1 65 ILE H . . 3.510 3.358 3.167 3.487 . 0 0 "[ . 1 . 2]" 1
164 1 19 VAL H 1 65 ILE HA . . 5.380 5.038 4.926 5.202 . 0 0 "[ . 1 . 2]" 1
165 1 19 VAL H 1 65 ILE HB . . 4.010 3.381 3.122 3.671 . 0 0 "[ . 1 . 2]" 1
166 1 19 VAL H 1 66 ARG HA . . 4.090 3.851 3.568 4.039 . 0 0 "[ . 1 . 2]" 1
167 1 19 VAL H 1 66 ARG HG3 . . 5.060 4.678 4.354 4.967 . 0 0 "[ . 1 . 2]" 1
168 1 19 VAL H 1 67 GLY H . . 5.500 5.369 5.118 5.495 . 0 0 "[ . 1 . 2]" 1
169 1 19 VAL H 1 72 VAL MG1 . . 4.070 3.253 2.978 3.442 . 0 0 "[ . 1 . 2]" 1
170 1 19 VAL HA 1 19 VAL QG . . 3.280 2.139 2.061 2.178 . 0 0 "[ . 1 . 2]" 1
171 1 19 VAL HA 1 20 GLU H . . 2.640 2.154 2.142 2.184 . 0 0 "[ . 1 . 2]" 1
172 1 19 VAL HA 1 65 ILE H . . 5.040 4.891 4.700 5.041 0.001 13 0 "[ . 1 . 2]" 1
173 1 19 VAL HB 1 20 GLU H . . 4.380 4.253 4.061 4.382 0.002 17 0 "[ . 1 . 2]" 1
174 1 19 VAL HB 1 65 ILE H . . 5.200 4.494 4.298 4.711 . 0 0 "[ . 1 . 2]" 1
175 1 19 VAL HB 1 65 ILE HB . . 4.220 3.379 3.107 3.666 . 0 0 "[ . 1 . 2]" 1
176 1 19 VAL HB 1 65 ILE MD . . 4.410 4.037 3.673 4.375 . 0 0 "[ . 1 . 2]" 1
177 1 19 VAL HB 1 72 VAL MG1 . . 3.650 2.067 1.901 2.267 . 0 0 "[ . 1 . 2]" 1
178 1 19 VAL QG 1 20 GLU H . . 3.170 2.695 2.198 2.990 . 0 0 "[ . 1 . 2]" 1
179 1 19 VAL QG 1 20 GLU HA . . 4.310 3.687 3.450 3.934 . 0 0 "[ . 1 . 2]" 1
180 1 19 VAL QG 1 72 VAL MG1 . . 2.580 2.183 1.899 2.495 . 0 0 "[ . 1 . 2]" 1
181 1 19 VAL QG 1 73 GLU HA . . 4.340 4.244 4.089 4.337 . 0 0 "[ . 1 . 2]" 1
182 1 20 GLU H 1 20 GLU QB . . 2.880 2.540 2.417 2.783 . 0 0 "[ . 1 . 2]" 1
183 1 20 GLU H 1 20 GLU QG . . 3.540 2.794 1.903 3.427 . 0 0 "[ . 1 . 2]" 1
184 1 20 GLU H 1 21 VAL H . . 4.690 4.541 4.468 4.582 . 0 0 "[ . 1 . 2]" 1
185 1 20 GLU HA 1 21 VAL H . . 2.830 2.340 2.223 2.424 . 0 0 "[ . 1 . 2]" 1
186 1 20 GLU HA 1 21 VAL HB . . 5.180 4.348 4.249 4.441 . 0 0 "[ . 1 . 2]" 1
187 1 20 GLU HA 1 21 VAL MG1 . . 4.800 3.693 3.469 3.920 . 0 0 "[ . 1 . 2]" 1
188 1 20 GLU HA 1 62 THR MG . . 4.240 3.954 3.613 4.209 . 0 0 "[ . 1 . 2]" 1
189 1 20 GLU HA 1 63 VAL H . . 4.860 4.574 4.184 4.870 0.010 17 0 "[ . 1 . 2]" 1
190 1 20 GLU HA 1 64 VAL HA . . 4.340 2.396 2.009 2.768 . 0 0 "[ . 1 . 2]" 1
191 1 20 GLU HA 1 64 VAL MG1 . . 4.820 3.977 3.596 4.339 . 0 0 "[ . 1 . 2]" 1
192 1 20 GLU HA 1 64 VAL MG2 . . 4.220 3.719 3.138 4.126 . 0 0 "[ . 1 . 2]" 1
193 1 20 GLU HA 1 65 ILE H . . 4.000 2.926 2.408 3.256 . 0 0 "[ . 1 . 2]" 1
194 1 20 GLU QB 1 21 VAL H . . 3.760 2.584 2.344 2.956 . 0 0 "[ . 1 . 2]" 1
195 1 20 GLU QB 1 62 THR MG . . 3.170 2.236 1.892 2.493 . 0 0 "[ . 1 . 2]" 1
196 1 20 GLU QB 1 63 VAL HA . . 5.340 5.032 4.346 5.339 . 0 0 "[ . 1 . 2]" 1
197 1 20 GLU QB 1 64 VAL HA . . 4.430 3.046 1.978 3.810 . 0 0 "[ . 1 . 2]" 1
198 1 20 GLU QB 1 65 ILE H . . 5.100 4.342 3.425 4.951 . 0 0 "[ . 1 . 2]" 1
199 1 20 GLU HB2 1 62 THR MG . . 3.700 2.950 1.905 3.664 . 0 0 "[ . 1 . 2]" 1
200 1 20 GLU HB2 1 64 VAL HA . . 5.100 3.816 2.139 4.937 . 0 0 "[ . 1 . 2]" 1
201 1 20 GLU HB3 1 62 THR MG . . 3.700 2.741 1.992 3.615 . 0 0 "[ . 1 . 2]" 1
202 1 20 GLU HB3 1 64 VAL HA . . 5.100 3.249 2.060 3.963 . 0 0 "[ . 1 . 2]" 1
203 1 20 GLU QG 1 21 VAL H . . 3.960 3.710 2.986 3.964 0.004 13 0 "[ . 1 . 2]" 1
204 1 20 GLU QG 1 62 THR MG . . 3.390 2.692 2.062 2.936 . 0 0 "[ . 1 . 2]" 1
205 1 20 GLU QG 1 64 VAL HA . . 4.880 2.971 1.947 4.572 . 0 0 "[ . 1 . 2]" 1
206 1 20 GLU QG 1 64 VAL MG2 . . 3.360 2.532 1.867 3.390 0.030 18 0 "[ . 1 . 2]" 1
207 1 20 GLU HG2 1 21 VAL H . . 4.770 4.269 3.352 4.745 . 0 0 "[ . 1 . 2]" 1
208 1 20 GLU HG2 1 62 THR MG . . 4.130 3.128 2.720 3.890 . 0 0 "[ . 1 . 2]" 1
209 1 20 GLU HG3 1 21 VAL H . . 4.770 4.239 3.117 4.754 . 0 0 "[ . 1 . 2]" 1
210 1 20 GLU HG3 1 62 THR MG . . 4.130 3.441 2.077 4.132 0.002 4 0 "[ . 1 . 2]" 1
211 1 21 VAL H 1 21 VAL HB . . 3.450 3.223 3.084 3.350 . 0 0 "[ . 1 . 2]" 1
212 1 21 VAL H 1 21 VAL MG1 . . 3.560 2.278 2.156 2.387 . 0 0 "[ . 1 . 2]" 1
213 1 21 VAL H 1 21 VAL MG2 . . 4.090 3.940 3.894 3.978 . 0 0 "[ . 1 . 2]" 1
214 1 21 VAL H 1 22 SER H . . 4.610 4.410 4.354 4.477 . 0 0 "[ . 1 . 2]" 1
215 1 21 VAL H 1 62 THR HA . . 4.590 4.363 4.085 4.603 0.013 18 0 "[ . 1 . 2]" 1
216 1 21 VAL H 1 62 THR MG . . 3.990 3.249 2.455 3.897 . 0 0 "[ . 1 . 2]" 1
217 1 21 VAL H 1 63 VAL H . . 3.640 2.814 2.494 3.093 . 0 0 "[ . 1 . 2]" 1
218 1 21 VAL H 1 63 VAL HB . . 4.020 3.185 2.938 3.336 . 0 0 "[ . 1 . 2]" 1
219 1 21 VAL H 1 63 VAL MG1 . . 5.060 4.107 3.761 4.478 . 0 0 "[ . 1 . 2]" 1
220 1 21 VAL H 1 63 VAL MG2 . . 5.030 4.409 4.208 4.615 . 0 0 "[ . 1 . 2]" 1
221 1 21 VAL H 1 64 VAL HA . . 4.340 3.970 3.567 4.341 0.001 12 0 "[ . 1 . 2]" 1
222 1 21 VAL H 1 65 ILE H . . 5.480 4.875 4.449 5.287 . 0 0 "[ . 1 . 2]" 1
223 1 21 VAL HA 1 21 VAL MG2 . . 3.640 2.258 2.161 2.380 . 0 0 "[ . 1 . 2]" 1
224 1 21 VAL HA 1 22 SER H . . 2.660 2.297 2.223 2.402 . 0 0 "[ . 1 . 2]" 1
225 1 21 VAL HA 1 22 SER HB2 . . 4.890 4.525 4.376 4.658 . 0 0 "[ . 1 . 2]" 1
226 1 21 VAL HA 1 22 SER QB . . 4.190 4.089 4.049 4.130 . 0 0 "[ . 1 . 2]" 1
227 1 21 VAL HA 1 22 SER HB3 . . 4.890 4.675 4.503 4.853 . 0 0 "[ . 1 . 2]" 1
228 1 21 VAL HB 1 22 SER H . . 4.060 3.934 3.761 4.061 0.001 15 0 "[ . 1 . 2]" 1
229 1 21 VAL HB 1 23 ILE MD . . 4.440 4.221 4.044 4.448 0.008 17 0 "[ . 1 . 2]" 1
230 1 21 VAL HB 1 63 VAL H . . 5.490 5.351 5.188 5.493 0.003 4 0 "[ . 1 . 2]" 1
231 1 21 VAL HB 1 63 VAL HB . . 4.670 4.534 4.291 4.678 0.008 17 0 "[ . 1 . 2]" 1
232 1 21 VAL HB 1 65 ILE MD . . 4.390 3.956 3.502 4.184 . 0 0 "[ . 1 . 2]" 1
233 1 21 VAL HB 1 76 LYS QD . . 4.490 4.035 2.851 4.491 0.001 16 0 "[ . 1 . 2]" 1
234 1 21 VAL HB 1 76 LYS HE2 . . 5.200 3.707 2.020 4.981 . 0 0 "[ . 1 . 2]" 1
235 1 21 VAL HB 1 76 LYS QE . . 4.540 2.786 1.865 3.794 . 0 0 "[ . 1 . 2]" 1
236 1 21 VAL HB 1 76 LYS HE3 . . 5.200 3.061 2.191 4.380 . 0 0 "[ . 1 . 2]" 1
237 1 21 VAL HB 1 76 LYS QG . . 4.180 2.831 2.387 3.736 . 0 0 "[ . 1 . 2]" 1
238 1 21 VAL HB 1 79 LEU MD2 . . 5.260 4.559 4.174 4.990 . 0 0 "[ . 1 . 2]" 1
239 1 21 VAL MG1 1 22 SER H . . 3.700 3.577 3.367 3.707 0.007 4 0 "[ . 1 . 2]" 1
240 1 21 VAL MG1 1 23 ILE MD . . 3.240 2.012 1.856 2.324 . 0 0 "[ . 1 . 2]" 1
241 1 21 VAL MG1 1 23 ILE HG12 . . 4.050 3.497 1.995 3.985 . 0 0 "[ . 1 . 2]" 1
242 1 21 VAL MG1 1 23 ILE QG . . 3.380 2.227 1.920 2.671 . 0 0 "[ . 1 . 2]" 1
243 1 21 VAL MG1 1 23 ILE HG13 . . 4.050 2.280 1.978 2.720 . 0 0 "[ . 1 . 2]" 1
244 1 21 VAL MG1 1 63 VAL H . . 4.590 2.988 2.578 3.282 . 0 0 "[ . 1 . 2]" 1
245 1 21 VAL MG1 1 63 VAL HB . . 3.480 1.969 1.831 2.133 . 0 0 "[ . 1 . 2]" 1
246 1 21 VAL MG1 1 63 VAL MG1 . . 3.950 2.907 2.629 3.094 . 0 0 "[ . 1 . 2]" 1
247 1 21 VAL MG1 1 63 VAL MG2 . . 4.320 2.891 2.630 3.156 . 0 0 "[ . 1 . 2]" 1
248 1 21 VAL MG1 1 65 ILE MD . . 3.640 3.031 2.678 3.318 . 0 0 "[ . 1 . 2]" 1
249 1 21 VAL MG1 1 65 ILE HG13 . . 4.110 3.777 3.487 4.030 . 0 0 "[ . 1 . 2]" 1
250 1 21 VAL MG1 1 76 LYS HA . . 4.500 4.181 3.878 4.351 . 0 0 "[ . 1 . 2]" 1
251 1 21 VAL MG1 1 76 LYS QG . . 3.850 3.343 2.874 3.778 . 0 0 "[ . 1 . 2]" 1
252 1 21 VAL MG2 1 22 SER H . . 3.550 1.926 1.788 2.139 . 0 0 "[ . 1 . 2]" 1
253 1 21 VAL MG2 1 23 ILE H . . 4.910 4.478 3.975 4.858 . 0 0 "[ . 1 . 2]" 1
254 1 21 VAL MG2 1 23 ILE MD . . 3.100 2.673 2.191 3.114 0.014 17 0 "[ . 1 . 2]" 1
255 1 21 VAL MG2 1 23 ILE HG12 . . 3.890 3.234 2.811 3.528 . 0 0 "[ . 1 . 2]" 1
256 1 21 VAL MG2 1 23 ILE QG . . 3.320 2.338 1.954 2.750 . 0 0 "[ . 1 . 2]" 1
257 1 21 VAL MG2 1 23 ILE HG13 . . 3.890 2.452 1.976 3.897 0.007 18 0 "[ . 1 . 2]" 1
258 1 21 VAL MG2 1 63 VAL HB . . 4.630 4.454 4.217 4.633 0.003 14 0 "[ . 1 . 2]" 1
259 1 21 VAL MG2 1 76 LYS HA . . 5.050 4.857 4.403 5.054 0.004 20 0 "[ . 1 . 2]" 1
260 1 21 VAL MG2 1 76 LYS QE . . 3.750 2.498 1.991 3.136 . 0 0 "[ . 1 . 2]" 1
261 1 21 VAL MG2 1 76 LYS QG . . 3.270 2.975 2.564 3.224 . 0 0 "[ . 1 . 2]" 1
262 1 22 SER H 1 22 SER HB2 . . 3.250 2.775 2.613 3.017 . 0 0 "[ . 1 . 2]" 1
263 1 22 SER H 1 22 SER HB3 . . 3.250 2.459 2.337 2.590 . 0 0 "[ . 1 . 2]" 1
264 1 22 SER H 1 23 ILE H . . 4.490 4.388 4.228 4.509 0.019 17 0 "[ . 1 . 2]" 1
265 1 22 SER H 1 23 ILE QG . . 5.250 3.742 3.517 4.027 . 0 0 "[ . 1 . 2]" 1
266 1 22 SER H 1 76 LYS QE . . 5.230 4.883 4.201 5.239 0.009 6 0 "[ . 1 . 2]" 1
267 1 22 SER HA 1 23 ILE H . . 3.030 2.145 2.138 2.161 . 0 0 "[ . 1 . 2]" 1
268 1 22 SER HA 1 62 THR HA . . 4.150 3.022 2.562 3.460 . 0 0 "[ . 1 . 2]" 1
269 1 22 SER HA 1 63 VAL H . . 4.290 3.964 3.501 4.268 . 0 0 "[ . 1 . 2]" 1
270 1 22 SER HB2 1 23 ILE H . . 4.510 4.329 4.190 4.459 . 0 0 "[ . 1 . 2]" 1
271 1 22 SER HB3 1 23 ILE H . . 4.510 4.354 4.261 4.495 . 0 0 "[ . 1 . 2]" 1
272 1 23 ILE H 1 23 ILE HB . . 3.690 2.906 2.787 2.992 . 0 0 "[ . 1 . 2]" 1
273 1 23 ILE H 1 23 ILE MD . . 4.720 4.368 3.838 4.580 . 0 0 "[ . 1 . 2]" 1
274 1 23 ILE H 1 23 ILE HG12 . . 4.530 4.110 2.649 4.272 . 0 0 "[ . 1 . 2]" 1
275 1 23 ILE H 1 23 ILE QG . . 3.970 3.106 2.612 3.296 . 0 0 "[ . 1 . 2]" 1
276 1 23 ILE H 1 23 ILE HG13 . . 4.530 3.273 3.137 3.958 . 0 0 "[ . 1 . 2]" 1
277 1 23 ILE H 1 23 ILE MG . . 4.240 3.924 3.899 3.959 . 0 0 "[ . 1 . 2]" 1
278 1 23 ILE H 1 24 PRO HD2 . . 5.320 4.773 4.705 4.818 . 0 0 "[ . 1 . 2]" 1
279 1 23 ILE H 1 24 PRO QD . . 4.450 4.175 4.049 4.257 . 0 0 "[ . 1 . 2]" 1
280 1 23 ILE H 1 24 PRO HD3 . . 5.320 4.611 4.417 4.741 . 0 0 "[ . 1 . 2]" 1
281 1 23 ILE H 1 61 ASP HB2 . . 4.570 3.704 2.840 4.381 . 0 0 "[ . 1 . 2]" 1
282 1 23 ILE H 1 61 ASP QB . . 3.710 3.253 2.812 3.700 . 0 0 "[ . 1 . 2]" 1
283 1 23 ILE H 1 61 ASP HB3 . . 4.570 4.055 3.081 4.573 0.003 18 0 "[ . 1 . 2]" 1
284 1 23 ILE H 1 62 THR HA . . 4.450 3.092 2.232 3.410 . 0 0 "[ . 1 . 2]" 1
285 1 23 ILE H 1 63 VAL H . . 4.490 3.907 3.325 4.286 . 0 0 "[ . 1 . 2]" 1
286 1 23 ILE H 1 63 VAL MG2 . . 4.480 3.761 3.047 4.264 . 0 0 "[ . 1 . 2]" 1
287 1 23 ILE HA 1 23 ILE MD . . 4.310 3.725 2.186 3.854 . 0 0 "[ . 1 . 2]" 1
288 1 23 ILE HA 1 23 ILE HG12 . . 4.230 2.526 2.386 2.998 . 0 0 "[ . 1 . 2]" 1
289 1 23 ILE HA 1 23 ILE HG13 . . 4.230 3.068 2.914 3.830 . 0 0 "[ . 1 . 2]" 1
290 1 23 ILE HA 1 23 ILE MG . . 3.700 2.457 2.360 2.470 . 0 0 "[ . 1 . 2]" 1
291 1 23 ILE HA 1 24 PRO HD2 . . 3.510 2.166 2.079 2.178 . 0 0 "[ . 1 . 2]" 1
292 1 23 ILE HA 1 24 PRO QD . . 3.020 1.966 1.923 1.972 . 0 0 "[ . 1 . 2]" 1
293 1 23 ILE HA 1 24 PRO HD3 . . 3.510 2.253 2.251 2.265 . 0 0 "[ . 1 . 2]" 1
294 1 23 ILE HA 1 24 PRO HG2 . . 4.600 4.325 4.256 4.335 . 0 0 "[ . 1 . 2]" 1
295 1 23 ILE HA 1 24 PRO HG3 . . 4.600 4.355 4.327 4.360 . 0 0 "[ . 1 . 2]" 1
296 1 23 ILE HB 1 23 ILE MD . . 3.330 2.463 2.315 3.211 . 0 0 "[ . 1 . 2]" 1
297 1 23 ILE HB 1 24 PRO HD2 . . 5.500 3.951 3.901 4.161 . 0 0 "[ . 1 . 2]" 1
298 1 23 ILE HB 1 24 PRO QD . . 4.730 3.792 3.748 3.967 . 0 0 "[ . 1 . 2]" 1
299 1 23 ILE HB 1 24 PRO HD3 . . 5.500 4.886 4.845 4.998 . 0 0 "[ . 1 . 2]" 1
300 1 23 ILE HB 1 28 HIS HD2 . . 4.530 3.509 3.174 3.882 . 0 0 "[ . 1 . 2]" 1
301 1 23 ILE HB 1 53 PHE HZ . . 5.500 5.457 4.939 5.507 0.007 17 0 "[ . 1 . 2]" 1
302 1 23 ILE HB 1 62 THR HA . . 5.500 4.724 3.458 5.144 . 0 0 "[ . 1 . 2]" 1
303 1 23 ILE HB 1 63 VAL MG2 . . 3.510 2.237 1.925 2.722 . 0 0 "[ . 1 . 2]" 1
304 1 23 ILE MD 1 23 ILE MG . . 3.050 2.034 1.879 2.205 . 0 0 "[ . 1 . 2]" 1
305 1 23 ILE MD 1 31 LEU MD1 . . 3.430 2.767 2.268 3.280 . 0 0 "[ . 1 . 2]" 1
306 1 23 ILE MD 1 53 PHE QE . . 4.560 3.645 3.189 4.546 . 0 0 "[ . 1 . 2]" 1
307 1 23 ILE MD 1 53 PHE HZ . . 5.050 3.896 3.421 4.669 . 0 0 "[ . 1 . 2]" 1
308 1 23 ILE MD 1 63 VAL HB . . 4.470 3.280 2.622 4.018 . 0 0 "[ . 1 . 2]" 1
309 1 23 ILE MD 1 63 VAL MG1 . . 4.280 3.631 3.095 4.288 0.008 18 0 "[ . 1 . 2]" 1
310 1 23 ILE MD 1 63 VAL MG2 . . 3.730 2.586 2.148 3.513 . 0 0 "[ . 1 . 2]" 1
311 1 23 ILE MD 1 79 LEU HB3 . . 4.110 3.110 2.828 3.448 . 0 0 "[ . 1 . 2]" 1
312 1 23 ILE MD 1 79 LEU MD1 . . 4.180 3.886 3.684 4.179 . 0 0 "[ . 1 . 2]" 1
313 1 23 ILE MD 1 79 LEU MD2 . . 3.210 1.818 1.690 2.049 . 0 0 "[ . 1 . 2]" 1
314 1 23 ILE MD 1 79 LEU HG . . 4.090 3.107 2.803 3.482 . 0 0 "[ . 1 . 2]" 1
315 1 23 ILE MD 1 80 LEU H . . 4.750 4.252 3.957 4.630 . 0 0 "[ . 1 . 2]" 1
316 1 23 ILE MD 1 80 LEU HA . . 4.090 3.304 2.963 3.591 . 0 0 "[ . 1 . 2]" 1
317 1 23 ILE MD 1 80 LEU MD1 . . 3.470 2.937 2.344 3.367 . 0 0 "[ . 1 . 2]" 1
318 1 23 ILE MD 1 83 ALA H . . 5.500 4.648 4.087 5.189 . 0 0 "[ . 1 . 2]" 1
319 1 23 ILE MD 1 83 ALA MB . . 3.490 2.674 2.134 3.142 . 0 0 "[ . 1 . 2]" 1
320 1 23 ILE QG 1 63 VAL HB . . 4.970 4.035 2.565 4.603 . 0 0 "[ . 1 . 2]" 1
321 1 23 ILE QG 1 63 VAL MG2 . . 4.230 3.357 2.088 3.914 . 0 0 "[ . 1 . 2]" 1
322 1 23 ILE QG 1 80 LEU MD1 . . 4.680 3.831 3.350 4.306 . 0 0 "[ . 1 . 2]" 1
323 1 23 ILE HG12 1 63 VAL MG2 . . 5.060 4.392 2.712 4.957 . 0 0 "[ . 1 . 2]" 1
324 1 23 ILE HG13 1 63 VAL MG2 . . 5.060 3.486 2.170 4.099 . 0 0 "[ . 1 . 2]" 1
325 1 23 ILE MG 1 24 PRO HA . . 5.230 3.943 3.916 4.142 . 0 0 "[ . 1 . 2]" 1
326 1 23 ILE MG 1 24 PRO HD2 . . 3.970 1.829 1.814 1.943 . 0 0 "[ . 1 . 2]" 1
327 1 23 ILE MG 1 24 PRO QD . . 3.390 1.818 1.803 1.930 . 0 0 "[ . 1 . 2]" 1
328 1 23 ILE MG 1 24 PRO HD3 . . 3.970 3.163 3.141 3.283 . 0 0 "[ . 1 . 2]" 1
329 1 23 ILE MG 1 24 PRO HG2 . . 4.890 2.953 2.923 3.072 . 0 0 "[ . 1 . 2]" 1
330 1 23 ILE MG 1 24 PRO QG . . 4.290 2.870 2.843 2.988 . 0 0 "[ . 1 . 2]" 1
331 1 23 ILE MG 1 24 PRO HG3 . . 4.890 3.908 3.881 4.082 . 0 0 "[ . 1 . 2]" 1
332 1 23 ILE MG 1 27 LEU H . . 4.820 3.940 3.745 4.226 . 0 0 "[ . 1 . 2]" 1
333 1 23 ILE MG 1 27 LEU HB3 . . 3.680 3.420 3.080 3.682 0.002 12 0 "[ . 1 . 2]" 1
334 1 23 ILE MG 1 28 HIS H . . 4.570 3.539 3.282 3.982 . 0 0 "[ . 1 . 2]" 1
335 1 23 ILE MG 1 28 HIS HA . . 5.500 3.862 3.405 4.170 . 0 0 "[ . 1 . 2]" 1
336 1 23 ILE MG 1 28 HIS HD2 . . 3.770 2.153 1.893 2.427 . 0 0 "[ . 1 . 2]" 1
337 1 23 ILE MG 1 63 VAL MG2 . . 4.510 3.136 2.595 3.569 . 0 0 "[ . 1 . 2]" 1
338 1 23 ILE MG 1 83 ALA MB . . 3.500 2.569 2.261 3.014 . 0 0 "[ . 1 . 2]" 1
339 1 24 PRO HA 1 25 ALA H . . 2.810 2.242 2.158 2.380 . 0 0 "[ . 1 . 2]" 1
340 1 24 PRO HA 1 25 ALA MB . . 4.350 4.021 3.953 4.048 . 0 0 "[ . 1 . 2]" 1
341 1 24 PRO HA 1 61 ASP HB2 . . 4.970 3.468 2.706 4.231 . 0 0 "[ . 1 . 2]" 1
342 1 24 PRO HA 1 61 ASP QB . . 4.180 2.240 1.988 2.605 . 0 0 "[ . 1 . 2]" 1
343 1 24 PRO HA 1 61 ASP HB3 . . 4.970 2.294 2.039 2.641 . 0 0 "[ . 1 . 2]" 1
344 1 24 PRO HB2 1 25 ALA H . . 4.210 3.095 2.670 3.485 . 0 0 "[ . 1 . 2]" 1
345 1 24 PRO HB2 1 26 LYS H . . 5.300 2.699 2.284 3.338 . 0 0 "[ . 1 . 2]" 1
346 1 24 PRO HB2 1 26 LYS QE . . 4.270 2.722 1.954 3.816 . 0 0 "[ . 1 . 2]" 1
347 1 24 PRO HB2 1 26 LYS QG . . 4.490 2.165 1.947 2.489 . 0 0 "[ . 1 . 2]" 1
348 1 24 PRO HB2 1 27 LEU H . . 3.620 3.098 2.824 3.320 . 0 0 "[ . 1 . 2]" 1
349 1 24 PRO HB2 1 27 LEU MD1 . . 4.320 3.992 3.620 4.188 . 0 0 "[ . 1 . 2]" 1
350 1 24 PRO HB2 1 27 LEU HG . . 3.990 3.516 2.934 3.832 . 0 0 "[ . 1 . 2]" 1
351 1 24 PRO HB3 1 25 ALA H . . 4.090 3.725 3.483 3.969 . 0 0 "[ . 1 . 2]" 1
352 1 24 PRO HB3 1 26 LYS H . . 4.750 4.235 3.924 4.765 0.015 13 0 "[ . 1 . 2]" 1
353 1 24 PRO HB3 1 26 LYS QE . . 4.220 3.169 2.260 4.278 0.058 12 0 "[ . 1 . 2]" 1
354 1 24 PRO HB3 1 26 LYS QG . . 4.520 3.678 3.342 4.002 . 0 0 "[ . 1 . 2]" 1
355 1 24 PRO HB3 1 27 LEU H . . 4.900 4.745 4.516 4.916 0.016 12 0 "[ . 1 . 2]" 1
356 1 24 PRO HB3 1 27 LEU MD1 . . 4.590 4.352 3.956 4.595 0.005 12 0 "[ . 1 . 2]" 1
357 1 24 PRO HB3 1 27 LEU HG . . 5.150 4.658 4.148 5.003 . 0 0 "[ . 1 . 2]" 1
358 1 24 PRO QD 1 27 LEU MD1 . . 3.340 2.279 1.992 2.617 . 0 0 "[ . 1 . 2]" 1
359 1 24 PRO HD2 1 27 LEU MD1 . . 3.940 2.319 2.013 2.713 . 0 0 "[ . 1 . 2]" 1
360 1 24 PRO HD2 1 27 LEU HG . . 5.500 4.058 3.726 4.474 . 0 0 "[ . 1 . 2]" 1
361 1 24 PRO HD3 1 27 LEU MD1 . . 3.940 3.365 3.095 3.505 . 0 0 "[ . 1 . 2]" 1
362 1 24 PRO HD3 1 27 LEU HG . . 5.500 4.942 4.732 5.271 . 0 0 "[ . 1 . 2]" 1
363 1 24 PRO QG 1 26 LYS QE . . 4.570 2.469 1.908 3.394 . 0 0 "[ . 1 . 2]" 1
364 1 24 PRO QG 1 26 LYS QG . . 4.960 2.685 2.223 3.095 . 0 0 "[ . 1 . 2]" 1
365 1 24 PRO QG 1 27 LEU H . . 4.220 2.925 2.707 3.131 . 0 0 "[ . 1 . 2]" 1
366 1 24 PRO QG 1 27 LEU MD1 . . 3.750 1.931 1.765 2.062 . 0 0 "[ . 1 . 2]" 1
367 1 24 PRO QG 1 27 LEU HG . . 3.740 2.103 1.971 2.342 . 0 0 "[ . 1 . 2]" 1
368 1 24 PRO HG2 1 27 LEU MD1 . . 4.590 2.018 1.915 2.184 . 0 0 "[ . 1 . 2]" 1
369 1 24 PRO HG3 1 27 LEU MD1 . . 4.590 2.501 1.973 2.818 . 0 0 "[ . 1 . 2]" 1
370 1 25 ALA H 1 25 ALA MB . . 2.960 2.181 2.038 2.263 . 0 0 "[ . 1 . 2]" 1
371 1 25 ALA H 1 28 HIS HE1 . . 5.500 4.822 4.481 5.138 . 0 0 "[ . 1 . 2]" 1
372 1 25 ALA H 1 61 ASP HA . . 3.810 3.750 3.514 3.811 0.001 4 0 "[ . 1 . 2]" 1
373 1 25 ALA H 1 61 ASP QB . . 4.200 3.345 2.907 4.020 . 0 0 "[ . 1 . 2]" 1
374 1 25 ALA HA 1 27 LEU H . . 4.600 3.830 3.547 4.024 . 0 0 "[ . 1 . 2]" 1
375 1 25 ALA HA 1 28 HIS H . . 4.250 3.000 2.865 3.170 . 0 0 "[ . 1 . 2]" 1
376 1 25 ALA HA 1 28 HIS HD2 . . 5.140 3.596 2.988 3.892 . 0 0 "[ . 1 . 2]" 1
377 1 25 ALA HA 1 28 HIS HE1 . . 4.500 3.516 3.132 3.840 . 0 0 "[ . 1 . 2]" 1
378 1 25 ALA MB 1 26 LYS H . . 3.390 2.735 2.389 3.059 . 0 0 "[ . 1 . 2]" 1
379 1 25 ALA MB 1 26 LYS HA . . 4.560 3.826 3.625 3.933 . 0 0 "[ . 1 . 2]" 1
380 1 25 ALA MB 1 28 HIS H . . 4.470 4.301 4.124 4.470 . 0 0 "[ . 1 . 2]" 1
381 1 25 ALA MB 1 28 HIS HE1 . . 4.320 3.791 3.250 4.176 . 0 0 "[ . 1 . 2]" 1
382 1 25 ALA MB 1 60 SER H . . 4.820 4.387 3.884 4.819 . 0 0 "[ . 1 . 2]" 1
383 1 25 ALA MB 1 61 ASP H . . 5.500 5.263 5.024 5.503 0.003 17 0 "[ . 1 . 2]" 1
384 1 25 ALA MB 1 61 ASP HA . . 4.240 3.706 3.460 3.979 . 0 0 "[ . 1 . 2]" 1
385 1 26 LYS H 1 26 LYS HB2 . . 3.750 3.558 3.518 3.609 . 0 0 "[ . 1 . 2]" 1
386 1 26 LYS H 1 26 LYS QB . . 3.050 2.304 2.200 2.547 . 0 0 "[ . 1 . 2]" 1
387 1 26 LYS H 1 26 LYS HB3 . . 3.750 2.335 2.223 2.604 . 0 0 "[ . 1 . 2]" 1
388 1 26 LYS H 1 26 LYS QD . . 4.020 3.537 1.843 4.045 0.025 18 0 "[ . 1 . 2]" 1
389 1 26 LYS H 1 26 LYS QE . . 5.320 4.236 2.699 4.863 . 0 0 "[ . 1 . 2]" 1
390 1 26 LYS H 1 26 LYS HG2 . . 4.190 2.663 2.310 3.305 . 0 0 "[ . 1 . 2]" 1
391 1 26 LYS H 1 26 LYS QG . . 3.330 2.576 2.290 2.819 . 0 0 "[ . 1 . 2]" 1
392 1 26 LYS H 1 26 LYS HG3 . . 4.190 3.827 2.394 4.121 . 0 0 "[ . 1 . 2]" 1
393 1 26 LYS H 1 27 LEU H . . 3.670 2.745 2.485 2.931 . 0 0 "[ . 1 . 2]" 1
394 1 26 LYS H 1 28 HIS H . . 4.510 4.184 3.981 4.455 . 0 0 "[ . 1 . 2]" 1
395 1 26 LYS HA 1 28 HIS H . . 5.020 4.606 4.356 4.807 . 0 0 "[ . 1 . 2]" 1
396 1 26 LYS HB2 1 27 LEU H . . 4.200 4.033 3.768 4.191 . 0 0 "[ . 1 . 2]" 1
397 1 26 LYS HB3 1 27 LEU H . . 4.200 3.890 3.738 4.118 . 0 0 "[ . 1 . 2]" 1
398 1 26 LYS QE 1 26 LYS HG2 . . 3.820 2.420 2.140 3.270 . 0 0 "[ . 1 . 2]" 1
399 1 26 LYS QE 1 26 LYS QG . . 3.350 2.169 2.099 2.380 . 0 0 "[ . 1 . 2]" 1
400 1 26 LYS QE 1 26 LYS HG3 . . 3.820 2.612 2.144 3.277 . 0 0 "[ . 1 . 2]" 1
401 1 26 LYS QE 1 27 LEU MD1 . . 4.580 3.351 2.751 4.283 . 0 0 "[ . 1 . 2]" 1
402 1 26 LYS QE 1 27 LEU HG . . 3.760 2.857 2.178 3.760 0.000 13 0 "[ . 1 . 2]" 1
403 1 26 LYS QG 1 27 LEU HB2 . . 4.270 3.612 3.492 3.858 . 0 0 "[ . 1 . 2]" 1
404 1 26 LYS QG 1 27 LEU MD2 . . 3.610 2.707 2.266 3.415 . 0 0 "[ . 1 . 2]" 1
405 1 26 LYS QG 1 28 HIS H . . 5.120 4.282 4.053 4.521 . 0 0 "[ . 1 . 2]" 1
406 1 26 LYS HG2 1 27 LEU H . . 4.270 2.309 1.899 4.095 . 0 0 "[ . 1 . 2]" 1
407 1 26 LYS HG2 1 27 LEU MD2 . . 4.180 3.625 3.322 4.235 0.055 14 0 "[ . 1 . 2]" 1
408 1 26 LYS HG2 1 27 LEU HG . . 3.740 2.522 2.124 3.732 . 0 0 "[ . 1 . 2]" 1
409 1 26 LYS HG3 1 27 LEU H . . 4.270 3.078 2.375 3.776 . 0 0 "[ . 1 . 2]" 1
410 1 26 LYS HG3 1 27 LEU MD2 . . 4.180 2.823 2.301 4.015 . 0 0 "[ . 1 . 2]" 1
411 1 26 LYS HG3 1 27 LEU HG . . 3.740 2.630 2.302 3.384 . 0 0 "[ . 1 . 2]" 1
412 1 27 LEU H 1 27 LEU HB2 . . 3.460 2.381 2.302 2.495 . 0 0 "[ . 1 . 2]" 1
413 1 27 LEU H 1 27 LEU HB3 . . 3.740 3.602 3.558 3.630 . 0 0 "[ . 1 . 2]" 1
414 1 27 LEU H 1 27 LEU MD1 . . 3.960 3.812 3.576 3.959 . 0 0 "[ . 1 . 2]" 1
415 1 27 LEU H 1 27 LEU MD2 . . 3.730 3.630 3.413 3.735 0.005 17 0 "[ . 1 . 2]" 1
416 1 27 LEU H 1 27 LEU HG . . 3.320 2.686 2.372 2.892 . 0 0 "[ . 1 . 2]" 1
417 1 27 LEU H 1 28 HIS H . . 3.050 2.326 2.168 2.572 . 0 0 "[ . 1 . 2]" 1
418 1 27 LEU H 1 28 HIS HD2 . . 4.380 4.144 3.589 4.372 . 0 0 "[ . 1 . 2]" 1
419 1 27 LEU HA 1 27 LEU MD1 . . 4.300 3.845 3.769 3.917 . 0 0 "[ . 1 . 2]" 1
420 1 27 LEU HA 1 27 LEU MD2 . . 3.200 2.033 1.947 2.161 . 0 0 "[ . 1 . 2]" 1
421 1 27 LEU HA 1 30 SER H . . 4.930 3.369 3.080 3.540 . 0 0 "[ . 1 . 2]" 1
422 1 27 LEU HA 1 30 SER QB . . 4.140 2.698 2.291 3.114 . 0 0 "[ . 1 . 2]" 1
423 1 27 LEU HB2 1 27 LEU MD1 . . 3.390 2.314 2.161 2.457 . 0 0 "[ . 1 . 2]" 1
424 1 27 LEU HB2 1 27 LEU MD2 . . 3.370 3.185 3.177 3.195 . 0 0 "[ . 1 . 2]" 1
425 1 27 LEU HB2 1 28 HIS H . . 4.130 2.704 2.516 2.901 . 0 0 "[ . 1 . 2]" 1
426 1 27 LEU HB2 1 28 HIS HA . . 4.410 4.276 4.118 4.368 . 0 0 "[ . 1 . 2]" 1
427 1 27 LEU HB2 1 31 LEU H . . 5.500 5.135 4.680 5.418 . 0 0 "[ . 1 . 2]" 1
428 1 27 LEU HB2 1 31 LEU MD1 . . 4.020 3.394 2.766 3.624 . 0 0 "[ . 1 . 2]" 1
429 1 27 LEU HB3 1 27 LEU MD1 . . 3.220 2.347 2.230 2.497 . 0 0 "[ . 1 . 2]" 1
430 1 27 LEU HB3 1 27 LEU MD2 . . 3.480 2.341 2.269 2.399 . 0 0 "[ . 1 . 2]" 1
431 1 27 LEU HB3 1 28 HIS H . . 3.820 3.636 3.335 3.811 . 0 0 "[ . 1 . 2]" 1
432 1 27 LEU HB3 1 28 HIS HD2 . . 4.520 4.255 3.832 4.507 . 0 0 "[ . 1 . 2]" 1
433 1 27 LEU HB3 1 30 SER H . . 5.280 4.905 4.676 5.154 . 0 0 "[ . 1 . 2]" 1
434 1 27 LEU HB3 1 30 SER QB . . 4.530 3.757 3.365 4.332 . 0 0 "[ . 1 . 2]" 1
435 1 27 LEU HB3 1 83 ALA HA . . 4.600 3.209 2.881 3.641 . 0 0 "[ . 1 . 2]" 1
436 1 27 LEU HB3 1 83 ALA MB . . 4.250 3.148 2.614 3.664 . 0 0 "[ . 1 . 2]" 1
437 1 27 LEU MD1 1 83 ALA HA . . 3.880 3.031 2.521 3.469 . 0 0 "[ . 1 . 2]" 1
438 1 27 LEU MD1 1 83 ALA MB . . 3.180 2.197 1.910 2.737 . 0 0 "[ . 1 . 2]" 1
439 1 27 LEU MD1 1 84 GLU HA . . 4.020 3.513 3.070 3.951 . 0 0 "[ . 1 . 2]" 1
440 1 27 LEU MD1 1 87 GLN HE21 . . 5.160 2.655 1.875 3.735 . 0 0 "[ . 1 . 2]" 1
441 1 27 LEU MD1 1 87 GLN HE22 . . 5.160 3.389 1.896 5.025 . 0 0 "[ . 1 . 2]" 1
442 1 27 LEU MD1 1 87 GLN HG2 . . 4.750 3.432 2.016 4.537 . 0 0 "[ . 1 . 2]" 1
443 1 27 LEU MD1 1 87 GLN QG . . 4.150 2.881 1.971 4.105 . 0 0 "[ . 1 . 2]" 1
444 1 27 LEU MD1 1 87 GLN HG3 . . 4.750 3.447 2.289 4.747 . 0 0 "[ . 1 . 2]" 1
445 1 27 LEU MD2 1 28 HIS H . . 4.700 4.671 4.568 4.710 0.010 12 0 "[ . 1 . 2]" 1
446 1 27 LEU MD2 1 83 ALA HA . . 3.870 3.479 3.021 3.873 0.003 18 0 "[ . 1 . 2]" 1
447 1 27 LEU MD2 1 86 LYS HB2 . . 4.280 2.973 2.089 3.897 . 0 0 "[ . 1 . 2]" 1
448 1 27 LEU MD2 1 86 LYS QB . . 3.760 2.771 2.046 3.548 . 0 0 "[ . 1 . 2]" 1
449 1 27 LEU MD2 1 86 LYS HB3 . . 4.280 3.424 2.376 4.190 . 0 0 "[ . 1 . 2]" 1
450 1 27 LEU MD2 1 87 GLN HG2 . . 5.040 2.790 1.915 4.316 . 0 0 "[ . 1 . 2]" 1
451 1 27 LEU MD2 1 87 GLN QG . . 4.340 2.466 1.814 3.159 . 0 0 "[ . 1 . 2]" 1
452 1 27 LEU MD2 1 87 GLN HG3 . . 5.040 3.098 2.008 4.490 . 0 0 "[ . 1 . 2]" 1
453 1 27 LEU HG 1 28 HIS H . . 4.590 4.463 4.254 4.571 . 0 0 "[ . 1 . 2]" 1
454 1 27 LEU HG 1 87 GLN QG . . 5.340 4.397 3.544 5.287 . 0 0 "[ . 1 . 2]" 1
455 1 28 HIS H 1 28 HIS HB2 . . 3.700 2.587 2.509 2.721 . 0 0 "[ . 1 . 2]" 1
456 1 28 HIS H 1 28 HIS QB . . 3.080 2.533 2.465 2.646 . 0 0 "[ . 1 . 2]" 1
457 1 28 HIS H 1 28 HIS HB3 . . 3.700 3.615 3.596 3.628 . 0 0 "[ . 1 . 2]" 1
458 1 28 HIS H 1 28 HIS HD2 . . 3.370 2.433 1.999 2.740 . 0 0 "[ . 1 . 2]" 1
459 1 28 HIS H 1 29 ASN H . . 3.960 3.193 2.958 3.359 . 0 0 "[ . 1 . 2]" 1
460 1 28 HIS H 1 53 PHE QE . . 4.750 4.551 4.124 4.753 0.003 3 0 "[ . 1 . 2]" 1
461 1 28 HIS HA 1 28 HIS HD2 . . 3.930 2.511 2.402 2.761 . 0 0 "[ . 1 . 2]" 1
462 1 28 HIS HA 1 30 SER H . . 4.980 4.447 3.950 4.839 . 0 0 "[ . 1 . 2]" 1
463 1 28 HIS HA 1 31 LEU HB2 . . 3.540 2.754 2.398 3.115 . 0 0 "[ . 1 . 2]" 1
464 1 28 HIS HA 1 31 LEU MD1 . . 3.840 2.994 2.528 3.494 . 0 0 "[ . 1 . 2]" 1
465 1 28 HIS HA 1 32 ILE H . . 4.440 3.734 3.394 4.091 . 0 0 "[ . 1 . 2]" 1
466 1 28 HIS HA 1 32 ILE HG13 . . 4.560 3.482 3.173 4.093 . 0 0 "[ . 1 . 2]" 1
467 1 28 HIS HA 1 53 PHE QD . . 5.260 3.759 2.647 4.248 . 0 0 "[ . 1 . 2]" 1
468 1 28 HIS HA 1 53 PHE QE . . 4.120 2.886 2.033 3.299 . 0 0 "[ . 1 . 2]" 1
469 1 28 HIS HA 1 53 PHE HZ . . 5.030 4.061 3.746 4.388 . 0 0 "[ . 1 . 2]" 1
470 1 28 HIS QB 1 32 ILE MD . . 4.370 2.305 1.953 2.734 . 0 0 "[ . 1 . 2]" 1
471 1 28 HIS QB 1 53 PHE QD . . 4.120 2.731 2.114 3.138 . 0 0 "[ . 1 . 2]" 1
472 1 28 HIS QB 1 53 PHE QE . . 5.340 3.574 3.220 3.807 . 0 0 "[ . 1 . 2]" 1
473 1 28 HIS HB2 1 29 ASN H . . 4.310 2.209 1.951 2.450 . 0 0 "[ . 1 . 2]" 1
474 1 28 HIS HB2 1 53 PHE QD . . 4.940 4.008 3.573 4.435 . 0 0 "[ . 1 . 2]" 1
475 1 28 HIS HB3 1 29 ASN H . . 4.310 3.136 2.883 3.534 . 0 0 "[ . 1 . 2]" 1
476 1 28 HIS HB3 1 53 PHE QD . . 4.940 2.783 2.130 3.209 . 0 0 "[ . 1 . 2]" 1
477 1 28 HIS HD2 1 31 LEU MD1 . . 4.720 3.335 2.811 3.926 . 0 0 "[ . 1 . 2]" 1
478 1 28 HIS HD2 1 53 PHE QE . . 4.570 2.581 2.133 3.163 . 0 0 "[ . 1 . 2]" 1
479 1 28 HIS HD2 1 63 VAL MG2 . . 5.470 3.524 3.269 3.883 . 0 0 "[ . 1 . 2]" 1
480 1 28 HIS HE1 1 53 PHE QB . . 5.500 4.935 4.640 5.380 . 0 0 "[ . 1 . 2]" 1
481 1 28 HIS HE1 1 53 PHE QD . . 5.320 3.432 3.019 4.106 . 0 0 "[ . 1 . 2]" 1
482 1 28 HIS HE1 1 54 PRO HB2 . . 4.890 4.689 4.152 4.891 0.001 19 0 "[ . 1 . 2]" 1
483 1 28 HIS HE1 1 54 PRO HB3 . . 5.390 5.107 4.762 5.389 . 0 0 "[ . 1 . 2]" 1
484 1 28 HIS HE1 1 54 PRO HD2 . . 4.370 2.660 2.432 2.946 . 0 0 "[ . 1 . 2]" 1
485 1 28 HIS HE1 1 54 PRO QD . . 3.800 2.609 2.406 2.863 . 0 0 "[ . 1 . 2]" 1
486 1 28 HIS HE1 1 54 PRO HD3 . . 4.370 3.843 3.306 4.105 . 0 0 "[ . 1 . 2]" 1
487 1 28 HIS HE1 1 54 PRO HG2 . . 3.690 2.447 1.997 2.809 . 0 0 "[ . 1 . 2]" 1
488 1 28 HIS HE1 1 54 PRO HG3 . . 3.690 3.105 2.622 3.652 . 0 0 "[ . 1 . 2]" 1
489 1 28 HIS HE1 1 61 ASP H . . 5.500 5.192 4.708 5.503 0.003 14 0 "[ . 1 . 2]" 1
490 1 28 HIS HE1 1 61 ASP HA . . 3.980 2.743 2.185 3.191 . 0 0 "[ . 1 . 2]" 1
491 1 28 HIS HE1 1 61 ASP QB . . 5.340 4.445 3.940 5.049 . 0 0 "[ . 1 . 2]" 1
492 1 28 HIS HE1 1 62 THR H . . 4.650 3.530 3.134 4.160 . 0 0 "[ . 1 . 2]" 1
493 1 28 HIS HE1 1 63 VAL MG2 . . 4.590 3.133 2.678 3.863 . 0 0 "[ . 1 . 2]" 1
494 1 29 ASN H 1 29 ASN HB2 . . 4.090 2.803 2.209 3.606 . 0 0 "[ . 1 . 2]" 1
495 1 29 ASN H 1 29 ASN QB . . 3.510 2.504 2.158 2.757 . 0 0 "[ . 1 . 2]" 1
496 1 29 ASN H 1 29 ASN HB3 . . 4.090 3.314 2.191 3.625 . 0 0 "[ . 1 . 2]" 1
497 1 29 ASN H 1 29 ASN HD21 . . 5.290 3.766 1.915 4.729 . 0 0 "[ . 1 . 2]" 1
498 1 29 ASN H 1 29 ASN HD22 . . 5.290 4.124 2.979 5.249 . 0 0 "[ . 1 . 2]" 1
499 1 29 ASN H 1 30 SER H . . 4.450 2.919 2.713 3.117 . 0 0 "[ . 1 . 2]" 1
500 1 29 ASN HA 1 29 ASN QD . . 4.470 3.386 2.246 4.148 . 0 0 "[ . 1 . 2]" 1
501 1 29 ASN HA 1 29 ASN HD22 . . 5.150 4.362 3.483 5.109 . 0 0 "[ . 1 . 2]" 1
502 1 29 ASN HA 1 31 LEU H . . 5.250 4.977 4.334 5.191 . 0 0 "[ . 1 . 2]" 1
503 1 29 ASN HA 1 32 ILE H . . 4.300 3.953 3.693 4.218 . 0 0 "[ . 1 . 2]" 1
504 1 29 ASN HA 1 32 ILE HB . . 3.940 2.987 2.758 3.259 . 0 0 "[ . 1 . 2]" 1
505 1 29 ASN HA 1 32 ILE MD . . 3.830 2.444 1.990 2.936 . 0 0 "[ . 1 . 2]" 1
506 1 29 ASN HA 1 32 ILE HG13 . . 4.510 4.072 3.593 4.508 . 0 0 "[ . 1 . 2]" 1
507 1 29 ASN HA 1 33 GLY H . . 5.500 3.905 3.233 4.353 . 0 0 "[ . 1 . 2]" 1
508 1 29 ASN QB 1 30 SER H . . 3.810 2.680 2.173 3.407 . 0 0 "[ . 1 . 2]" 1
509 1 29 ASN HB2 1 30 SER H . . 4.380 2.839 2.203 3.881 . 0 0 "[ . 1 . 2]" 1
510 1 29 ASN HB3 1 30 SER H . . 4.380 3.589 2.716 4.180 . 0 0 "[ . 1 . 2]" 1
511 1 30 SER H 1 30 SER QB . . 3.330 2.317 2.156 2.573 . 0 0 "[ . 1 . 2]" 1
512 1 30 SER H 1 31 LEU H . . 3.730 2.836 2.571 3.049 . 0 0 "[ . 1 . 2]" 1
513 1 30 SER H 1 31 LEU HB2 . . 5.500 4.599 4.325 4.806 . 0 0 "[ . 1 . 2]" 1
514 1 30 SER H 1 32 ILE H . . 5.050 4.266 3.931 4.634 . 0 0 "[ . 1 . 2]" 1
515 1 30 SER HA 1 32 ILE H . . 5.290 4.704 4.352 5.269 . 0 0 "[ . 1 . 2]" 1
516 1 30 SER HA 1 33 GLY H . . 4.560 3.795 3.412 4.256 . 0 0 "[ . 1 . 2]" 1
517 1 30 SER QB 1 31 LEU H . . 3.800 2.347 2.082 3.158 . 0 0 "[ . 1 . 2]" 1
518 1 30 SER HB2 1 31 LEU HG . . 5.500 4.498 3.824 5.499 . 0 0 "[ . 1 . 2]" 1
519 1 30 SER HB3 1 31 LEU HG . . 5.500 4.456 3.655 5.396 . 0 0 "[ . 1 . 2]" 1
520 1 31 LEU H 1 31 LEU HB2 . . 3.140 2.224 2.160 2.268 . 0 0 "[ . 1 . 2]" 1
521 1 31 LEU H 1 31 LEU HB3 . . 3.840 3.517 3.473 3.543 . 0 0 "[ . 1 . 2]" 1
522 1 31 LEU H 1 31 LEU MD1 . . 3.970 3.333 3.241 3.477 . 0 0 "[ . 1 . 2]" 1
523 1 31 LEU H 1 31 LEU MD2 . . 4.440 4.078 3.938 4.234 . 0 0 "[ . 1 . 2]" 1
524 1 31 LEU H 1 31 LEU HG . . 4.290 2.892 2.775 3.171 . 0 0 "[ . 1 . 2]" 1
525 1 31 LEU H 1 32 ILE H . . 3.250 2.910 2.747 3.047 . 0 0 "[ . 1 . 2]" 1
526 1 31 LEU H 1 32 ILE HB . . 5.500 5.104 4.797 5.244 . 0 0 "[ . 1 . 2]" 1
527 1 31 LEU HA 1 31 LEU MD1 . . 4.430 3.792 3.778 3.814 . 0 0 "[ . 1 . 2]" 1
528 1 31 LEU HA 1 31 LEU MD2 . . 3.160 2.496 2.250 2.610 . 0 0 "[ . 1 . 2]" 1
529 1 31 LEU HA 1 31 LEU HG . . 4.220 2.507 2.470 2.599 . 0 0 "[ . 1 . 2]" 1
530 1 31 LEU HB2 1 31 LEU MD1 . . 3.000 2.121 2.018 2.219 . 0 0 "[ . 1 . 2]" 1
531 1 31 LEU HB2 1 32 ILE H . . 3.770 2.608 2.442 2.740 . 0 0 "[ . 1 . 2]" 1
532 1 31 LEU HB2 1 53 PHE QE . . 4.590 4.130 3.114 4.487 . 0 0 "[ . 1 . 2]" 1
533 1 31 LEU HB2 1 53 PHE HZ . . 4.330 3.906 3.501 4.333 0.003 18 0 "[ . 1 . 2]" 1
534 1 31 LEU HB2 1 79 LEU MD1 . . 4.790 4.261 3.842 4.572 . 0 0 "[ . 1 . 2]" 1
535 1 31 LEU HB2 1 79 LEU MD2 . . 5.500 4.786 4.398 5.164 . 0 0 "[ . 1 . 2]" 1
536 1 31 LEU HB3 1 31 LEU MD1 . . 3.650 2.620 2.534 2.689 . 0 0 "[ . 1 . 2]" 1
537 1 31 LEU HB3 1 31 LEU MD2 . . 3.550 2.085 2.018 2.192 . 0 0 "[ . 1 . 2]" 1
538 1 31 LEU HB3 1 32 ILE H . . 4.300 3.038 2.768 3.247 . 0 0 "[ . 1 . 2]" 1
539 1 31 LEU HB3 1 39 ILE MD . . 4.360 2.586 2.276 3.007 . 0 0 "[ . 1 . 2]" 1
540 1 31 LEU HB3 1 53 PHE QE . . 4.910 4.191 3.699 4.461 . 0 0 "[ . 1 . 2]" 1
541 1 31 LEU HB3 1 53 PHE HZ . . 4.490 3.590 3.038 3.898 . 0 0 "[ . 1 . 2]" 1
542 1 31 LEU MD1 1 53 PHE QE . . 4.080 3.333 2.691 3.665 . 0 0 "[ . 1 . 2]" 1
543 1 31 LEU MD1 1 53 PHE HZ . . 4.160 2.951 2.466 3.370 . 0 0 "[ . 1 . 2]" 1
544 1 31 LEU MD1 1 79 LEU HA . . 3.940 3.810 3.461 3.943 0.003 19 0 "[ . 1 . 2]" 1
545 1 31 LEU MD1 1 79 LEU HG . . 4.030 2.182 1.977 2.525 . 0 0 "[ . 1 . 2]" 1
546 1 31 LEU MD1 1 82 LEU HB2 . . 4.390 3.788 3.563 4.066 . 0 0 "[ . 1 . 2]" 1
547 1 31 LEU MD1 1 83 ALA H . . 4.180 3.002 2.779 3.236 . 0 0 "[ . 1 . 2]" 1
548 1 31 LEU MD1 1 83 ALA HA . . 4.150 2.397 1.979 3.057 . 0 0 "[ . 1 . 2]" 1
549 1 31 LEU MD1 1 83 ALA MB . . 3.370 1.884 1.698 2.052 . 0 0 "[ . 1 . 2]" 1
550 1 31 LEU MD1 1 84 GLU H . . 4.830 4.815 4.756 4.846 0.016 17 0 "[ . 1 . 2]" 1
551 1 31 LEU MD2 1 53 PHE HZ . . 4.400 4.078 3.586 4.374 . 0 0 "[ . 1 . 2]" 1
552 1 31 LEU MD2 1 79 LEU HA . . 3.040 2.529 2.304 2.749 . 0 0 "[ . 1 . 2]" 1
553 1 31 LEU MD2 1 79 LEU HG . . 3.960 2.343 1.924 2.769 . 0 0 "[ . 1 . 2]" 1
554 1 31 LEU MD2 1 82 LEU H . . 4.280 3.871 3.658 4.132 . 0 0 "[ . 1 . 2]" 1
555 1 31 LEU MD2 1 82 LEU HB2 . . 3.380 1.889 1.797 1.984 . 0 0 "[ . 1 . 2]" 1
556 1 31 LEU MD2 1 82 LEU HB3 . . 3.820 2.374 1.968 2.831 . 0 0 "[ . 1 . 2]" 1
557 1 31 LEU MD2 1 83 ALA H . . 3.810 2.395 1.919 2.702 . 0 0 "[ . 1 . 2]" 1
558 1 31 LEU MD2 1 83 ALA HA . . 3.900 3.235 2.756 3.561 . 0 0 "[ . 1 . 2]" 1
559 1 31 LEU MD2 1 83 ALA MB . . 3.490 2.970 2.571 3.344 . 0 0 "[ . 1 . 2]" 1
560 1 31 LEU MD2 1 84 GLU H . . 5.500 4.995 4.599 5.285 . 0 0 "[ . 1 . 2]" 1
561 1 31 LEU MD2 1 86 LYS QE . . 4.600 3.466 2.105 4.216 . 0 0 "[ . 1 . 2]" 1
562 1 31 LEU HG 1 79 LEU MD1 . . 5.300 4.729 4.343 5.188 . 0 0 "[ . 1 . 2]" 1
563 1 31 LEU HG 1 82 LEU HB2 . . 3.950 3.834 3.616 3.954 0.004 7 0 "[ . 1 . 2]" 1
564 1 31 LEU HG 1 83 ALA HA . . 4.810 2.718 2.274 3.094 . 0 0 "[ . 1 . 2]" 1
565 1 31 LEU HG 1 83 ALA MB . . 4.810 3.525 2.861 3.949 . 0 0 "[ . 1 . 2]" 1
566 1 31 LEU HG 1 86 LYS QE . . 4.980 3.959 2.707 4.976 . 0 0 "[ . 1 . 2]" 1
567 1 32 ILE H 1 32 ILE HB . . 3.360 2.610 2.435 2.652 . 0 0 "[ . 1 . 2]" 1
568 1 32 ILE H 1 32 ILE MD . . 4.100 3.234 3.017 3.400 . 0 0 "[ . 1 . 2]" 1
569 1 32 ILE H 1 32 ILE HG12 . . 3.880 3.437 3.312 3.756 . 0 0 "[ . 1 . 2]" 1
570 1 32 ILE H 1 32 ILE HG13 . . 3.440 1.958 1.895 2.324 . 0 0 "[ . 1 . 2]" 1
571 1 32 ILE H 1 32 ILE MG . . 3.790 3.763 3.745 3.770 . 0 0 "[ . 1 . 2]" 1
572 1 32 ILE H 1 33 GLY H . . 3.360 2.904 2.620 3.028 . 0 0 "[ . 1 . 2]" 1
573 1 32 ILE H 1 33 GLY HA2 . . 5.080 5.029 4.794 5.084 0.004 10 0 "[ . 1 . 2]" 1
574 1 32 ILE H 1 39 ILE HB . . 5.500 5.492 5.397 5.515 0.015 5 0 "[ . 1 . 2]" 1
575 1 32 ILE HA 1 32 ILE MD . . 4.480 3.892 3.828 3.917 . 0 0 "[ . 1 . 2]" 1
576 1 32 ILE HA 1 39 ILE H . . 4.050 3.420 2.818 3.651 . 0 0 "[ . 1 . 2]" 1
577 1 32 ILE HA 1 39 ILE HB . . 3.710 2.790 2.698 2.945 . 0 0 "[ . 1 . 2]" 1
578 1 32 ILE HA 1 39 ILE QG . . 4.040 1.812 1.794 1.897 . 0 0 "[ . 1 . 2]" 1
579 1 32 ILE HA 1 39 ILE MG . . 4.180 3.850 3.724 4.060 . 0 0 "[ . 1 . 2]" 1
580 1 32 ILE HA 1 40 ARG H . . 5.350 5.050 4.879 5.240 . 0 0 "[ . 1 . 2]" 1
581 1 32 ILE HB 1 32 ILE MD . . 3.620 2.263 2.115 2.388 . 0 0 "[ . 1 . 2]" 1
582 1 32 ILE HB 1 33 GLY H . . 4.200 2.318 2.108 2.752 . 0 0 "[ . 1 . 2]" 1
583 1 32 ILE MD 1 32 ILE MG . . 3.170 2.208 1.953 2.455 . 0 0 "[ . 1 . 2]" 1
584 1 32 ILE MD 1 33 GLY H . . 5.500 4.129 3.879 4.501 . 0 0 "[ . 1 . 2]" 1
585 1 32 ILE MD 1 53 PHE QB . . 4.100 2.489 1.974 3.131 . 0 0 "[ . 1 . 2]" 1
586 1 32 ILE MD 1 53 PHE QD . . 4.380 3.110 2.367 3.725 . 0 0 "[ . 1 . 2]" 1
587 1 32 ILE HG12 1 32 ILE MG . . 3.420 2.253 2.073 2.345 . 0 0 "[ . 1 . 2]" 1
588 1 32 ILE HG12 1 33 GLY H . . 5.500 4.915 4.818 5.117 . 0 0 "[ . 1 . 2]" 1
589 1 32 ILE HG13 1 33 GLY H . . 5.310 4.150 4.064 4.361 . 0 0 "[ . 1 . 2]" 1
590 1 32 ILE HG13 1 53 PHE QD . . 4.790 4.004 3.524 4.418 . 0 0 "[ . 1 . 2]" 1
591 1 32 ILE MG 1 33 GLY H . . 4.670 3.222 2.692 3.581 . 0 0 "[ . 1 . 2]" 1
592 1 32 ILE MG 1 36 GLY H . . 4.020 2.946 2.483 3.958 . 0 0 "[ . 1 . 2]" 1
593 1 32 ILE MG 1 36 GLY HA2 . . 3.920 1.922 1.767 2.437 . 0 0 "[ . 1 . 2]" 1
594 1 32 ILE MG 1 36 GLY QA . . 3.360 1.889 1.742 2.402 . 0 0 "[ . 1 . 2]" 1
595 1 32 ILE MG 1 36 GLY HA3 . . 3.920 2.798 2.485 3.639 . 0 0 "[ . 1 . 2]" 1
596 1 32 ILE MG 1 37 ARG H . . 4.280 4.129 3.827 4.297 0.017 13 0 "[ . 1 . 2]" 1
597 1 32 ILE MG 1 38 LEU H . . 5.200 4.793 4.202 5.150 . 0 0 "[ . 1 . 2]" 1
598 1 32 ILE MG 1 39 ILE H . . 4.450 4.011 3.491 4.353 . 0 0 "[ . 1 . 2]" 1
599 1 32 ILE MG 1 39 ILE HB . . 4.520 3.064 2.812 3.368 . 0 0 "[ . 1 . 2]" 1
600 1 32 ILE MG 1 39 ILE MG . . 3.840 3.840 3.771 3.865 0.025 17 0 "[ . 1 . 2]" 1
601 1 32 ILE MG 1 53 PHE QD . . 4.890 4.439 3.833 4.844 . 0 0 "[ . 1 . 2]" 1
602 1 32 ILE MG 1 53 PHE QE . . 5.500 4.918 4.395 5.263 . 0 0 "[ . 1 . 2]" 1
603 1 33 GLY H 1 38 LEU QB . . 5.120 4.124 3.784 4.341 . 0 0 "[ . 1 . 2]" 1
604 1 33 GLY H 1 38 LEU QD . . 5.500 4.203 3.497 5.208 . 0 0 "[ . 1 . 2]" 1
605 1 33 GLY HA2 1 38 LEU HB2 . . 5.360 3.798 3.341 4.101 . 0 0 "[ . 1 . 2]" 1
606 1 33 GLY HA2 1 38 LEU QB . . 4.630 3.687 3.190 3.948 . 0 0 "[ . 1 . 2]" 1
607 1 33 GLY HA2 1 38 LEU HB3 . . 5.360 5.091 4.041 5.365 0.005 17 0 "[ . 1 . 2]" 1
608 1 33 GLY HA2 1 38 LEU HG . . 5.500 4.729 4.115 5.514 0.014 10 0 "[ . 1 . 2]" 1
609 1 33 GLY HA3 1 37 ARG QG . . 5.360 4.316 3.215 5.364 0.004 11 0 "[ . 1 . 2]" 1
610 1 33 GLY HA3 1 38 LEU H . . 3.910 3.061 2.533 3.820 . 0 0 "[ . 1 . 2]" 1
611 1 33 GLY HA3 1 38 LEU HB2 . . 4.810 2.943 2.506 3.145 . 0 0 "[ . 1 . 2]" 1
612 1 33 GLY HA3 1 38 LEU QB . . 4.170 2.899 2.410 3.106 . 0 0 "[ . 1 . 2]" 1
613 1 33 GLY HA3 1 38 LEU HB3 . . 4.810 4.468 3.083 4.820 0.010 11 0 "[ . 1 . 2]" 1
614 1 33 GLY HA3 1 38 LEU QD . . 4.020 2.935 2.162 4.027 0.007 4 0 "[ . 1 . 2]" 1
615 1 33 GLY HA3 1 38 LEU HG . . 5.500 4.312 3.781 5.140 . 0 0 "[ . 1 . 2]" 1
616 1 34 THR HA 1 34 THR MG . . 3.600 3.109 2.281 3.208 . 0 0 "[ . 1 . 2]" 1
617 1 34 THR MG 1 35 LYS QB . . 4.120 2.714 2.143 4.018 . 0 0 "[ . 1 . 2]" 1
618 1 34 THR MG 1 35 LYS QE . . 4.800 3.883 2.443 4.806 0.006 1 0 "[ . 1 . 2]" 1
619 1 34 THR MG 1 37 ARG QD . . 4.860 3.966 3.135 4.797 . 0 0 "[ . 1 . 2]" 1
620 1 35 LYS HA 1 35 LYS QD . . 4.880 3.441 2.114 4.442 . 0 0 "[ . 1 . 2]" 1
621 1 35 LYS HA 1 35 LYS HG2 . . 4.190 3.268 2.430 4.165 . 0 0 "[ . 1 . 2]" 1
622 1 35 LYS HA 1 35 LYS HG3 . . 4.190 3.070 2.173 4.185 . 0 0 "[ . 1 . 2]" 1
623 1 35 LYS HB2 1 35 LYS QE . . 4.610 3.245 2.063 4.105 . 0 0 "[ . 1 . 2]" 1
624 1 35 LYS HB2 1 36 GLY H . . 4.850 4.092 2.412 4.564 . 0 0 "[ . 1 . 2]" 1
625 1 35 LYS HB3 1 35 LYS QE . . 4.610 3.383 2.053 4.510 . 0 0 "[ . 1 . 2]" 1
626 1 35 LYS HB3 1 36 GLY H . . 4.850 4.029 2.056 4.625 . 0 0 "[ . 1 . 2]" 1
627 1 35 LYS QE 1 35 LYS HG2 . . 3.870 2.675 2.083 3.394 . 0 0 "[ . 1 . 2]" 1
628 1 35 LYS QE 1 35 LYS HG3 . . 3.870 2.764 2.109 3.490 . 0 0 "[ . 1 . 2]" 1
629 1 36 GLY QA 1 38 LEU H . . 5.170 3.887 3.390 4.258 . 0 0 "[ . 1 . 2]" 1
630 1 36 GLY QA 1 39 ILE H . . 4.230 3.454 3.285 3.690 . 0 0 "[ . 1 . 2]" 1
631 1 36 GLY HA2 1 39 ILE H . . 4.930 3.560 3.374 3.810 . 0 0 "[ . 1 . 2]" 1
632 1 36 GLY HA2 1 39 ILE MG . . 4.950 4.715 4.424 4.867 . 0 0 "[ . 1 . 2]" 1
633 1 36 GLY HA3 1 39 ILE H . . 4.930 4.668 4.427 4.929 . 0 0 "[ . 1 . 2]" 1
634 1 36 GLY HA3 1 39 ILE MG . . 4.950 4.922 4.759 4.969 0.019 10 0 "[ . 1 . 2]" 1
635 1 37 ARG H 1 37 ARG HB2 . . 3.700 3.197 2.564 3.737 0.037 10 0 "[ . 1 . 2]" 1
636 1 37 ARG H 1 37 ARG QB . . 3.010 2.461 2.136 2.756 . 0 0 "[ . 1 . 2]" 1
637 1 37 ARG H 1 37 ARG HB3 . . 3.700 2.741 2.189 3.680 . 0 0 "[ . 1 . 2]" 1
638 1 37 ARG H 1 37 ARG QG . . 4.290 2.823 1.890 4.145 . 0 0 "[ . 1 . 2]" 1
639 1 37 ARG HA 1 37 ARG QD . . 5.110 4.139 3.593 4.485 . 0 0 "[ . 1 . 2]" 1
640 1 37 ARG HA 1 37 ARG QG . . 3.650 2.901 2.439 3.344 . 0 0 "[ . 1 . 2]" 1
641 1 37 ARG HA 1 39 ILE H . . 4.640 4.052 3.710 4.586 . 0 0 "[ . 1 . 2]" 1
642 1 37 ARG HA 1 40 ARG H . . 3.920 3.303 3.074 3.574 . 0 0 "[ . 1 . 2]" 1
643 1 37 ARG HA 1 40 ARG QB . . 3.640 2.352 1.990 3.199 . 0 0 "[ . 1 . 2]" 1
644 1 37 ARG HA 1 40 ARG QD . . 5.290 3.635 1.965 5.269 . 0 0 "[ . 1 . 2]" 1
645 1 37 ARG HA 1 40 ARG HG2 . . 4.840 3.778 1.994 4.842 0.002 13 0 "[ . 1 . 2]" 1
646 1 37 ARG HA 1 40 ARG QG . . 4.090 3.056 1.986 3.897 . 0 0 "[ . 1 . 2]" 1
647 1 37 ARG HA 1 40 ARG HG3 . . 4.840 3.643 3.371 4.110 . 0 0 "[ . 1 . 2]" 1
648 1 37 ARG HA 1 41 SER H . . 4.460 3.784 3.290 4.372 . 0 0 "[ . 1 . 2]" 1
649 1 37 ARG QB 1 37 ARG QD . . 3.040 2.201 2.077 2.425 . 0 0 "[ . 1 . 2]" 1
650 1 37 ARG QB 1 38 LEU H . . 3.880 2.884 2.148 3.612 . 0 0 "[ . 1 . 2]" 1
651 1 37 ARG QB 1 38 LEU HA . . 4.870 4.242 3.743 4.610 . 0 0 "[ . 1 . 2]" 1
652 1 37 ARG HB2 1 37 ARG QD . . 3.580 2.591 2.174 3.210 . 0 0 "[ . 1 . 2]" 1
653 1 37 ARG HB2 1 38 LEU H . . 4.550 3.561 2.172 4.168 . 0 0 "[ . 1 . 2]" 1
654 1 37 ARG HB3 1 37 ARG QD . . 3.580 2.572 2.132 3.186 . 0 0 "[ . 1 . 2]" 1
655 1 37 ARG HB3 1 38 LEU H . . 4.550 3.348 2.325 4.026 . 0 0 "[ . 1 . 2]" 1
656 1 37 ARG QG 1 38 LEU H . . 3.770 2.804 1.893 3.800 0.030 11 0 "[ . 1 . 2]" 1
657 1 37 ARG QG 1 41 SER H . . 5.500 4.926 3.843 5.500 0.000 1 0 "[ . 1 . 2]" 1
658 1 38 LEU H 1 38 LEU HB2 . . 4.130 2.229 2.146 2.337 . 0 0 "[ . 1 . 2]" 1
659 1 38 LEU H 1 38 LEU QB . . 3.460 2.198 2.101 2.307 . 0 0 "[ . 1 . 2]" 1
660 1 38 LEU H 1 38 LEU HB3 . . 4.130 3.400 2.804 3.560 . 0 0 "[ . 1 . 2]" 1
661 1 38 LEU H 1 38 LEU QD . . 4.110 2.870 1.884 3.501 . 0 0 "[ . 1 . 2]" 1
662 1 38 LEU H 1 38 LEU HG . . 4.610 3.491 2.550 4.625 0.015 10 0 "[ . 1 . 2]" 1
663 1 38 LEU HA 1 38 LEU QD . . 3.280 2.298 1.905 2.958 . 0 0 "[ . 1 . 2]" 1
664 1 38 LEU HA 1 38 LEU HG . . 4.040 2.907 2.246 3.703 . 0 0 "[ . 1 . 2]" 1
665 1 38 LEU HA 1 40 ARG H . . 4.900 4.860 4.734 4.905 0.005 18 0 "[ . 1 . 2]" 1
666 1 38 LEU HA 1 41 SER H . . 4.340 4.156 4.024 4.325 . 0 0 "[ . 1 . 2]" 1
667 1 38 LEU HA 1 41 SER QB . . 4.020 3.535 3.354 4.024 0.004 17 0 "[ . 1 . 2]" 1
668 1 38 LEU QB 1 39 ILE H . . 3.380 2.786 2.338 3.028 . 0 0 "[ . 1 . 2]" 1
669 1 38 LEU HB2 1 38 LEU QD . . 3.220 2.156 1.986 2.355 . 0 0 "[ . 1 . 2]" 1
670 1 38 LEU HB2 1 39 ILE H . . 3.860 3.111 2.744 3.851 . 0 0 "[ . 1 . 2]" 1
671 1 38 LEU HB3 1 38 LEU QD . . 3.220 2.134 1.945 2.416 . 0 0 "[ . 1 . 2]" 1
672 1 38 LEU HB3 1 39 ILE H . . 3.860 3.359 2.379 3.750 . 0 0 "[ . 1 . 2]" 1
673 1 38 LEU QD 1 39 ILE H . . 4.390 4.013 3.348 4.359 . 0 0 "[ . 1 . 2]" 1
674 1 39 ILE H 1 39 ILE HB . . 3.290 2.328 2.272 2.363 . 0 0 "[ . 1 . 2]" 1
675 1 39 ILE H 1 39 ILE MD . . 4.700 3.974 3.773 4.297 . 0 0 "[ . 1 . 2]" 1
676 1 39 ILE H 1 39 ILE HG12 . . 4.190 2.891 2.655 3.247 . 0 0 "[ . 1 . 2]" 1
677 1 39 ILE H 1 39 ILE QG . . 3.490 2.822 2.608 3.112 . 0 0 "[ . 1 . 2]" 1
678 1 39 ILE H 1 39 ILE HG13 . . 4.190 3.957 3.793 4.105 . 0 0 "[ . 1 . 2]" 1
679 1 39 ILE H 1 39 ILE MG . . 3.790 3.675 3.589 3.700 . 0 0 "[ . 1 . 2]" 1
680 1 39 ILE H 1 40 ARG H . . 3.230 2.351 2.228 2.590 . 0 0 "[ . 1 . 2]" 1
681 1 39 ILE H 1 40 ARG QB . . 4.310 4.113 3.952 4.313 0.003 4 0 "[ . 1 . 2]" 1
682 1 39 ILE HA 1 39 ILE MD . . 3.750 2.101 1.965 2.298 . 0 0 "[ . 1 . 2]" 1
683 1 39 ILE HA 1 42 ILE H . . 4.650 3.522 3.177 3.794 . 0 0 "[ . 1 . 2]" 1
684 1 39 ILE HA 1 42 ILE HB . . 4.010 3.103 2.812 3.527 . 0 0 "[ . 1 . 2]" 1
685 1 39 ILE HA 1 42 ILE MD . . 3.510 2.549 2.199 3.139 . 0 0 "[ . 1 . 2]" 1
686 1 39 ILE HA 1 42 ILE HG12 . . 5.440 4.911 4.474 5.249 . 0 0 "[ . 1 . 2]" 1
687 1 39 ILE HA 1 42 ILE HG13 . . 4.650 3.579 3.023 4.009 . 0 0 "[ . 1 . 2]" 1
688 1 39 ILE HB 1 40 ARG H . . 3.750 2.660 2.581 2.747 . 0 0 "[ . 1 . 2]" 1
689 1 39 ILE MD 1 39 ILE MG . . 3.340 1.972 1.838 2.034 . 0 0 "[ . 1 . 2]" 1
690 1 39 ILE MD 1 40 ARG H . . 4.840 4.703 4.657 4.750 . 0 0 "[ . 1 . 2]" 1
691 1 39 ILE MD 1 42 ILE HB . . 4.020 3.503 3.188 3.798 . 0 0 "[ . 1 . 2]" 1
692 1 39 ILE MD 1 43 MET HG2 . . 5.500 4.776 4.399 5.162 . 0 0 "[ . 1 . 2]" 1
693 1 39 ILE MD 1 51 ILE HB . . 4.340 3.781 3.320 4.147 . 0 0 "[ . 1 . 2]" 1
694 1 39 ILE MD 1 51 ILE MD . . 3.250 2.189 1.982 2.393 . 0 0 "[ . 1 . 2]" 1
695 1 39 ILE MD 1 53 PHE QD . . 5.180 4.098 3.803 4.621 . 0 0 "[ . 1 . 2]" 1
696 1 39 ILE MD 1 53 PHE QE . . 3.810 2.190 1.974 2.747 . 0 0 "[ . 1 . 2]" 1
697 1 39 ILE MD 1 53 PHE HZ . . 4.340 2.965 2.662 3.178 . 0 0 "[ . 1 . 2]" 1
698 1 39 ILE MD 1 79 LEU MD1 . . 2.930 1.895 1.751 2.041 . 0 0 "[ . 1 . 2]" 1
699 1 39 ILE QG 1 40 ARG H . . 4.390 4.215 4.174 4.282 . 0 0 "[ . 1 . 2]" 1
700 1 39 ILE QG 1 51 ILE MD . . 3.960 3.722 3.426 3.868 . 0 0 "[ . 1 . 2]" 1
701 1 39 ILE QG 1 53 PHE QE . . 4.200 2.887 2.452 3.237 . 0 0 "[ . 1 . 2]" 1
702 1 39 ILE QG 1 53 PHE HZ . . 4.760 4.117 3.838 4.368 . 0 0 "[ . 1 . 2]" 1
703 1 39 ILE HG12 1 40 ARG H . . 5.070 4.547 4.495 4.678 . 0 0 "[ . 1 . 2]" 1
704 1 39 ILE HG12 1 51 ILE MD . . 4.740 4.574 4.343 4.700 . 0 0 "[ . 1 . 2]" 1
705 1 39 ILE HG12 1 53 PHE QE . . 4.860 4.317 3.862 4.715 . 0 0 "[ . 1 . 2]" 1
706 1 39 ILE HG12 1 53 PHE HZ . . 5.500 5.184 4.887 5.501 0.001 2 0 "[ . 1 . 2]" 1
707 1 39 ILE HG13 1 40 ARG H . . 5.070 4.986 4.935 5.046 . 0 0 "[ . 1 . 2]" 1
708 1 39 ILE HG13 1 51 ILE MD . . 4.740 3.944 3.588 4.134 . 0 0 "[ . 1 . 2]" 1
709 1 39 ILE HG13 1 53 PHE QE . . 4.860 2.934 2.480 3.314 . 0 0 "[ . 1 . 2]" 1
710 1 39 ILE HG13 1 53 PHE HZ . . 5.500 4.322 3.982 4.599 . 0 0 "[ . 1 . 2]" 1
711 1 39 ILE MG 1 40 ARG H . . 3.450 3.036 2.811 3.208 . 0 0 "[ . 1 . 2]" 1
712 1 39 ILE MG 1 40 ARG HA . . 4.380 3.114 2.951 3.248 . 0 0 "[ . 1 . 2]" 1
713 1 39 ILE MG 1 43 MET ME . . 3.300 2.602 1.931 3.105 . 0 0 "[ . 1 . 2]" 1
714 1 39 ILE MG 1 51 ILE HB . . 4.090 2.790 2.488 3.008 . 0 0 "[ . 1 . 2]" 1
715 1 39 ILE MG 1 51 ILE MD . . 3.960 2.015 1.840 2.195 . 0 0 "[ . 1 . 2]" 1
716 1 39 ILE MG 1 53 PHE QD . . 5.380 3.749 3.245 4.190 . 0 0 "[ . 1 . 2]" 1
717 1 39 ILE MG 1 53 PHE QE . . 4.290 2.981 2.560 3.208 . 0 0 "[ . 1 . 2]" 1
718 1 40 ARG H 1 40 ARG QB . . 2.940 2.205 2.161 2.280 . 0 0 "[ . 1 . 2]" 1
719 1 40 ARG H 1 40 ARG QD . . 4.780 4.147 3.614 4.554 . 0 0 "[ . 1 . 2]" 1
720 1 40 ARG H 1 40 ARG HG2 . . 4.040 3.124 2.752 4.021 . 0 0 "[ . 1 . 2]" 1
721 1 40 ARG H 1 40 ARG HG3 . . 4.040 3.457 2.589 4.034 . 0 0 "[ . 1 . 2]" 1
722 1 40 ARG H 1 41 SER H . . 3.600 2.804 2.727 2.893 . 0 0 "[ . 1 . 2]" 1
723 1 40 ARG HA 1 40 ARG QD . . 4.390 3.446 2.136 4.413 0.023 14 0 "[ . 1 . 2]" 1
724 1 40 ARG HA 1 40 ARG HG2 . . 4.000 2.827 2.166 3.873 . 0 0 "[ . 1 . 2]" 1
725 1 40 ARG HA 1 40 ARG QG . . 3.410 2.615 2.128 3.304 . 0 0 "[ . 1 . 2]" 1
726 1 40 ARG HA 1 40 ARG HG3 . . 4.000 3.385 2.570 3.658 . 0 0 "[ . 1 . 2]" 1
727 1 40 ARG HA 1 43 MET H . . 4.090 3.698 3.497 3.960 . 0 0 "[ . 1 . 2]" 1
728 1 40 ARG HA 1 43 MET HB2 . . 3.850 2.871 2.612 3.030 . 0 0 "[ . 1 . 2]" 1
729 1 40 ARG HA 1 43 MET HB3 . . 4.530 4.395 4.155 4.531 0.001 14 0 "[ . 1 . 2]" 1
730 1 40 ARG HA 1 43 MET ME . . 3.330 2.034 1.868 2.245 . 0 0 "[ . 1 . 2]" 1
731 1 40 ARG HA 1 43 MET HG3 . . 4.970 3.105 2.440 3.769 . 0 0 "[ . 1 . 2]" 1
732 1 40 ARG HA 1 44 GLU H . . 4.780 4.504 4.027 4.784 0.004 6 0 "[ . 1 . 2]" 1
733 1 40 ARG QB 1 41 SER H . . 3.590 2.901 2.474 3.583 . 0 0 "[ . 1 . 2]" 1
734 1 40 ARG QB 1 44 GLU H . . 5.500 5.109 4.624 5.493 . 0 0 "[ . 1 . 2]" 1
735 1 40 ARG QG 1 41 SER H . . 4.480 3.720 2.071 4.471 . 0 0 "[ . 1 . 2]" 1
736 1 40 ARG HG2 1 41 SER H . . 5.260 4.136 2.118 5.248 . 0 0 "[ . 1 . 2]" 1
737 1 40 ARG HG3 1 41 SER H . . 5.260 4.279 2.535 5.085 . 0 0 "[ . 1 . 2]" 1
738 1 41 SER H 1 41 SER QB . . 3.230 2.275 2.147 2.470 . 0 0 "[ . 1 . 2]" 1
739 1 41 SER H 1 42 ILE H . . 3.420 2.811 2.568 3.044 . 0 0 "[ . 1 . 2]" 1
740 1 41 SER H 1 42 ILE HG13 . . 5.310 4.462 4.056 4.726 . 0 0 "[ . 1 . 2]" 1
741 1 41 SER H 1 43 MET H . . 4.270 4.159 4.001 4.262 . 0 0 "[ . 1 . 2]" 1
742 1 41 SER HA 1 43 MET H . . 5.070 4.467 4.205 4.836 . 0 0 "[ . 1 . 2]" 1
743 1 41 SER HA 1 43 MET HB2 . . 5.500 5.096 4.824 5.464 . 0 0 "[ . 1 . 2]" 1
744 1 41 SER HA 1 44 GLU H . . 3.860 3.540 3.284 3.858 . 0 0 "[ . 1 . 2]" 1
745 1 41 SER HA 1 44 GLU HB2 . . 4.040 3.620 2.990 3.923 . 0 0 "[ . 1 . 2]" 1
746 1 41 SER HA 1 44 GLU HB3 . . 4.040 3.323 2.918 3.697 . 0 0 "[ . 1 . 2]" 1
747 1 41 SER HA 1 44 GLU QG . . 5.340 4.861 4.266 5.275 . 0 0 "[ . 1 . 2]" 1
748 1 41 SER HA 1 45 GLU H . . 4.530 3.817 3.464 4.137 . 0 0 "[ . 1 . 2]" 1
749 1 41 SER HA 1 45 GLU QG . . 4.680 3.857 3.040 4.672 . 0 0 "[ . 1 . 2]" 1
750 1 41 SER QB 1 42 ILE H . . 3.440 2.447 1.981 3.358 . 0 0 "[ . 1 . 2]" 1
751 1 41 SER QB 1 42 ILE HG12 . . 5.500 4.578 4.236 5.285 . 0 0 "[ . 1 . 2]" 1
752 1 41 SER QB 1 42 ILE HG13 . . 5.410 3.340 3.029 4.245 . 0 0 "[ . 1 . 2]" 1
753 1 42 ILE H 1 42 ILE HB . . 3.140 2.572 2.460 2.692 . 0 0 "[ . 1 . 2]" 1
754 1 42 ILE H 1 42 ILE MD . . 3.510 3.410 3.150 3.509 . 0 0 "[ . 1 . 2]" 1
755 1 42 ILE H 1 42 ILE HG12 . . 3.650 3.423 3.154 3.629 . 0 0 "[ . 1 . 2]" 1
756 1 42 ILE H 1 42 ILE HG13 . . 3.100 2.046 1.908 2.249 . 0 0 "[ . 1 . 2]" 1
757 1 42 ILE H 1 42 ILE MG . . 4.320 3.766 3.751 3.779 . 0 0 "[ . 1 . 2]" 1
758 1 42 ILE H 1 43 MET H . . 3.260 2.833 2.617 3.021 . 0 0 "[ . 1 . 2]" 1
759 1 42 ILE H 1 44 GLU H . . 4.590 4.252 3.890 4.568 . 0 0 "[ . 1 . 2]" 1
760 1 42 ILE HA 1 42 ILE MD . . 4.150 3.853 3.823 3.882 . 0 0 "[ . 1 . 2]" 1
761 1 42 ILE HA 1 42 ILE HG12 . . 3.530 2.610 2.523 2.775 . 0 0 "[ . 1 . 2]" 1
762 1 42 ILE HA 1 42 ILE HG13 . . 3.720 2.870 2.700 3.009 . 0 0 "[ . 1 . 2]" 1
763 1 42 ILE HA 1 42 ILE MG . . 3.400 2.399 2.293 2.479 . 0 0 "[ . 1 . 2]" 1
764 1 42 ILE HA 1 44 GLU H . . 4.880 4.270 3.835 4.648 . 0 0 "[ . 1 . 2]" 1
765 1 42 ILE HA 1 45 GLU H . . 4.240 3.723 3.289 3.928 . 0 0 "[ . 1 . 2]" 1
766 1 42 ILE HA 1 45 GLU QB . . 3.950 2.989 2.228 3.955 0.005 17 0 "[ . 1 . 2]" 1
767 1 42 ILE HA 1 45 GLU HG2 . . 5.020 3.408 1.997 4.867 . 0 0 "[ . 1 . 2]" 1
768 1 42 ILE HA 1 45 GLU QG . . 4.400 2.893 1.912 3.619 . 0 0 "[ . 1 . 2]" 1
769 1 42 ILE HA 1 45 GLU HG3 . . 5.020 3.352 2.219 4.179 . 0 0 "[ . 1 . 2]" 1
770 1 42 ILE HA 1 46 CYS H . . 4.230 3.552 3.265 3.871 . 0 0 "[ . 1 . 2]" 1
771 1 42 ILE HA 1 78 GLN QE . . 5.010 3.871 2.852 4.903 . 0 0 "[ . 1 . 2]" 1
772 1 42 ILE HB 1 42 ILE MD . . 3.200 2.339 2.150 2.452 . 0 0 "[ . 1 . 2]" 1
773 1 42 ILE HB 1 43 MET H . . 3.450 2.549 2.397 2.656 . 0 0 "[ . 1 . 2]" 1
774 1 42 ILE HB 1 44 GLU H . . 5.500 4.990 4.724 5.258 . 0 0 "[ . 1 . 2]" 1
775 1 42 ILE HB 1 51 ILE MD . . 4.120 3.510 3.249 3.749 . 0 0 "[ . 1 . 2]" 1
776 1 42 ILE MD 1 78 GLN HB2 . . 3.940 3.601 3.159 3.944 0.004 17 0 "[ . 1 . 2]" 1
777 1 42 ILE MD 1 79 LEU H . . 4.760 4.323 3.852 4.635 . 0 0 "[ . 1 . 2]" 1
778 1 42 ILE MD 1 79 LEU HB2 . . 4.360 4.273 3.994 4.371 0.011 20 0 "[ . 1 . 2]" 1
779 1 42 ILE MD 1 82 LEU MD1 . . 3.170 1.946 1.832 2.149 . 0 0 "[ . 1 . 2]" 1
780 1 42 ILE HG12 1 42 ILE MG . . 3.470 2.271 2.067 2.378 . 0 0 "[ . 1 . 2]" 1
781 1 42 ILE HG12 1 82 LEU MD1 . . 4.610 3.536 3.061 3.793 . 0 0 "[ . 1 . 2]" 1
782 1 42 ILE HG13 1 42 ILE MG . . 3.540 3.184 3.142 3.200 . 0 0 "[ . 1 . 2]" 1
783 1 42 ILE HG13 1 43 MET H . . 4.400 4.251 4.152 4.381 . 0 0 "[ . 1 . 2]" 1
784 1 42 ILE HG13 1 82 LEU MD1 . . 4.570 3.919 3.660 4.212 . 0 0 "[ . 1 . 2]" 1
785 1 42 ILE MG 1 43 MET H . . 3.890 3.367 3.151 3.592 . 0 0 "[ . 1 . 2]" 1
786 1 42 ILE MG 1 43 MET HA . . 4.440 3.434 3.209 3.683 . 0 0 "[ . 1 . 2]" 1
787 1 42 ILE MG 1 43 MET HG2 . . 4.900 4.080 3.835 4.308 . 0 0 "[ . 1 . 2]" 1
788 1 42 ILE MG 1 43 MET HG3 . . 4.800 4.427 3.927 4.656 . 0 0 "[ . 1 . 2]" 1
789 1 42 ILE MG 1 46 CYS H . . 4.520 3.695 3.331 4.069 . 0 0 "[ . 1 . 2]" 1
790 1 42 ILE MG 1 46 CYS QB . . 4.530 2.986 2.338 3.579 . 0 0 "[ . 1 . 2]" 1
791 1 42 ILE MG 1 75 ALA HA . . 3.670 2.638 2.457 2.836 . 0 0 "[ . 1 . 2]" 1
792 1 42 ILE MG 1 75 ALA MB . . 3.110 2.712 2.392 3.023 . 0 0 "[ . 1 . 2]" 1
793 1 42 ILE MG 1 78 GLN HB2 . . 3.930 2.834 2.498 3.177 . 0 0 "[ . 1 . 2]" 1
794 1 42 ILE MG 1 78 GLN HB3 . . 3.920 2.955 2.498 3.450 . 0 0 "[ . 1 . 2]" 1
795 1 42 ILE MG 1 78 GLN HE21 . . 5.040 3.321 2.318 4.416 . 0 0 "[ . 1 . 2]" 1
796 1 42 ILE MG 1 78 GLN QE . . 4.360 2.686 1.897 3.474 . 0 0 "[ . 1 . 2]" 1
797 1 42 ILE MG 1 78 GLN HE22 . . 5.040 2.849 2.003 3.638 . 0 0 "[ . 1 . 2]" 1
798 1 42 ILE MG 1 78 GLN HG2 . . 5.350 4.322 3.845 4.782 . 0 0 "[ . 1 . 2]" 1
799 1 43 MET H 1 43 MET HB3 . . 3.710 3.586 3.566 3.599 . 0 0 "[ . 1 . 2]" 1
800 1 43 MET H 1 43 MET ME . . 4.060 3.868 3.655 4.039 . 0 0 "[ . 1 . 2]" 1
801 1 43 MET H 1 43 MET HG2 . . 3.790 3.139 2.890 3.415 . 0 0 "[ . 1 . 2]" 1
802 1 43 MET H 1 43 MET HG3 . . 3.490 2.426 2.245 2.633 . 0 0 "[ . 1 . 2]" 1
803 1 43 MET H 1 51 ILE MD . . 4.000 3.855 3.641 3.999 . 0 0 "[ . 1 . 2]" 1
804 1 43 MET HA 1 43 MET HG2 . . 4.080 2.349 2.246 2.438 . 0 0 "[ . 1 . 2]" 1
805 1 43 MET HA 1 44 GLU HA . . 5.150 4.700 4.654 4.746 . 0 0 "[ . 1 . 2]" 1
806 1 43 MET HA 1 45 GLU H . . 5.500 5.170 4.691 5.375 . 0 0 "[ . 1 . 2]" 1
807 1 43 MET HA 1 46 CYS H . . 4.500 4.108 3.677 4.390 . 0 0 "[ . 1 . 2]" 1
808 1 43 MET HA 1 46 CYS HB2 . . 5.070 3.708 2.592 5.075 0.005 11 0 "[ . 1 . 2]" 1
809 1 43 MET HA 1 46 CYS HB3 . . 5.070 4.126 2.790 5.069 . 0 0 "[ . 1 . 2]" 1
810 1 43 MET HA 1 49 VAL H . . 3.880 3.141 2.942 3.379 . 0 0 "[ . 1 . 2]" 1
811 1 43 MET HA 1 49 VAL MG1 . . 4.790 4.276 3.952 4.706 . 0 0 "[ . 1 . 2]" 1
812 1 43 MET HA 1 49 VAL MG2 . . 3.730 2.226 1.927 2.456 . 0 0 "[ . 1 . 2]" 1
813 1 43 MET HB2 1 44 GLU H . . 3.240 2.700 2.350 3.043 . 0 0 "[ . 1 . 2]" 1
814 1 43 MET HB2 1 49 VAL H . . 5.210 4.977 4.745 5.219 0.009 11 0 "[ . 1 . 2]" 1
815 1 43 MET HB2 1 49 VAL MG2 . . 4.640 4.290 3.854 4.619 . 0 0 "[ . 1 . 2]" 1
816 1 43 MET HB2 1 51 ILE MD . . 5.500 4.481 4.202 4.820 . 0 0 "[ . 1 . 2]" 1
817 1 43 MET HB3 1 44 GLU H . . 4.530 3.626 3.320 3.956 . 0 0 "[ . 1 . 2]" 1
818 1 43 MET HB3 1 49 VAL H . . 5.120 3.466 3.153 3.809 . 0 0 "[ . 1 . 2]" 1
819 1 43 MET HB3 1 49 VAL MG2 . . 4.650 3.191 2.527 3.637 . 0 0 "[ . 1 . 2]" 1
820 1 43 MET ME 1 43 MET HG2 . . 3.960 3.376 3.356 3.399 . 0 0 "[ . 1 . 2]" 1
821 1 43 MET ME 1 43 MET HG3 . . 3.660 2.448 2.267 2.620 . 0 0 "[ . 1 . 2]" 1
822 1 43 MET ME 1 44 GLU H . . 4.910 4.465 4.041 4.912 0.002 17 0 "[ . 1 . 2]" 1
823 1 43 MET ME 1 50 HIS HD2 . . 5.500 5.382 5.202 5.478 . 0 0 "[ . 1 . 2]" 1
824 1 43 MET ME 1 51 ILE H . . 4.520 3.682 3.085 3.946 . 0 0 "[ . 1 . 2]" 1
825 1 43 MET ME 1 51 ILE HB . . 4.700 4.467 3.855 4.706 0.006 11 0 "[ . 1 . 2]" 1
826 1 43 MET HG2 1 44 GLU H . . 5.130 4.875 4.730 5.047 . 0 0 "[ . 1 . 2]" 1
827 1 43 MET HG2 1 49 VAL MG1 . . 5.500 5.123 4.660 5.503 0.003 11 0 "[ . 1 . 2]" 1
828 1 43 MET HG2 1 49 VAL MG2 . . 4.270 2.521 2.101 2.985 . 0 0 "[ . 1 . 2]" 1
829 1 43 MET HG2 1 51 ILE HB . . 4.820 4.407 4.032 4.775 . 0 0 "[ . 1 . 2]" 1
830 1 43 MET HG2 1 51 ILE MD . . 4.020 2.199 2.036 2.507 . 0 0 "[ . 1 . 2]" 1
831 1 43 MET HG2 1 51 ILE QG . . 4.330 2.793 2.542 3.187 . 0 0 "[ . 1 . 2]" 1
832 1 43 MET HG3 1 44 GLU H . . 4.540 4.435 4.141 4.541 0.001 11 0 "[ . 1 . 2]" 1
833 1 43 MET HG3 1 49 VAL MG2 . . 4.790 4.003 3.600 4.392 . 0 0 "[ . 1 . 2]" 1
834 1 43 MET HG3 1 51 ILE H . . 5.270 4.450 3.952 4.843 . 0 0 "[ . 1 . 2]" 1
835 1 43 MET HG3 1 51 ILE HB . . 4.730 4.563 4.218 4.724 . 0 0 "[ . 1 . 2]" 1
836 1 43 MET HG3 1 51 ILE MD . . 3.980 2.594 2.199 3.135 . 0 0 "[ . 1 . 2]" 1
837 1 43 MET HG3 1 51 ILE QG . . 4.790 3.850 3.473 4.305 . 0 0 "[ . 1 . 2]" 1
838 1 44 GLU H 1 44 GLU HB2 . . 3.280 2.398 2.293 2.590 . 0 0 "[ . 1 . 2]" 1
839 1 44 GLU H 1 44 GLU QB . . 2.840 2.247 2.195 2.306 . 0 0 "[ . 1 . 2]" 1
840 1 44 GLU H 1 44 GLU HB3 . . 3.280 2.739 2.571 2.829 . 0 0 "[ . 1 . 2]" 1
841 1 44 GLU H 1 44 GLU QG . . 5.060 4.011 3.910 4.100 . 0 0 "[ . 1 . 2]" 1
842 1 44 GLU H 1 46 CYS H . . 4.310 3.949 3.691 4.178 . 0 0 "[ . 1 . 2]" 1
843 1 44 GLU H 1 48 GLY H . . 5.500 5.400 5.095 5.503 0.003 17 0 "[ . 1 . 2]" 1
844 1 44 GLU HA 1 44 GLU HG2 . . 4.180 3.222 2.253 3.694 . 0 0 "[ . 1 . 2]" 1
845 1 44 GLU HA 1 44 GLU QG . . 3.480 2.492 2.182 2.959 . 0 0 "[ . 1 . 2]" 1
846 1 44 GLU HA 1 44 GLU HG3 . . 4.180 2.723 2.221 3.568 . 0 0 "[ . 1 . 2]" 1
847 1 44 GLU HA 1 46 CYS H . . 4.440 4.389 4.249 4.444 0.004 11 0 "[ . 1 . 2]" 1
848 1 44 GLU HA 1 48 GLY QA . . 5.240 3.013 2.612 3.472 . 0 0 "[ . 1 . 2]" 1
849 1 44 GLU QB 1 46 CYS H . . 4.760 4.529 4.380 4.701 . 0 0 "[ . 1 . 2]" 1
850 1 44 GLU HB2 1 45 GLU H . . 3.630 3.465 3.378 3.558 . 0 0 "[ . 1 . 2]" 1
851 1 44 GLU HB3 1 45 GLU H . . 3.630 2.182 2.084 2.508 . 0 0 "[ . 1 . 2]" 1
852 1 44 GLU QG 1 45 GLU H . . 4.390 3.695 3.314 4.115 . 0 0 "[ . 1 . 2]" 1
853 1 45 GLU H 1 45 GLU QB . . 3.090 2.506 2.384 2.589 . 0 0 "[ . 1 . 2]" 1
854 1 45 GLU H 1 45 GLU HG2 . . 4.020 2.278 1.946 3.197 . 0 0 "[ . 1 . 2]" 1
855 1 45 GLU H 1 45 GLU QG . . 3.410 2.123 1.926 2.423 . 0 0 "[ . 1 . 2]" 1
856 1 45 GLU H 1 45 GLU HG3 . . 4.020 3.252 1.965 3.723 . 0 0 "[ . 1 . 2]" 1
857 1 45 GLU H 1 46 CYS H . . 3.070 2.881 2.535 3.070 . 0 0 "[ . 1 . 2]" 1
858 1 45 GLU H 1 47 GLY H . . 5.320 4.496 4.127 4.757 . 0 0 "[ . 1 . 2]" 1
859 1 45 GLU HA 1 45 GLU HG2 . . 4.060 3.147 2.287 4.166 0.106 18 0 "[ . 1 . 2]" 1
860 1 45 GLU HA 1 45 GLU QG . . 3.490 2.934 2.244 3.374 . 0 0 "[ . 1 . 2]" 1
861 1 45 GLU HA 1 45 GLU HG3 . . 4.060 3.696 3.255 3.964 . 0 0 "[ . 1 . 2]" 1
862 1 45 GLU HA 1 47 GLY H . . 5.050 4.714 4.020 5.033 . 0 0 "[ . 1 . 2]" 1
863 1 45 GLU QB 1 46 CYS H . . 3.500 2.796 2.400 3.495 . 0 0 "[ . 1 . 2]" 1
864 1 45 GLU QG 1 46 CYS H . . 4.250 3.381 2.034 4.132 . 0 0 "[ . 1 . 2]" 1
865 1 45 GLU HG2 1 46 CYS H . . 4.970 3.834 2.198 4.859 . 0 0 "[ . 1 . 2]" 1
866 1 45 GLU HG3 1 46 CYS H . . 4.970 3.895 2.092 4.920 . 0 0 "[ . 1 . 2]" 1
867 1 46 CYS H 1 46 CYS HB2 . . 3.650 2.622 2.184 3.588 . 0 0 "[ . 1 . 2]" 1
868 1 46 CYS H 1 46 CYS HB3 . . 3.650 3.061 2.295 3.592 . 0 0 "[ . 1 . 2]" 1
869 1 46 CYS H 1 47 GLY H . . 3.690 2.778 2.599 2.911 . 0 0 "[ . 1 . 2]" 1
870 1 46 CYS H 1 48 GLY H . . 4.870 4.563 4.166 4.736 . 0 0 "[ . 1 . 2]" 1
871 1 46 CYS H 1 49 VAL MG2 . . 5.230 4.847 4.598 5.228 . 0 0 "[ . 1 . 2]" 1
872 1 46 CYS H 1 75 ALA MB . . 5.500 5.189 4.768 5.487 . 0 0 "[ . 1 . 2]" 1
873 1 46 CYS HA 1 71 ASP QB . . 5.030 4.387 3.728 5.050 0.020 11 0 "[ . 1 . 2]" 1
874 1 46 CYS HA 1 74 LYS QE . . 5.500 4.184 3.433 5.496 . 0 0 "[ . 1 . 2]" 1
875 1 46 CYS QB 1 48 GLY H . . 4.800 3.358 2.886 4.189 . 0 0 "[ . 1 . 2]" 1
876 1 46 CYS QB 1 49 VAL H . . 4.650 3.798 3.375 4.597 . 0 0 "[ . 1 . 2]" 1
877 1 46 CYS QB 1 49 VAL MG1 . . 3.990 3.259 2.537 3.717 . 0 0 "[ . 1 . 2]" 1
878 1 46 CYS QB 1 71 ASP QB . . 4.450 2.836 1.981 3.647 . 0 0 "[ . 1 . 2]" 1
879 1 46 CYS QB 1 75 ALA H . . 5.050 4.053 2.960 4.696 . 0 0 "[ . 1 . 2]" 1
880 1 46 CYS QB 1 75 ALA MB . . 3.530 3.043 2.457 3.322 . 0 0 "[ . 1 . 2]" 1
881 1 46 CYS QB 1 78 GLN QE . . 4.130 3.601 2.433 4.102 . 0 0 "[ . 1 . 2]" 1
882 1 46 CYS HB2 1 47 GLY H . . 5.500 3.106 2.400 4.026 . 0 0 "[ . 1 . 2]" 1
883 1 46 CYS HB2 1 48 GLY H . . 5.450 3.982 3.281 4.896 . 0 0 "[ . 1 . 2]" 1
884 1 46 CYS HB2 1 49 VAL H . . 5.500 4.419 3.699 5.242 . 0 0 "[ . 1 . 2]" 1
885 1 46 CYS HB2 1 49 VAL MG1 . . 4.580 3.940 3.338 4.582 0.002 19 0 "[ . 1 . 2]" 1
886 1 46 CYS HB2 1 49 VAL MG2 . . 4.020 3.385 2.883 4.021 0.001 6 0 "[ . 1 . 2]" 1
887 1 46 CYS HB2 1 75 ALA MB . . 4.070 3.416 2.618 3.824 . 0 0 "[ . 1 . 2]" 1
888 1 46 CYS HB3 1 47 GLY H . . 5.500 3.099 2.179 3.917 . 0 0 "[ . 1 . 2]" 1
889 1 46 CYS HB3 1 48 GLY H . . 5.450 3.890 2.916 4.934 . 0 0 "[ . 1 . 2]" 1
890 1 46 CYS HB3 1 49 VAL H . . 5.500 4.393 3.459 5.297 . 0 0 "[ . 1 . 2]" 1
891 1 46 CYS HB3 1 49 VAL MG1 . . 4.580 3.662 2.616 4.634 0.054 11 0 "[ . 1 . 2]" 1
892 1 46 CYS HB3 1 49 VAL MG2 . . 4.020 3.426 2.642 4.017 . 0 0 "[ . 1 . 2]" 1
893 1 46 CYS HB3 1 75 ALA MB . . 4.070 3.438 2.869 3.795 . 0 0 "[ . 1 . 2]" 1
894 1 47 GLY H 1 48 GLY H . . 3.660 2.153 1.843 2.589 . 0 0 "[ . 1 . 2]" 1
895 1 47 GLY H 1 48 GLY QA . . 4.860 3.682 3.611 3.837 . 0 0 "[ . 1 . 2]" 1
896 1 47 GLY QA 1 48 GLY H . . 3.130 2.738 2.638 2.819 . 0 0 "[ . 1 . 2]" 1
897 1 48 GLY H 1 49 VAL H . . 3.270 1.941 1.801 2.178 . 0 0 "[ . 1 . 2]" 1
898 1 48 GLY H 1 49 VAL MG1 . . 4.750 3.054 2.832 3.328 . 0 0 "[ . 1 . 2]" 1
899 1 48 GLY H 1 49 VAL MG2 . . 4.290 3.383 3.174 3.702 . 0 0 "[ . 1 . 2]" 1
900 1 48 GLY H 1 71 ASP QB . . 5.340 3.859 3.301 4.712 . 0 0 "[ . 1 . 2]" 1
901 1 49 VAL H 1 49 VAL HB . . 3.750 3.653 3.598 3.719 . 0 0 "[ . 1 . 2]" 1
902 1 49 VAL H 1 49 VAL MG1 . . 3.370 2.478 2.212 2.780 . 0 0 "[ . 1 . 2]" 1
903 1 49 VAL H 1 49 VAL MG2 . . 3.150 2.097 1.879 2.303 . 0 0 "[ . 1 . 2]" 1
904 1 49 VAL H 1 50 HIS H . . 4.860 4.590 4.532 4.616 . 0 0 "[ . 1 . 2]" 1
905 1 49 VAL H 1 71 ASP QB . . 5.340 4.321 3.809 4.968 . 0 0 "[ . 1 . 2]" 1
906 1 49 VAL HA 1 49 VAL MG1 . . 3.660 2.307 2.105 2.382 . 0 0 "[ . 1 . 2]" 1
907 1 49 VAL HA 1 50 HIS H . . 3.040 2.366 2.271 2.460 . 0 0 "[ . 1 . 2]" 1
908 1 49 VAL HA 1 50 HIS HA . . 4.730 4.406 4.377 4.432 . 0 0 "[ . 1 . 2]" 1
909 1 49 VAL HA 1 50 HIS QB . . 4.770 4.459 4.407 4.499 . 0 0 "[ . 1 . 2]" 1
910 1 49 VAL HA 1 50 HIS HD2 . . 5.500 2.445 2.311 2.658 . 0 0 "[ . 1 . 2]" 1
911 1 49 VAL HA 1 66 ARG H . . 5.110 5.050 4.696 5.115 0.005 11 0 "[ . 1 . 2]" 1
912 1 49 VAL HA 1 67 GLY HA2 . . 4.170 3.875 3.684 4.125 . 0 0 "[ . 1 . 2]" 1
913 1 49 VAL HA 1 67 GLY HA3 . . 4.240 2.900 2.715 3.272 . 0 0 "[ . 1 . 2]" 1
914 1 49 VAL HB 1 50 HIS H . . 3.270 2.491 2.292 2.732 . 0 0 "[ . 1 . 2]" 1
915 1 49 VAL HB 1 50 HIS HA . . 4.820 4.573 4.378 4.670 . 0 0 "[ . 1 . 2]" 1
916 1 49 VAL HB 1 50 HIS QB . . 4.920 4.811 4.583 4.919 . 0 0 "[ . 1 . 2]" 1
917 1 49 VAL HB 1 65 ILE MG . . 3.690 2.613 2.359 2.789 . 0 0 "[ . 1 . 2]" 1
918 1 49 VAL HB 1 66 ARG H . . 4.460 3.765 3.518 3.942 . 0 0 "[ . 1 . 2]" 1
919 1 49 VAL HB 1 67 GLY HA2 . . 4.960 4.748 4.444 4.934 . 0 0 "[ . 1 . 2]" 1
920 1 49 VAL HB 1 67 GLY HA3 . . 4.900 3.177 2.852 3.407 . 0 0 "[ . 1 . 2]" 1
921 1 49 VAL HB 1 68 PRO HD2 . . 4.830 4.207 3.899 4.570 . 0 0 "[ . 1 . 2]" 1
922 1 49 VAL HB 1 72 VAL MG2 . . 3.840 3.476 3.112 3.837 . 0 0 "[ . 1 . 2]" 1
923 1 49 VAL HB 1 75 ALA MB . . 4.100 4.056 3.847 4.104 0.004 16 0 "[ . 1 . 2]" 1
924 1 49 VAL MG1 1 50 HIS H . . 3.840 3.738 3.423 3.839 . 0 0 "[ . 1 . 2]" 1
925 1 49 VAL MG1 1 67 GLY HA2 . . 4.170 3.724 3.229 4.054 . 0 0 "[ . 1 . 2]" 1
926 1 49 VAL MG1 1 67 GLY HA3 . . 3.820 2.335 1.915 2.673 . 0 0 "[ . 1 . 2]" 1
927 1 49 VAL MG1 1 68 PRO HD2 . . 3.920 2.017 1.945 2.213 . 0 0 "[ . 1 . 2]" 1
928 1 49 VAL MG1 1 68 PRO HD3 . . 4.160 3.519 3.359 3.730 . 0 0 "[ . 1 . 2]" 1
929 1 49 VAL MG1 1 68 PRO HG2 . . 4.640 3.110 2.887 3.296 . 0 0 "[ . 1 . 2]" 1
930 1 49 VAL MG1 1 71 ASP H . . 4.620 4.179 3.972 4.372 . 0 0 "[ . 1 . 2]" 1
931 1 49 VAL MG1 1 71 ASP HA . . 4.810 4.294 4.050 4.510 . 0 0 "[ . 1 . 2]" 1
932 1 49 VAL MG1 1 71 ASP HB2 . . 3.810 2.536 2.261 3.498 . 0 0 "[ . 1 . 2]" 1
933 1 49 VAL MG1 1 71 ASP QB . . 3.260 2.208 1.973 2.440 . 0 0 "[ . 1 . 2]" 1
934 1 49 VAL MG1 1 71 ASP HB3 . . 3.810 2.534 2.164 2.933 . 0 0 "[ . 1 . 2]" 1
935 1 49 VAL MG1 1 72 VAL H . . 4.140 3.169 2.753 3.660 . 0 0 "[ . 1 . 2]" 1
936 1 49 VAL MG1 1 72 VAL HA . . 3.800 2.841 2.430 3.234 . 0 0 "[ . 1 . 2]" 1
937 1 49 VAL MG1 1 72 VAL MG2 . . 3.610 2.209 1.963 2.614 . 0 0 "[ . 1 . 2]" 1
938 1 49 VAL MG1 1 75 ALA MB . . 3.580 3.137 2.849 3.519 . 0 0 "[ . 1 . 2]" 1
939 1 49 VAL MG2 1 50 HIS H . . 3.640 3.450 3.132 3.642 0.002 16 0 "[ . 1 . 2]" 1
940 1 49 VAL MG2 1 51 ILE QG . . 3.850 2.730 2.330 3.128 . 0 0 "[ . 1 . 2]" 1
941 1 49 VAL MG2 1 67 GLY HA3 . . 4.520 4.497 4.364 4.526 0.006 7 0 "[ . 1 . 2]" 1
942 1 49 VAL MG2 1 71 ASP HB2 . . 4.700 4.431 4.112 4.749 0.049 11 0 "[ . 1 . 2]" 1
943 1 49 VAL MG2 1 71 ASP QB . . 4.040 3.706 3.304 4.045 0.005 17 0 "[ . 1 . 2]" 1
944 1 49 VAL MG2 1 71 ASP HB3 . . 4.700 3.988 3.456 4.512 . 0 0 "[ . 1 . 2]" 1
945 1 49 VAL MG2 1 72 VAL HA . . 4.180 3.586 3.150 3.858 . 0 0 "[ . 1 . 2]" 1
946 1 49 VAL MG2 1 75 ALA H . . 5.030 4.443 3.991 4.736 . 0 0 "[ . 1 . 2]" 1
947 1 49 VAL MG2 1 75 ALA HA . . 4.530 4.377 4.121 4.464 . 0 0 "[ . 1 . 2]" 1
948 1 49 VAL MG2 1 75 ALA MB . . 2.980 2.251 2.023 2.370 . 0 0 "[ . 1 . 2]" 1
949 1 50 HIS H 1 50 HIS QB . . 3.200 2.584 2.506 2.643 . 0 0 "[ . 1 . 2]" 1
950 1 50 HIS H 1 50 HIS HD2 . . 4.870 2.497 2.324 2.740 . 0 0 "[ . 1 . 2]" 1
951 1 50 HIS H 1 51 ILE H . . 4.680 4.291 3.947 4.507 . 0 0 "[ . 1 . 2]" 1
952 1 50 HIS H 1 65 ILE HA . . 5.110 4.872 4.574 5.099 . 0 0 "[ . 1 . 2]" 1
953 1 50 HIS H 1 65 ILE MG . . 4.130 3.391 3.193 3.539 . 0 0 "[ . 1 . 2]" 1
954 1 50 HIS H 1 66 ARG H . . 3.740 3.048 2.835 3.281 . 0 0 "[ . 1 . 2]" 1
955 1 50 HIS H 1 66 ARG HB2 . . 5.000 3.618 3.264 3.843 . 0 0 "[ . 1 . 2]" 1
956 1 50 HIS H 1 66 ARG QB . . 4.370 3.390 3.072 3.566 . 0 0 "[ . 1 . 2]" 1
957 1 50 HIS H 1 66 ARG HB3 . . 5.000 4.097 3.745 4.226 . 0 0 "[ . 1 . 2]" 1
958 1 50 HIS H 1 67 GLY HA2 . . 4.740 4.555 4.383 4.740 . 0 0 "[ . 1 . 2]" 1
959 1 50 HIS H 1 67 GLY HA3 . . 4.360 3.744 3.568 3.981 . 0 0 "[ . 1 . 2]" 1
960 1 50 HIS HA 1 50 HIS HD2 . . 3.600 3.328 3.170 3.446 . 0 0 "[ . 1 . 2]" 1
961 1 50 HIS HA 1 51 ILE H . . 3.140 2.161 2.140 2.226 . 0 0 "[ . 1 . 2]" 1
962 1 50 HIS HA 1 51 ILE HA . . 5.150 4.401 4.385 4.456 . 0 0 "[ . 1 . 2]" 1
963 1 50 HIS HA 1 51 ILE HB . . 4.720 4.699 4.635 4.736 0.016 17 0 "[ . 1 . 2]" 1
964 1 50 HIS HA 1 51 ILE QG . . 4.820 3.573 3.299 3.800 . 0 0 "[ . 1 . 2]" 1
965 1 50 HIS HA 1 66 ARG H . . 4.920 4.722 4.480 4.873 . 0 0 "[ . 1 . 2]" 1
966 1 50 HIS QB 1 50 HIS HE1 . . 4.860 4.356 4.351 4.361 . 0 0 "[ . 1 . 2]" 1
967 1 50 HIS QB 1 51 ILE H . . 4.130 3.291 2.858 3.666 . 0 0 "[ . 1 . 2]" 1
968 1 50 HIS QB 1 66 ARG H . . 3.870 3.461 3.211 3.759 . 0 0 "[ . 1 . 2]" 1
969 1 50 HIS QB 1 66 ARG HB2 . . 4.360 2.623 2.315 2.937 . 0 0 "[ . 1 . 2]" 1
970 1 50 HIS QB 1 66 ARG QB . . 3.600 2.561 2.272 2.849 . 0 0 "[ . 1 . 2]" 1
971 1 50 HIS QB 1 66 ARG HB3 . . 4.360 3.600 3.304 3.840 . 0 0 "[ . 1 . 2]" 1
972 1 50 HIS HD2 1 51 ILE H . . 5.500 5.390 5.237 5.486 . 0 0 "[ . 1 . 2]" 1
973 1 50 HIS HD2 1 65 ILE MG . . 5.500 5.486 5.431 5.505 0.005 5 0 "[ . 1 . 2]" 1
974 1 50 HIS HD2 1 66 ARG HB2 . . 5.500 5.137 4.826 5.330 . 0 0 "[ . 1 . 2]" 1
975 1 50 HIS HD2 1 66 ARG QB . . 4.770 4.605 4.275 4.763 . 0 0 "[ . 1 . 2]" 1
976 1 50 HIS HD2 1 66 ARG HB3 . . 5.500 5.206 4.773 5.403 . 0 0 "[ . 1 . 2]" 1
977 1 50 HIS HD2 1 67 GLY HA2 . . 5.500 4.939 4.514 5.426 . 0 0 "[ . 1 . 2]" 1
978 1 51 ILE H 1 51 ILE HB . . 3.660 2.619 2.553 2.752 . 0 0 "[ . 1 . 2]" 1
979 1 51 ILE H 1 51 ILE HG12 . . 4.460 3.819 3.555 4.057 . 0 0 "[ . 1 . 2]" 1
980 1 51 ILE H 1 51 ILE QG . . 3.690 2.393 2.088 2.633 . 0 0 "[ . 1 . 2]" 1
981 1 51 ILE H 1 51 ILE HG13 . . 4.460 2.418 2.103 2.668 . 0 0 "[ . 1 . 2]" 1
982 1 51 ILE H 1 51 ILE MG . . 4.500 3.830 3.781 3.899 . 0 0 "[ . 1 . 2]" 1
983 1 51 ILE H 1 52 HIS H . . 4.770 4.504 4.366 4.593 . 0 0 "[ . 1 . 2]" 1
984 1 51 ILE HA 1 51 ILE MD . . 4.460 3.912 3.897 3.935 . 0 0 "[ . 1 . 2]" 1
985 1 51 ILE HA 1 51 ILE MG . . 3.560 2.283 2.207 2.396 . 0 0 "[ . 1 . 2]" 1
986 1 51 ILE HA 1 52 HIS H . . 3.000 2.196 2.149 2.265 . 0 0 "[ . 1 . 2]" 1
987 1 51 ILE HA 1 52 HIS HD2 . . 5.180 3.557 2.599 5.188 0.008 6 0 "[ . 1 . 2]" 1
988 1 51 ILE HA 1 65 ILE HA . . 4.480 2.239 2.000 2.380 . 0 0 "[ . 1 . 2]" 1
989 1 51 ILE HA 1 65 ILE HG12 . . 4.860 2.750 2.508 2.992 . 0 0 "[ . 1 . 2]" 1
990 1 51 ILE HA 1 65 ILE HG13 . . 5.140 3.939 3.743 4.170 . 0 0 "[ . 1 . 2]" 1
991 1 51 ILE HA 1 65 ILE MG . . 4.490 3.019 2.806 3.267 . 0 0 "[ . 1 . 2]" 1
992 1 51 ILE HA 1 66 ARG H . . 4.070 3.424 3.200 3.657 . 0 0 "[ . 1 . 2]" 1
993 1 51 ILE HB 1 51 ILE MD . . 3.310 2.235 2.115 2.333 . 0 0 "[ . 1 . 2]" 1
994 1 51 ILE HB 1 52 HIS H . . 4.530 3.969 3.780 4.172 . 0 0 "[ . 1 . 2]" 1
995 1 51 ILE HB 1 53 PHE QD . . 5.470 3.636 3.070 3.972 . 0 0 "[ . 1 . 2]" 1
996 1 51 ILE HB 1 53 PHE QE . . 5.490 3.345 3.096 3.553 . 0 0 "[ . 1 . 2]" 1
997 1 51 ILE HB 1 53 PHE HZ . . 5.500 5.492 5.426 5.504 0.004 20 0 "[ . 1 . 2]" 1
998 1 51 ILE MD 1 51 ILE MG . . 2.970 2.278 2.045 2.498 . 0 0 "[ . 1 . 2]" 1
999 1 51 ILE MD 1 53 PHE QE . . 4.650 3.009 2.561 3.418 . 0 0 "[ . 1 . 2]" 1
1000 1 51 ILE QG 1 51 ILE MG . . 2.940 2.172 2.016 2.278 . 0 0 "[ . 1 . 2]" 1
1001 1 51 ILE QG 1 52 HIS H . . 4.830 4.140 4.033 4.262 . 0 0 "[ . 1 . 2]" 1
1002 1 51 ILE QG 1 65 ILE HA . . 4.750 3.595 3.445 3.716 . 0 0 "[ . 1 . 2]" 1
1003 1 51 ILE QG 1 65 ILE MG . . 3.620 2.313 2.074 2.490 . 0 0 "[ . 1 . 2]" 1
1004 1 51 ILE QG 1 66 ARG H . . 4.990 4.248 4.085 4.448 . 0 0 "[ . 1 . 2]" 1
1005 1 51 ILE HG12 1 51 ILE MG . . 3.750 2.213 2.042 2.332 . 0 0 "[ . 1 . 2]" 1
1006 1 51 ILE HG13 1 51 ILE MG . . 3.750 3.166 3.130 3.189 . 0 0 "[ . 1 . 2]" 1
1007 1 51 ILE MG 1 52 HIS H . . 3.460 2.213 1.912 2.684 . 0 0 "[ . 1 . 2]" 1
1008 1 51 ILE MG 1 53 PHE H . . 4.550 4.249 3.964 4.438 . 0 0 "[ . 1 . 2]" 1
1009 1 51 ILE MG 1 53 PHE QD . . 4.000 2.681 2.279 3.168 . 0 0 "[ . 1 . 2]" 1
1010 1 51 ILE MG 1 53 PHE QE . . 3.970 2.167 1.845 2.410 . 0 0 "[ . 1 . 2]" 1
1011 1 51 ILE MG 1 53 PHE HZ . . 4.560 3.361 3.222 3.476 . 0 0 "[ . 1 . 2]" 1
1012 1 51 ILE MG 1 63 VAL MG1 . . 3.320 1.961 1.769 2.139 . 0 0 "[ . 1 . 2]" 1
1013 1 51 ILE MG 1 64 VAL H . . 4.600 4.173 3.760 4.404 . 0 0 "[ . 1 . 2]" 1
1014 1 51 ILE MG 1 65 ILE HA . . 4.690 3.451 3.179 3.689 . 0 0 "[ . 1 . 2]" 1
1015 1 51 ILE MG 1 65 ILE HG12 . . 4.350 2.207 2.084 2.422 . 0 0 "[ . 1 . 2]" 1
1016 1 51 ILE MG 1 65 ILE HG13 . . 4.140 3.092 2.827 3.304 . 0 0 "[ . 1 . 2]" 1
1017 1 51 ILE MG 1 79 LEU MD1 . . 3.790 2.945 2.648 3.272 . 0 0 "[ . 1 . 2]" 1
1018 1 51 ILE MG 1 79 LEU MD2 . . 3.900 3.038 2.691 3.245 . 0 0 "[ . 1 . 2]" 1
1019 1 52 HIS H 1 52 HIS HB2 . . 3.510 2.470 2.372 2.618 . 0 0 "[ . 1 . 2]" 1
1020 1 52 HIS H 1 52 HIS HB3 . . 3.790 3.668 3.558 3.745 . 0 0 "[ . 1 . 2]" 1
1021 1 52 HIS H 1 52 HIS HD2 . . 4.480 3.103 2.445 4.289 . 0 0 "[ . 1 . 2]" 1
1022 1 52 HIS H 1 53 PHE H . . 4.430 4.368 4.279 4.432 0.002 12 0 "[ . 1 . 2]" 1
1023 1 52 HIS H 1 63 VAL HA . . 5.120 4.668 4.169 5.092 . 0 0 "[ . 1 . 2]" 1
1024 1 52 HIS H 1 63 VAL MG1 . . 4.170 3.001 2.570 3.265 . 0 0 "[ . 1 . 2]" 1
1025 1 52 HIS H 1 64 VAL H . . 3.810 3.530 3.145 3.827 0.017 5 0 "[ . 1 . 2]" 1
1026 1 52 HIS H 1 64 VAL HB . . 4.150 3.983 3.754 4.149 . 0 0 "[ . 1 . 2]" 1
1027 1 52 HIS H 1 64 VAL MG1 . . 5.340 4.422 4.158 4.657 . 0 0 "[ . 1 . 2]" 1
1028 1 52 HIS H 1 65 ILE H . . 5.500 4.684 4.505 4.837 . 0 0 "[ . 1 . 2]" 1
1029 1 52 HIS H 1 65 ILE HA . . 4.030 3.099 2.851 3.288 . 0 0 "[ . 1 . 2]" 1
1030 1 52 HIS H 1 65 ILE HG13 . . 4.400 4.182 3.942 4.398 . 0 0 "[ . 1 . 2]" 1
1031 1 52 HIS H 1 66 ARG H . . 5.040 4.771 4.314 5.029 . 0 0 "[ . 1 . 2]" 1
1032 1 52 HIS HA 1 53 PHE H . . 2.960 2.149 2.139 2.181 . 0 0 "[ . 1 . 2]" 1
1033 1 52 HIS HA 1 53 PHE QB . . 5.050 4.160 4.125 4.202 . 0 0 "[ . 1 . 2]" 1
1034 1 52 HIS HB2 1 52 HIS HE1 . . 5.300 5.221 5.044 5.346 0.046 17 0 "[ . 1 . 2]" 1
1035 1 52 HIS HB2 1 53 PHE H . . 4.480 4.317 4.153 4.446 . 0 0 "[ . 1 . 2]" 1
1036 1 52 HIS HB2 1 64 VAL H . . 4.130 2.845 1.899 3.326 . 0 0 "[ . 1 . 2]" 1
1037 1 52 HIS HB2 1 64 VAL HB . . 3.700 2.230 1.998 2.527 . 0 0 "[ . 1 . 2]" 1
1038 1 52 HIS HB2 1 64 VAL MG1 . . 4.430 3.439 3.107 3.742 . 0 0 "[ . 1 . 2]" 1
1039 1 52 HIS HB2 1 64 VAL MG2 . . 4.450 3.687 3.160 4.052 . 0 0 "[ . 1 . 2]" 1
1040 1 52 HIS HB3 1 53 PHE H . . 3.590 3.389 3.122 3.577 . 0 0 "[ . 1 . 2]" 1
1041 1 52 HIS HB3 1 64 VAL H . . 4.410 3.886 2.957 4.328 . 0 0 "[ . 1 . 2]" 1
1042 1 52 HIS HB3 1 64 VAL HB . . 3.850 3.430 2.957 3.690 . 0 0 "[ . 1 . 2]" 1
1043 1 52 HIS HB3 1 64 VAL MG1 . . 4.910 4.579 4.223 4.827 . 0 0 "[ . 1 . 2]" 1
1044 1 52 HIS HB3 1 64 VAL MG2 . . 4.580 4.326 3.863 4.590 0.010 6 0 "[ . 1 . 2]" 1
1045 1 52 HIS HD2 1 64 VAL HB . . 4.550 4.146 2.825 4.559 0.009 2 0 "[ . 1 . 2]" 1
1046 1 52 HIS HD2 1 64 VAL MG1 . . 4.300 3.719 2.103 4.275 . 0 0 "[ . 1 . 2]" 1
1047 1 53 PHE H 1 53 PHE QB . . 3.100 2.408 2.295 2.516 . 0 0 "[ . 1 . 2]" 1
1048 1 53 PHE H 1 53 PHE QD . . 3.690 3.440 3.170 3.669 . 0 0 "[ . 1 . 2]" 1
1049 1 53 PHE H 1 54 PRO HD2 . . 5.140 4.728 4.445 4.843 . 0 0 "[ . 1 . 2]" 1
1050 1 53 PHE H 1 54 PRO QD . . 4.510 4.098 3.661 4.333 . 0 0 "[ . 1 . 2]" 1
1051 1 53 PHE H 1 54 PRO HD3 . . 5.140 4.503 3.896 4.885 . 0 0 "[ . 1 . 2]" 1
1052 1 53 PHE HA 1 54 PRO HD2 . . 3.750 2.026 1.913 2.193 . 0 0 "[ . 1 . 2]" 1
1053 1 53 PHE HA 1 54 PRO HD3 . . 3.750 2.332 2.251 2.533 . 0 0 "[ . 1 . 2]" 1
1054 1 53 PHE HA 1 63 VAL HA . . 4.600 3.461 3.056 3.763 . 0 0 "[ . 1 . 2]" 1
1055 1 53 PHE HA 1 63 VAL MG1 . . 4.590 3.498 3.022 3.892 . 0 0 "[ . 1 . 2]" 1
1056 1 53 PHE HA 1 63 VAL MG2 . . 4.220 3.211 2.811 3.517 . 0 0 "[ . 1 . 2]" 1
1057 1 53 PHE HA 1 64 VAL H . . 4.830 4.405 3.760 4.846 0.016 15 0 "[ . 1 . 2]" 1
1058 1 53 PHE QB 1 54 PRO HD2 . . 4.590 3.179 2.658 3.747 . 0 0 "[ . 1 . 2]" 1
1059 1 53 PHE QB 1 54 PRO QD . . 3.770 3.078 2.613 3.556 . 0 0 "[ . 1 . 2]" 1
1060 1 53 PHE QB 1 54 PRO HD3 . . 4.590 4.156 3.853 4.426 . 0 0 "[ . 1 . 2]" 1
1061 1 53 PHE QD 1 54 PRO HD2 . . 4.980 2.626 2.075 3.753 . 0 0 "[ . 1 . 2]" 1
1062 1 53 PHE QD 1 54 PRO QD . . 4.100 2.593 2.059 3.643 . 0 0 "[ . 1 . 2]" 1
1063 1 53 PHE QD 1 54 PRO HD3 . . 4.980 4.082 3.457 4.925 . 0 0 "[ . 1 . 2]" 1
1064 1 53 PHE QD 1 63 VAL MG1 . . 5.230 3.488 3.294 3.728 . 0 0 "[ . 1 . 2]" 1
1065 1 53 PHE QD 1 63 VAL MG2 . . 4.350 2.680 2.267 3.054 . 0 0 "[ . 1 . 2]" 1
1066 1 53 PHE QE 1 63 VAL MG1 . . 4.570 3.054 2.565 3.258 . 0 0 "[ . 1 . 2]" 1
1067 1 53 PHE QE 1 63 VAL MG2 . . 3.980 2.133 1.919 2.555 . 0 0 "[ . 1 . 2]" 1
1068 1 53 PHE HZ 1 63 VAL HB . . 5.500 5.102 4.621 5.457 . 0 0 "[ . 1 . 2]" 1
1069 1 53 PHE HZ 1 63 VAL MG1 . . 4.700 3.141 2.854 3.609 . 0 0 "[ . 1 . 2]" 1
1070 1 53 PHE HZ 1 63 VAL MG2 . . 5.220 3.096 2.469 3.614 . 0 0 "[ . 1 . 2]" 1
1071 1 53 PHE HZ 1 79 LEU HB2 . . 5.500 5.358 4.979 5.506 0.006 6 0 "[ . 1 . 2]" 1
1072 1 53 PHE HZ 1 79 LEU MD1 . . 4.000 2.389 1.977 2.698 . 0 0 "[ . 1 . 2]" 1
1073 1 53 PHE HZ 1 79 LEU MD2 . . 4.090 2.293 1.947 2.518 . 0 0 "[ . 1 . 2]" 1
1074 1 54 PRO HA 1 55 VAL H . . 2.750 2.270 2.178 2.350 . 0 0 "[ . 1 . 2]" 1
1075 1 54 PRO HA 1 55 VAL HB . . 4.970 4.732 4.296 4.973 0.003 5 0 "[ . 1 . 2]" 1
1076 1 54 PRO HB2 1 55 VAL H . . 3.400 2.999 2.750 3.351 . 0 0 "[ . 1 . 2]" 1
1077 1 54 PRO HB2 1 60 SER HB3 . . 4.390 2.170 1.998 2.777 . 0 0 "[ . 1 . 2]" 1
1078 1 54 PRO HB3 1 55 VAL H . . 3.910 3.668 3.524 3.880 . 0 0 "[ . 1 . 2]" 1
1079 1 54 PRO HB3 1 60 SER H . . 5.020 4.552 4.082 5.026 0.006 15 0 "[ . 1 . 2]" 1
1080 1 54 PRO HB3 1 60 SER HB2 . . 4.800 3.864 3.558 4.339 . 0 0 "[ . 1 . 2]" 1
1081 1 54 PRO HB3 1 60 SER HB3 . . 4.420 2.487 2.154 2.869 . 0 0 "[ . 1 . 2]" 1
1082 1 54 PRO HB3 1 62 THR H . . 5.470 4.636 3.660 5.478 0.008 17 0 "[ . 1 . 2]" 1
1083 1 54 PRO QD 1 62 THR H . . 5.350 3.932 3.610 4.115 . 0 0 "[ . 1 . 2]" 1
1084 1 54 PRO QD 1 63 VAL MG2 . . 3.910 2.902 2.522 3.200 . 0 0 "[ . 1 . 2]" 1
1085 1 54 PRO HD2 1 63 VAL HA . . 4.420 3.721 3.320 4.065 . 0 0 "[ . 1 . 2]" 1
1086 1 54 PRO HD2 1 63 VAL MG2 . . 4.480 3.069 2.749 3.361 . 0 0 "[ . 1 . 2]" 1
1087 1 54 PRO HD3 1 63 VAL HA . . 4.420 3.121 2.486 3.603 . 0 0 "[ . 1 . 2]" 1
1088 1 54 PRO HD3 1 63 VAL MG2 . . 4.480 3.613 2.934 4.177 . 0 0 "[ . 1 . 2]" 1
1089 1 54 PRO QG 1 60 SER H . . 4.110 3.812 3.322 4.103 . 0 0 "[ . 1 . 2]" 1
1090 1 54 PRO QG 1 60 SER HB2 . . 5.010 3.990 3.378 4.647 . 0 0 "[ . 1 . 2]" 1
1091 1 54 PRO QG 1 60 SER HB3 . . 3.690 2.539 2.018 3.235 . 0 0 "[ . 1 . 2]" 1
1092 1 54 PRO QG 1 61 ASP H . . 4.780 4.459 4.242 4.676 . 0 0 "[ . 1 . 2]" 1
1093 1 54 PRO QG 1 62 THR H . . 4.020 2.608 2.168 3.061 . 0 0 "[ . 1 . 2]" 1
1094 1 54 PRO HG2 1 60 SER HB3 . . 4.390 3.242 2.407 3.952 . 0 0 "[ . 1 . 2]" 1
1095 1 54 PRO HG3 1 60 SER HB3 . . 4.390 2.662 2.077 3.434 . 0 0 "[ . 1 . 2]" 1
1096 1 55 VAL H 1 55 VAL HB . . 3.000 2.560 2.414 2.697 . 0 0 "[ . 1 . 2]" 1
1097 1 55 VAL H 1 55 VAL QG . . 2.800 2.255 2.134 2.510 . 0 0 "[ . 1 . 2]" 1
1098 1 55 VAL H 1 56 GLU H . . 4.710 4.574 4.498 4.646 . 0 0 "[ . 1 . 2]" 1
1099 1 55 VAL H 1 58 SER QB . . 4.030 3.338 2.353 3.881 . 0 0 "[ . 1 . 2]" 1
1100 1 55 VAL HA 1 55 VAL MG1 . . 3.740 2.462 2.155 3.184 . 0 0 "[ . 1 . 2]" 1
1101 1 55 VAL HA 1 55 VAL MG2 . . 3.740 2.359 2.181 2.479 . 0 0 "[ . 1 . 2]" 1
1102 1 55 VAL HA 1 56 GLU H . . 2.740 2.210 2.147 2.377 . 0 0 "[ . 1 . 2]" 1
1103 1 55 VAL HB 1 56 GLU H . . 4.080 4.012 3.869 4.099 0.019 12 0 "[ . 1 . 2]" 1
1104 1 55 VAL HB 1 58 SER H . . 4.740 3.267 2.505 4.453 . 0 0 "[ . 1 . 2]" 1
1105 1 55 VAL HB 1 58 SER QB . . 4.100 3.340 2.239 4.100 . 0 0 "[ . 1 . 2]" 1
1106 1 55 VAL QG 1 56 GLU H . . 3.360 2.159 1.872 2.630 . 0 0 "[ . 1 . 2]" 1
1107 1 55 VAL QG 1 58 SER H . . 3.890 2.913 1.701 3.765 . 0 0 "[ . 1 . 2]" 1
1108 1 55 VAL QG 1 58 SER QB . . 4.830 3.421 1.778 4.247 . 0 0 "[ . 1 . 2]" 1
1109 1 55 VAL MG1 1 58 SER QB . . 5.500 3.806 1.780 4.850 . 0 0 "[ . 1 . 2]" 1
1110 1 55 VAL MG2 1 58 SER QB . . 5.500 4.195 3.659 4.801 . 0 0 "[ . 1 . 2]" 1
1111 1 56 GLU H 1 56 GLU HB2 . . 3.630 3.013 2.160 3.617 . 0 0 "[ . 1 . 2]" 1
1112 1 56 GLU H 1 56 GLU QB . . 2.980 2.457 2.122 2.677 . 0 0 "[ . 1 . 2]" 1
1113 1 56 GLU H 1 56 GLU HB3 . . 3.630 3.039 2.372 3.607 . 0 0 "[ . 1 . 2]" 1
1114 1 56 GLU H 1 56 GLU HG2 . . 4.210 3.059 1.966 4.007 . 0 0 "[ . 1 . 2]" 1
1115 1 56 GLU H 1 56 GLU QG . . 3.680 2.568 1.877 3.681 0.001 13 0 "[ . 1 . 2]" 1
1116 1 56 GLU H 1 56 GLU HG3 . . 4.210 3.204 1.891 4.290 0.080 13 0 "[ . 1 . 2]" 1
1117 1 56 GLU H 1 57 GLY H . . 5.030 3.116 2.645 4.651 . 0 0 "[ . 1 . 2]" 1
1118 1 56 GLU HA 1 56 GLU HG2 . . 4.000 3.501 2.155 4.130 0.130 16 0 "[ . 1 . 2]" 1
1119 1 56 GLU HA 1 56 GLU QG . . 3.450 2.835 2.134 3.339 . 0 0 "[ . 1 . 2]" 1
1120 1 56 GLU HA 1 56 GLU HG3 . . 4.000 3.215 2.319 3.890 . 0 0 "[ . 1 . 2]" 1
1121 1 56 GLU HA 1 59 GLY H . . 4.540 3.629 3.239 4.410 . 0 0 "[ . 1 . 2]" 1
1122 1 56 GLU HG2 1 57 GLY H . . 5.110 3.771 2.113 5.085 . 0 0 "[ . 1 . 2]" 1
1123 1 56 GLU HG3 1 57 GLY H . . 5.110 3.365 1.901 5.033 . 0 0 "[ . 1 . 2]" 1
1124 1 57 GLY H 1 58 SER H . . 3.720 3.049 2.859 3.456 . 0 0 "[ . 1 . 2]" 1
1125 1 57 GLY H 1 59 GLY H . . 5.500 4.408 3.728 5.055 . 0 0 "[ . 1 . 2]" 1
1126 1 58 SER H 1 58 SER QB . . 3.090 2.263 2.149 2.568 . 0 0 "[ . 1 . 2]" 1
1127 1 58 SER H 1 58 SER HG . . 4.840 3.929 2.101 4.491 . 0 0 "[ . 1 . 2]" 1
1128 1 58 SER H 1 59 GLY H . . 3.650 2.869 2.606 3.086 . 0 0 "[ . 1 . 2]" 1
1129 1 58 SER H 1 60 SER H . . 4.890 4.774 4.449 4.900 0.010 13 0 "[ . 1 . 2]" 1
1130 1 58 SER QB 1 60 SER H . . 3.850 3.017 2.459 3.310 . 0 0 "[ . 1 . 2]" 1
1131 1 59 GLY H 1 60 SER H . . 3.550 2.366 2.034 2.808 . 0 0 "[ . 1 . 2]" 1
1132 1 59 GLY QA 1 60 SER H . . 3.100 2.743 2.664 2.910 . 0 0 "[ . 1 . 2]" 1
1133 1 60 SER H 1 60 SER HB2 . . 3.140 2.935 2.383 3.145 0.005 17 0 "[ . 1 . 2]" 1
1134 1 60 SER H 1 60 SER HB3 . . 3.030 2.592 2.473 2.763 . 0 0 "[ . 1 . 2]" 1
1135 1 60 SER H 1 61 ASP H . . 4.500 4.304 4.119 4.501 0.001 19 0 "[ . 1 . 2]" 1
1136 1 60 SER HA 1 61 ASP H . . 2.850 2.140 2.136 2.153 . 0 0 "[ . 1 . 2]" 1
1137 1 60 SER HA 1 62 THR H . . 3.890 3.826 3.724 3.903 0.013 3 0 "[ . 1 . 2]" 1
1138 1 60 SER HB2 1 61 ASP H . . 4.390 4.331 4.245 4.395 0.005 15 0 "[ . 1 . 2]" 1
1139 1 60 SER HB2 1 62 THR H . . 5.060 4.556 4.390 4.746 . 0 0 "[ . 1 . 2]" 1
1140 1 60 SER HB3 1 61 ASP H . . 4.510 4.316 4.185 4.414 . 0 0 "[ . 1 . 2]" 1
1141 1 60 SER HB3 1 62 THR H . . 4.490 3.733 3.432 4.000 . 0 0 "[ . 1 . 2]" 1
1142 1 61 ASP H 1 61 ASP HB2 . . 3.940 3.018 2.511 3.650 . 0 0 "[ . 1 . 2]" 1
1143 1 61 ASP H 1 61 ASP QB . . 3.280 2.724 2.470 3.042 . 0 0 "[ . 1 . 2]" 1
1144 1 61 ASP H 1 61 ASP HB3 . . 3.940 3.459 2.980 3.730 . 0 0 "[ . 1 . 2]" 1
1145 1 61 ASP H 1 62 THR H . . 3.120 2.984 2.731 3.122 0.002 17 0 "[ . 1 . 2]" 1
1146 1 61 ASP H 1 62 THR HB . . 5.200 4.655 4.479 4.806 . 0 0 "[ . 1 . 2]" 1
1147 1 61 ASP QB 1 62 THR H . . 4.260 3.916 3.806 4.033 . 0 0 "[ . 1 . 2]" 1
1148 1 61 ASP QB 1 62 THR HA . . 5.030 4.346 4.257 4.523 . 0 0 "[ . 1 . 2]" 1
1149 1 62 THR H 1 62 THR HB . . 2.960 2.634 2.578 2.797 . 0 0 "[ . 1 . 2]" 1
1150 1 62 THR H 1 62 THR MG . . 3.840 3.842 3.822 3.894 0.054 17 0 "[ . 1 . 2]" 1
1151 1 62 THR H 1 63 VAL H . . 4.600 4.334 4.124 4.484 . 0 0 "[ . 1 . 2]" 1
1152 1 62 THR H 1 63 VAL HA . . 5.240 4.864 4.695 4.962 . 0 0 "[ . 1 . 2]" 1
1153 1 62 THR HA 1 62 THR MG . . 3.420 2.457 2.384 2.484 . 0 0 "[ . 1 . 2]" 1
1154 1 62 THR HA 1 63 VAL H . . 3.050 2.176 2.142 2.261 . 0 0 "[ . 1 . 2]" 1
1155 1 62 THR HA 1 63 VAL HB . . 4.970 4.598 4.491 4.662 . 0 0 "[ . 1 . 2]" 1
1156 1 62 THR HA 1 63 VAL MG2 . . 4.940 3.682 3.479 3.868 . 0 0 "[ . 1 . 2]" 1
1157 1 62 THR HB 1 63 VAL H . . 4.520 4.180 3.906 4.393 . 0 0 "[ . 1 . 2]" 1
1158 1 62 THR MG 1 63 VAL H . . 3.660 2.526 2.120 2.936 . 0 0 "[ . 1 . 2]" 1
1159 1 62 THR MG 1 64 VAL HA . . 4.280 3.945 3.748 4.248 . 0 0 "[ . 1 . 2]" 1
1160 1 62 THR MG 1 64 VAL MG2 . . 3.050 2.527 2.260 2.870 . 0 0 "[ . 1 . 2]" 1
1161 1 63 VAL H 1 63 VAL HB . . 3.370 2.571 2.428 2.747 . 0 0 "[ . 1 . 2]" 1
1162 1 63 VAL H 1 63 VAL MG1 . . 4.630 3.817 3.754 3.888 . 0 0 "[ . 1 . 2]" 1
1163 1 63 VAL H 1 63 VAL MG2 . . 3.610 2.663 2.421 2.934 . 0 0 "[ . 1 . 2]" 1
1164 1 63 VAL H 1 64 VAL H . . 4.570 4.283 3.999 4.597 0.027 13 0 "[ . 1 . 2]" 1
1165 1 63 VAL HA 1 63 VAL MG2 . . 3.670 2.337 2.251 2.446 . 0 0 "[ . 1 . 2]" 1
1166 1 63 VAL HA 1 64 VAL H . . 2.890 2.160 2.140 2.238 . 0 0 "[ . 1 . 2]" 1
1167 1 63 VAL HA 1 64 VAL HB . . 4.940 4.639 4.480 4.765 . 0 0 "[ . 1 . 2]" 1
1168 1 63 VAL HA 1 64 VAL MG2 . . 4.310 3.776 3.333 4.045 . 0 0 "[ . 1 . 2]" 1
1169 1 63 VAL HB 1 64 VAL H . . 4.400 4.306 3.902 4.437 0.037 18 0 "[ . 1 . 2]" 1
1170 1 63 VAL MG1 1 64 VAL H . . 3.400 2.781 2.024 3.229 . 0 0 "[ . 1 . 2]" 1
1171 1 63 VAL MG1 1 65 ILE H . . 4.840 4.119 3.737 4.402 . 0 0 "[ . 1 . 2]" 1
1172 1 63 VAL MG1 1 65 ILE MD . . 4.440 2.989 2.642 3.226 . 0 0 "[ . 1 . 2]" 1
1173 1 63 VAL MG1 1 65 ILE HG12 . . 4.030 2.947 2.710 3.092 . 0 0 "[ . 1 . 2]" 1
1174 1 63 VAL MG1 1 65 ILE HG13 . . 4.340 2.593 2.242 2.840 . 0 0 "[ . 1 . 2]" 1
1175 1 63 VAL MG1 1 79 LEU MD1 . . 4.050 3.564 3.214 3.948 . 0 0 "[ . 1 . 2]" 1
1176 1 63 VAL MG1 1 79 LEU MD2 . . 3.810 2.434 2.037 2.980 . 0 0 "[ . 1 . 2]" 1
1177 1 63 VAL MG2 1 64 VAL H . . 4.170 4.090 3.905 4.173 0.003 20 0 "[ . 1 . 2]" 1
1178 1 63 VAL MG2 1 79 LEU MD2 . . 4.710 2.720 2.223 3.105 . 0 0 "[ . 1 . 2]" 1
1179 1 64 VAL H 1 64 VAL HB . . 3.220 2.530 2.369 2.698 . 0 0 "[ . 1 . 2]" 1
1180 1 64 VAL H 1 64 VAL MG1 . . 3.960 3.797 3.708 3.873 . 0 0 "[ . 1 . 2]" 1
1181 1 64 VAL H 1 64 VAL MG2 . . 3.400 2.536 2.272 2.780 . 0 0 "[ . 1 . 2]" 1
1182 1 64 VAL H 1 65 ILE H . . 4.630 4.403 4.182 4.499 . 0 0 "[ . 1 . 2]" 1
1183 1 64 VAL HA 1 64 VAL MG1 . . 3.220 2.340 2.185 2.479 . 0 0 "[ . 1 . 2]" 1
1184 1 64 VAL HA 1 64 VAL MG2 . . 3.410 2.356 2.200 2.545 . 0 0 "[ . 1 . 2]" 1
1185 1 64 VAL HA 1 65 ILE H . . 2.860 2.144 2.140 2.154 . 0 0 "[ . 1 . 2]" 1
1186 1 64 VAL HA 1 65 ILE HB . . 5.040 4.684 4.649 4.723 . 0 0 "[ . 1 . 2]" 1
1187 1 64 VAL HA 1 65 ILE HG13 . . 4.960 3.695 3.581 3.822 . 0 0 "[ . 1 . 2]" 1
1188 1 64 VAL HB 1 65 ILE H . . 5.090 4.257 4.072 4.369 . 0 0 "[ . 1 . 2]" 1
1189 1 64 VAL MG1 1 65 ILE H . . 3.040 2.615 2.351 2.841 . 0 0 "[ . 1 . 2]" 1
1190 1 64 VAL MG1 1 65 ILE HA . . 5.200 3.816 3.612 3.991 . 0 0 "[ . 1 . 2]" 1
1191 1 64 VAL MG1 1 66 ARG HD2 . . 4.670 3.571 3.117 4.688 0.018 18 0 "[ . 1 . 2]" 1
1192 1 64 VAL MG1 1 66 ARG QD . . 3.970 3.292 3.069 3.870 . 0 0 "[ . 1 . 2]" 1
1193 1 64 VAL MG1 1 66 ARG HD3 . . 4.670 4.126 3.344 4.671 0.001 6 0 "[ . 1 . 2]" 1
1194 1 64 VAL MG1 1 66 ARG HG3 . . 3.690 3.111 2.866 3.280 . 0 0 "[ . 1 . 2]" 1
1195 1 64 VAL MG2 1 65 ILE H . . 4.270 4.071 3.869 4.185 . 0 0 "[ . 1 . 2]" 1
1196 1 65 ILE H 1 65 ILE HB . . 3.380 2.630 2.571 2.698 . 0 0 "[ . 1 . 2]" 1
1197 1 65 ILE H 1 65 ILE MD . . 3.920 3.792 3.627 3.920 0.000 19 0 "[ . 1 . 2]" 1
1198 1 65 ILE H 1 65 ILE HG12 . . 3.910 3.834 3.689 3.907 . 0 0 "[ . 1 . 2]" 1
1199 1 65 ILE H 1 65 ILE HG13 . . 3.530 2.571 2.394 2.682 . 0 0 "[ . 1 . 2]" 1
1200 1 65 ILE H 1 65 ILE MG . . 4.630 3.846 3.818 3.876 . 0 0 "[ . 1 . 2]" 1
1201 1 65 ILE HA 1 65 ILE MD . . 4.560 3.877 3.842 3.902 . 0 0 "[ . 1 . 2]" 1
1202 1 65 ILE HA 1 65 ILE MG . . 3.580 2.304 2.237 2.419 . 0 0 "[ . 1 . 2]" 1
1203 1 65 ILE HA 1 66 ARG H . . 2.790 2.215 2.161 2.291 . 0 0 "[ . 1 . 2]" 1
1204 1 65 ILE HB 1 65 ILE MD . . 3.130 2.364 2.266 2.461 . 0 0 "[ . 1 . 2]" 1
1205 1 65 ILE HB 1 66 ARG H . . 4.120 3.930 3.732 4.116 . 0 0 "[ . 1 . 2]" 1
1206 1 65 ILE HB 1 72 VAL HA . . 5.500 4.880 4.522 5.201 . 0 0 "[ . 1 . 2]" 1
1207 1 65 ILE HB 1 72 VAL MG1 . . 3.540 2.654 2.334 2.973 . 0 0 "[ . 1 . 2]" 1
1208 1 65 ILE HB 1 72 VAL MG2 . . 4.230 4.017 3.651 4.223 . 0 0 "[ . 1 . 2]" 1
1209 1 65 ILE MD 1 65 ILE MG . . 2.740 2.089 1.939 2.209 . 0 0 "[ . 1 . 2]" 1
1210 1 65 ILE MD 1 72 VAL HA . . 4.730 4.096 3.794 4.412 . 0 0 "[ . 1 . 2]" 1
1211 1 65 ILE MD 1 75 ALA MB . . 3.590 2.793 2.459 3.107 . 0 0 "[ . 1 . 2]" 1
1212 1 65 ILE MD 1 76 LYS H . . 3.970 3.774 3.317 3.976 0.006 5 0 "[ . 1 . 2]" 1
1213 1 65 ILE MD 1 76 LYS HA . . 3.450 2.901 2.586 3.136 . 0 0 "[ . 1 . 2]" 1
1214 1 65 ILE MD 1 76 LYS HB2 . . 4.130 2.975 2.591 3.242 . 0 0 "[ . 1 . 2]" 1
1215 1 65 ILE MD 1 76 LYS HB3 . . 4.660 4.349 3.978 4.641 . 0 0 "[ . 1 . 2]" 1
1216 1 65 ILE MD 1 76 LYS QG . . 4.080 3.421 2.649 4.076 . 0 0 "[ . 1 . 2]" 1
1217 1 65 ILE MD 1 79 LEU H . . 5.310 4.988 4.593 5.191 . 0 0 "[ . 1 . 2]" 1
1218 1 65 ILE MD 1 79 LEU MD1 . . 3.750 3.537 3.272 3.747 . 0 0 "[ . 1 . 2]" 1
1219 1 65 ILE MD 1 79 LEU MD2 . . 3.650 2.980 2.612 3.309 . 0 0 "[ . 1 . 2]" 1
1220 1 65 ILE HG12 1 65 ILE MG . . 3.630 2.281 2.174 2.403 . 0 0 "[ . 1 . 2]" 1
1221 1 65 ILE HG12 1 66 ARG H . . 4.390 4.355 4.271 4.405 0.015 17 0 "[ . 1 . 2]" 1
1222 1 65 ILE HG13 1 65 ILE MG . . 3.490 3.184 3.178 3.201 . 0 0 "[ . 1 . 2]" 1
1223 1 65 ILE HG13 1 66 ARG H . . 5.500 4.961 4.879 5.061 . 0 0 "[ . 1 . 2]" 1
1224 1 65 ILE MG 1 66 ARG H . . 3.210 2.036 1.867 2.320 . 0 0 "[ . 1 . 2]" 1
1225 1 65 ILE MG 1 66 ARG HA . . 4.160 3.686 3.556 3.780 . 0 0 "[ . 1 . 2]" 1
1226 1 65 ILE MG 1 67 GLY H . . 5.210 4.611 4.468 4.769 . 0 0 "[ . 1 . 2]" 1
1227 1 65 ILE MG 1 72 VAL HA . . 3.550 3.122 2.739 3.407 . 0 0 "[ . 1 . 2]" 1
1228 1 65 ILE MG 1 75 ALA MB . . 3.310 2.883 2.697 3.044 . 0 0 "[ . 1 . 2]" 1
1229 1 65 ILE MG 1 76 LYS H . . 5.500 4.848 4.421 5.054 . 0 0 "[ . 1 . 2]" 1
1230 1 66 ARG H 1 66 ARG HB2 . . 3.840 2.480 2.404 2.571 . 0 0 "[ . 1 . 2]" 1
1231 1 66 ARG H 1 66 ARG QB . . 3.290 2.439 2.369 2.522 . 0 0 "[ . 1 . 2]" 1
1232 1 66 ARG H 1 66 ARG HB3 . . 3.840 3.607 3.566 3.658 . 0 0 "[ . 1 . 2]" 1
1233 1 66 ARG H 1 66 ARG HG2 . . 4.880 4.634 4.541 4.695 . 0 0 "[ . 1 . 2]" 1
1234 1 66 ARG H 1 66 ARG HG3 . . 4.000 3.621 3.535 3.691 . 0 0 "[ . 1 . 2]" 1
1235 1 66 ARG H 1 67 GLY H . . 4.530 4.456 4.411 4.504 . 0 0 "[ . 1 . 2]" 1
1236 1 66 ARG HA 1 66 ARG HG2 . . 3.930 2.741 2.585 2.802 . 0 0 "[ . 1 . 2]" 1
1237 1 66 ARG HA 1 66 ARG HG3 . . 4.220 2.445 2.380 2.567 . 0 0 "[ . 1 . 2]" 1
1238 1 66 ARG HA 1 67 GLY H . . 2.810 2.261 2.212 2.340 . 0 0 "[ . 1 . 2]" 1
1239 1 66 ARG HA 1 67 GLY HA2 . . 5.180 4.541 4.499 4.603 . 0 0 "[ . 1 . 2]" 1
1240 1 66 ARG HA 1 67 GLY HA3 . . 5.170 4.367 4.358 4.377 . 0 0 "[ . 1 . 2]" 1
1241 1 66 ARG HA 1 72 VAL MG1 . . 4.650 4.495 4.008 4.651 0.001 5 0 "[ . 1 . 2]" 1
1242 1 66 ARG HA 1 72 VAL MG2 . . 4.000 3.780 3.553 3.951 . 0 0 "[ . 1 . 2]" 1
1243 1 66 ARG QB 1 66 ARG QD . . 3.030 2.137 2.013 2.586 . 0 0 "[ . 1 . 2]" 1
1244 1 66 ARG QB 1 67 GLY H . . 3.560 2.859 2.652 3.014 . 0 0 "[ . 1 . 2]" 1
1245 1 66 ARG QB 1 67 GLY HA2 . . 5.280 3.864 3.788 3.929 . 0 0 "[ . 1 . 2]" 1
1246 1 66 ARG HB2 1 67 GLY H . . 4.240 4.144 4.013 4.243 0.003 20 0 "[ . 1 . 2]" 1
1247 1 66 ARG HB3 1 67 GLY H . . 4.240 2.914 2.691 3.084 . 0 0 "[ . 1 . 2]" 1
1248 1 66 ARG HG2 1 67 GLY H . . 3.800 3.673 3.407 3.786 . 0 0 "[ . 1 . 2]" 1
1249 1 66 ARG HG3 1 67 GLY H . . 4.340 4.312 4.224 4.359 0.019 15 0 "[ . 1 . 2]" 1
1250 1 67 GLY H 1 68 PRO HD2 . . 5.220 4.810 4.789 4.826 . 0 0 "[ . 1 . 2]" 1
1251 1 67 GLY H 1 68 PRO HD3 . . 5.060 4.957 4.906 4.992 . 0 0 "[ . 1 . 2]" 1
1252 1 67 GLY H 1 72 VAL MG2 . . 3.540 3.408 3.202 3.548 0.008 19 0 "[ . 1 . 2]" 1
1253 1 67 GLY HA2 1 68 PRO HD3 . . 3.610 2.636 2.570 2.691 . 0 0 "[ . 1 . 2]" 1
1254 1 67 GLY HA2 1 72 VAL MG2 . . 4.290 4.026 3.886 4.176 . 0 0 "[ . 1 . 2]" 1
1255 1 67 GLY HA3 1 68 PRO HD3 . . 3.790 3.007 2.945 3.082 . 0 0 "[ . 1 . 2]" 1
1256 1 67 GLY HA3 1 72 VAL MG2 . . 4.260 2.972 2.801 3.174 . 0 0 "[ . 1 . 2]" 1
1257 1 68 PRO HA 1 69 SER H . . 2.890 2.159 2.151 2.168 . 0 0 "[ . 1 . 2]" 1
1258 1 68 PRO HA 1 71 ASP H . . 4.720 4.576 4.482 4.660 . 0 0 "[ . 1 . 2]" 1
1259 1 68 PRO HA 1 72 VAL H . . 5.230 4.969 4.914 5.073 . 0 0 "[ . 1 . 2]" 1
1260 1 68 PRO HB2 1 70 SER QB . . 4.550 2.879 2.456 3.188 . 0 0 "[ . 1 . 2]" 1
1261 1 68 PRO HB2 1 71 ASP H . . 3.780 2.878 2.708 3.071 . 0 0 "[ . 1 . 2]" 1
1262 1 68 PRO HB2 1 71 ASP QB . . 4.400 3.750 3.454 3.987 . 0 0 "[ . 1 . 2]" 1
1263 1 68 PRO HB3 1 69 SER H . . 4.410 4.154 4.041 4.213 . 0 0 "[ . 1 . 2]" 1
1264 1 68 PRO HB3 1 71 ASP H . . 4.730 4.530 4.327 4.692 . 0 0 "[ . 1 . 2]" 1
1265 1 68 PRO HD2 1 71 ASP H . . 4.990 4.670 4.307 4.917 . 0 0 "[ . 1 . 2]" 1
1266 1 68 PRO HD2 1 71 ASP QB . . 4.080 3.087 2.856 3.295 . 0 0 "[ . 1 . 2]" 1
1267 1 68 PRO HD2 1 72 VAL H . . 5.170 4.478 4.257 4.848 . 0 0 "[ . 1 . 2]" 1
1268 1 68 PRO HG2 1 70 SER QB . . 4.620 4.073 3.677 4.418 . 0 0 "[ . 1 . 2]" 1
1269 1 68 PRO HG2 1 71 ASP H . . 4.190 2.854 2.454 3.147 . 0 0 "[ . 1 . 2]" 1
1270 1 68 PRO HG2 1 71 ASP QB . . 3.470 2.025 1.932 2.196 . 0 0 "[ . 1 . 2]" 1
1271 1 68 PRO HG2 1 72 VAL H . . 4.100 3.772 3.572 4.023 . 0 0 "[ . 1 . 2]" 1
1272 1 69 SER H 1 69 SER QB . . 2.900 2.512 2.204 2.719 . 0 0 "[ . 1 . 2]" 1
1273 1 69 SER H 1 71 ASP H . . 5.090 4.475 4.242 4.698 . 0 0 "[ . 1 . 2]" 1
1274 1 69 SER H 1 72 VAL H . . 5.410 4.486 4.347 4.563 . 0 0 "[ . 1 . 2]" 1
1275 1 69 SER H 1 72 VAL HB . . 4.680 4.487 4.386 4.604 . 0 0 "[ . 1 . 2]" 1
1276 1 69 SER H 1 72 VAL MG2 . . 4.200 3.176 3.026 3.371 . 0 0 "[ . 1 . 2]" 1
1277 1 69 SER QB 1 72 VAL HB . . 3.760 3.735 3.648 3.799 0.039 19 0 "[ . 1 . 2]" 1
1278 1 69 SER QB 1 72 VAL MG1 . . 4.750 4.491 4.369 4.597 . 0 0 "[ . 1 . 2]" 1
1279 1 69 SER QB 1 72 VAL MG2 . . 3.860 3.723 3.513 3.863 0.003 17 0 "[ . 1 . 2]" 1
1280 1 70 SER HA 1 73 GLU H . . 4.440 4.279 4.059 4.419 . 0 0 "[ . 1 . 2]" 1
1281 1 70 SER HA 1 73 GLU QB . . 4.130 4.081 3.942 4.136 0.006 18 0 "[ . 1 . 2]" 1
1282 1 70 SER HA 1 73 GLU QG . . 4.660 3.181 2.378 3.772 . 0 0 "[ . 1 . 2]" 1
1283 1 70 SER HA 1 74 LYS H . . 5.500 5.277 4.868 5.505 0.005 4 0 "[ . 1 . 2]" 1
1284 1 70 SER HB2 1 71 ASP H . . 3.790 3.154 2.464 3.784 . 0 0 "[ . 1 . 2]" 1
1285 1 70 SER HB3 1 71 ASP H . . 3.790 3.004 2.375 3.767 . 0 0 "[ . 1 . 2]" 1
1286 1 71 ASP H 1 71 ASP HB2 . . 3.660 2.544 2.331 2.805 . 0 0 "[ . 1 . 2]" 1
1287 1 71 ASP H 1 71 ASP QB . . 3.030 2.433 2.278 2.556 . 0 0 "[ . 1 . 2]" 1
1288 1 71 ASP H 1 71 ASP HB3 . . 3.660 3.451 2.425 3.674 0.014 16 0 "[ . 1 . 2]" 1
1289 1 71 ASP H 1 72 VAL H . . 3.050 2.355 2.193 2.480 . 0 0 "[ . 1 . 2]" 1
1290 1 71 ASP H 1 72 VAL HB . . 4.720 4.609 4.533 4.710 . 0 0 "[ . 1 . 2]" 1
1291 1 71 ASP H 1 72 VAL MG2 . . 4.100 3.675 3.470 3.819 . 0 0 "[ . 1 . 2]" 1
1292 1 71 ASP H 1 73 GLU H . . 4.380 4.125 3.885 4.338 . 0 0 "[ . 1 . 2]" 1
1293 1 71 ASP HA 1 73 GLU H . . 5.000 4.316 4.011 4.791 . 0 0 "[ . 1 . 2]" 1
1294 1 71 ASP HA 1 74 LYS H . . 3.610 3.399 3.146 3.611 0.001 5 0 "[ . 1 . 2]" 1
1295 1 71 ASP HA 1 74 LYS QB . . 3.630 3.035 2.734 3.430 . 0 0 "[ . 1 . 2]" 1
1296 1 71 ASP HA 1 74 LYS QD . . 4.680 3.556 2.451 4.682 0.002 19 0 "[ . 1 . 2]" 1
1297 1 71 ASP QB 1 72 VAL H . . 3.450 2.619 2.437 2.985 . 0 0 "[ . 1 . 2]" 1
1298 1 71 ASP QB 1 72 VAL MG2 . . 4.480 3.250 3.118 3.440 . 0 0 "[ . 1 . 2]" 1
1299 1 71 ASP QB 1 75 ALA H . . 5.340 4.502 4.226 5.057 . 0 0 "[ . 1 . 2]" 1
1300 1 71 ASP HB2 1 72 VAL H . . 4.110 2.878 2.484 3.899 . 0 0 "[ . 1 . 2]" 1
1301 1 71 ASP HB3 1 72 VAL H . . 4.110 3.568 2.465 4.104 . 0 0 "[ . 1 . 2]" 1
1302 1 72 VAL H 1 72 VAL HB . . 3.060 2.651 2.516 2.722 . 0 0 "[ . 1 . 2]" 1
1303 1 72 VAL H 1 72 VAL MG1 . . 3.920 3.764 3.754 3.771 . 0 0 "[ . 1 . 2]" 1
1304 1 72 VAL H 1 72 VAL MG2 . . 3.050 2.037 1.878 2.194 . 0 0 "[ . 1 . 2]" 1
1305 1 72 VAL H 1 73 GLU H . . 3.380 2.843 2.615 2.979 . 0 0 "[ . 1 . 2]" 1
1306 1 72 VAL H 1 74 LYS H . . 4.380 4.226 4.008 4.390 0.010 5 0 "[ . 1 . 2]" 1
1307 1 72 VAL H 1 75 ALA MB . . 5.500 4.452 4.174 4.691 . 0 0 "[ . 1 . 2]" 1
1308 1 72 VAL HA 1 72 VAL MG1 . . 3.320 2.368 2.255 2.436 . 0 0 "[ . 1 . 2]" 1
1309 1 72 VAL HA 1 72 VAL MG2 . . 3.180 2.399 2.335 2.462 . 0 0 "[ . 1 . 2]" 1
1310 1 72 VAL HA 1 74 LYS H . . 4.770 4.229 3.949 4.447 . 0 0 "[ . 1 . 2]" 1
1311 1 72 VAL HA 1 75 ALA H . . 4.030 3.302 3.124 3.534 . 0 0 "[ . 1 . 2]" 1
1312 1 72 VAL HA 1 75 ALA MB . . 3.590 2.420 2.116 2.640 . 0 0 "[ . 1 . 2]" 1
1313 1 72 VAL HA 1 76 LYS H . . 4.460 3.959 3.776 4.131 . 0 0 "[ . 1 . 2]" 1
1314 1 72 VAL HA 1 76 LYS HB2 . . 5.500 4.922 4.417 5.253 . 0 0 "[ . 1 . 2]" 1
1315 1 72 VAL HB 1 73 GLU H . . 3.020 2.518 2.217 2.814 . 0 0 "[ . 1 . 2]" 1
1316 1 72 VAL MG1 1 73 GLU H . . 3.760 3.469 3.214 3.695 . 0 0 "[ . 1 . 2]" 1
1317 1 72 VAL MG1 1 73 GLU HA . . 4.300 3.559 3.388 3.796 . 0 0 "[ . 1 . 2]" 1
1318 1 72 VAL MG1 1 75 ALA H . . 5.470 4.492 4.252 4.808 . 0 0 "[ . 1 . 2]" 1
1319 1 72 VAL MG1 1 75 ALA MB . . 4.310 3.469 3.167 3.703 . 0 0 "[ . 1 . 2]" 1
1320 1 72 VAL MG1 1 76 LYS H . . 4.060 3.769 3.463 4.055 . 0 0 "[ . 1 . 2]" 1
1321 1 72 VAL MG1 1 76 LYS HB2 . . 3.940 3.186 2.910 3.501 . 0 0 "[ . 1 . 2]" 1
1322 1 72 VAL MG2 1 73 GLU H . . 3.970 3.756 3.626 3.884 . 0 0 "[ . 1 . 2]" 1
1323 1 72 VAL MG2 1 74 LYS H . . 5.500 5.269 5.076 5.411 . 0 0 "[ . 1 . 2]" 1
1324 1 73 GLU H 1 73 GLU QB . . 3.190 2.308 2.174 2.647 . 0 0 "[ . 1 . 2]" 1
1325 1 73 GLU H 1 73 GLU QG . . 3.470 2.526 2.009 2.803 . 0 0 "[ . 1 . 2]" 1
1326 1 73 GLU H 1 74 LYS H . . 3.150 2.740 2.563 2.949 . 0 0 "[ . 1 . 2]" 1
1327 1 73 GLU H 1 74 LYS QG . . 4.670 4.284 3.825 4.656 . 0 0 "[ . 1 . 2]" 1
1328 1 73 GLU H 1 75 ALA H . . 4.550 4.176 3.908 4.490 . 0 0 "[ . 1 . 2]" 1
1329 1 73 GLU H 1 75 ALA MB . . 4.960 4.798 4.603 4.948 . 0 0 "[ . 1 . 2]" 1
1330 1 73 GLU H 1 76 LYS H . . 4.880 4.793 4.655 4.856 . 0 0 "[ . 1 . 2]" 1
1331 1 73 GLU HA 1 76 LYS H . . 3.870 3.724 3.581 3.870 0.000 16 0 "[ . 1 . 2]" 1
1332 1 73 GLU HA 1 76 LYS HB2 . . 4.120 3.903 3.616 4.120 . 0 0 "[ . 1 . 2]" 1
1333 1 73 GLU HA 1 76 LYS HB3 . . 3.140 3.082 2.851 3.151 0.011 20 0 "[ . 1 . 2]" 1
1334 1 73 GLU HA 1 76 LYS QD . . 4.390 3.773 3.490 4.127 . 0 0 "[ . 1 . 2]" 1
1335 1 73 GLU HA 1 76 LYS QG . . 5.180 4.921 4.502 5.070 . 0 0 "[ . 1 . 2]" 1
1336 1 73 GLU QB 1 74 LYS H . . 3.640 3.420 3.279 3.547 . 0 0 "[ . 1 . 2]" 1
1337 1 73 GLU QG 1 74 LYS H . . 4.370 2.035 1.822 2.281 . 0 0 "[ . 1 . 2]" 1
1338 1 73 GLU QG 1 74 LYS HA . . 5.140 3.241 2.919 3.739 . 0 0 "[ . 1 . 2]" 1
1339 1 73 GLU QG 1 74 LYS QG . . 5.340 2.053 1.954 2.214 . 0 0 "[ . 1 . 2]" 1
1340 1 74 LYS H 1 74 LYS QB . . 2.650 2.455 2.372 2.583 . 0 0 "[ . 1 . 2]" 1
1341 1 74 LYS H 1 74 LYS QD . . 4.130 3.899 3.389 4.146 0.016 5 0 "[ . 1 . 2]" 1
1342 1 74 LYS H 1 74 LYS QE . . 4.900 4.384 3.164 4.890 . 0 0 "[ . 1 . 2]" 1
1343 1 74 LYS H 1 74 LYS HG2 . . 4.140 3.221 2.107 3.742 . 0 0 "[ . 1 . 2]" 1
1344 1 74 LYS H 1 74 LYS QG . . 3.500 2.250 2.017 2.510 . 0 0 "[ . 1 . 2]" 1
1345 1 74 LYS H 1 74 LYS HG3 . . 4.140 2.527 2.040 3.558 . 0 0 "[ . 1 . 2]" 1
1346 1 74 LYS H 1 75 ALA H . . 3.090 2.493 2.368 2.701 . 0 0 "[ . 1 . 2]" 1
1347 1 74 LYS H 1 76 LYS H . . 4.490 3.972 3.836 4.097 . 0 0 "[ . 1 . 2]" 1
1348 1 74 LYS HA 1 74 LYS QD . . 4.420 3.742 1.996 4.233 . 0 0 "[ . 1 . 2]" 1
1349 1 74 LYS HA 1 74 LYS HG2 . . 4.110 2.650 2.443 3.126 . 0 0 "[ . 1 . 2]" 1
1350 1 74 LYS HA 1 74 LYS QG . . 3.610 2.532 2.365 2.992 . 0 0 "[ . 1 . 2]" 1
1351 1 74 LYS HA 1 74 LYS HG3 . . 4.110 3.245 2.895 3.849 . 0 0 "[ . 1 . 2]" 1
1352 1 74 LYS HA 1 76 LYS H . . 5.030 4.255 3.940 4.495 . 0 0 "[ . 1 . 2]" 1
1353 1 74 LYS HA 1 77 LYS H . . 3.780 3.637 3.425 3.778 . 0 0 "[ . 1 . 2]" 1
1354 1 74 LYS HA 1 77 LYS HB3 . . 3.680 3.655 3.483 3.714 0.034 20 0 "[ . 1 . 2]" 1
1355 1 74 LYS HA 1 77 LYS QD . . 4.030 2.790 2.063 3.712 . 0 0 "[ . 1 . 2]" 1
1356 1 74 LYS HA 1 77 LYS QE . . 4.950 3.351 2.003 4.570 . 0 0 "[ . 1 . 2]" 1
1357 1 74 LYS HA 1 77 LYS QG . . 4.190 2.152 1.985 2.891 . 0 0 "[ . 1 . 2]" 1
1358 1 74 LYS HA 1 78 GLN H . . 4.700 4.254 4.156 4.399 . 0 0 "[ . 1 . 2]" 1
1359 1 74 LYS HA 1 78 GLN HG3 . . 5.370 4.056 3.758 4.334 . 0 0 "[ . 1 . 2]" 1
1360 1 74 LYS QB 1 74 LYS QD . . 3.270 2.254 2.125 2.525 . 0 0 "[ . 1 . 2]" 1
1361 1 74 LYS QB 1 74 LYS QE . . 4.310 2.360 1.963 3.647 . 0 0 "[ . 1 . 2]" 1
1362 1 74 LYS QB 1 75 ALA H . . 3.010 2.585 2.230 2.795 . 0 0 "[ . 1 . 2]" 1
1363 1 74 LYS QB 1 75 ALA MB . . 4.060 3.806 3.719 3.873 . 0 0 "[ . 1 . 2]" 1
1364 1 74 LYS QB 1 77 LYS QE . . 5.280 4.041 2.737 5.283 0.003 6 0 "[ . 1 . 2]" 1
1365 1 74 LYS QB 1 77 LYS QG . . 4.920 3.605 3.384 4.059 . 0 0 "[ . 1 . 2]" 1
1366 1 74 LYS QD 1 75 ALA H . . 5.200 4.900 4.590 5.197 . 0 0 "[ . 1 . 2]" 1
1367 1 74 LYS QE 1 74 LYS QG . . 3.150 2.279 2.114 2.494 . 0 0 "[ . 1 . 2]" 1
1368 1 74 LYS QG 1 75 ALA H . . 4.120 3.999 3.843 4.123 0.003 4 0 "[ . 1 . 2]" 1
1369 1 75 ALA H 1 75 ALA MB . . 2.910 2.115 2.026 2.243 . 0 0 "[ . 1 . 2]" 1
1370 1 75 ALA H 1 76 LYS H . . 3.290 2.627 2.519 2.802 . 0 0 "[ . 1 . 2]" 1
1371 1 75 ALA H 1 77 LYS H . . 4.760 4.431 4.147 4.680 . 0 0 "[ . 1 . 2]" 1
1372 1 75 ALA H 1 78 GLN H . . 4.860 4.808 4.691 4.868 0.008 4 0 "[ . 1 . 2]" 1
1373 1 75 ALA HA 1 77 LYS H . . 5.190 4.843 4.650 4.963 . 0 0 "[ . 1 . 2]" 1
1374 1 75 ALA HA 1 78 GLN H . . 3.670 3.649 3.575 3.684 0.014 20 0 "[ . 1 . 2]" 1
1375 1 75 ALA HA 1 78 GLN HB2 . . 3.830 2.650 2.583 2.699 . 0 0 "[ . 1 . 2]" 1
1376 1 75 ALA HA 1 78 GLN HB3 . . 4.190 4.174 4.077 4.211 0.021 17 0 "[ . 1 . 2]" 1
1377 1 75 ALA HA 1 78 GLN HG2 . . 5.130 5.054 4.811 5.130 0.000 17 0 "[ . 1 . 2]" 1
1378 1 75 ALA HA 1 78 GLN HG3 . . 4.320 3.866 3.586 4.121 . 0 0 "[ . 1 . 2]" 1
1379 1 75 ALA HA 1 79 LEU H . . 4.360 4.273 4.053 4.368 0.008 20 0 "[ . 1 . 2]" 1
1380 1 75 ALA MB 1 76 LYS H . . 3.310 2.737 2.615 2.877 . 0 0 "[ . 1 . 2]" 1
1381 1 75 ALA MB 1 76 LYS HA . . 4.690 3.796 3.696 3.911 . 0 0 "[ . 1 . 2]" 1
1382 1 76 LYS H 1 76 LYS HB2 . . 3.120 2.612 2.340 2.968 . 0 0 "[ . 1 . 2]" 1
1383 1 76 LYS H 1 76 LYS HB3 . . 3.040 2.463 2.211 2.739 . 0 0 "[ . 1 . 2]" 1
1384 1 76 LYS H 1 76 LYS QD . . 4.870 4.346 4.062 4.504 . 0 0 "[ . 1 . 2]" 1
1385 1 76 LYS H 1 76 LYS QG . . 4.090 3.967 3.802 4.044 . 0 0 "[ . 1 . 2]" 1
1386 1 76 LYS H 1 77 LYS H . . 3.320 2.695 2.557 2.826 . 0 0 "[ . 1 . 2]" 1
1387 1 76 LYS H 1 78 GLN H . . 4.380 3.828 3.736 3.902 . 0 0 "[ . 1 . 2]" 1
1388 1 76 LYS HA 1 76 LYS QD . . 4.730 4.029 3.534 4.203 . 0 0 "[ . 1 . 2]" 1
1389 1 76 LYS HA 1 76 LYS QG . . 3.570 2.516 2.378 2.680 . 0 0 "[ . 1 . 2]" 1
1390 1 76 LYS HA 1 78 GLN H . . 4.990 4.055 3.974 4.217 . 0 0 "[ . 1 . 2]" 1
1391 1 76 LYS HA 1 79 LEU H . . 4.270 3.348 3.278 3.438 . 0 0 "[ . 1 . 2]" 1
1392 1 76 LYS HA 1 79 LEU HB2 . . 4.530 3.143 2.979 3.238 . 0 0 "[ . 1 . 2]" 1
1393 1 76 LYS HA 1 79 LEU HB3 . . 3.650 3.328 3.209 3.459 . 0 0 "[ . 1 . 2]" 1
1394 1 76 LYS HA 1 79 LEU MD1 . . 4.840 4.502 4.315 4.676 . 0 0 "[ . 1 . 2]" 1
1395 1 76 LYS HA 1 79 LEU MD2 . . 4.030 3.943 3.678 4.030 . 0 0 "[ . 1 . 2]" 1
1396 1 76 LYS HA 1 80 LEU H . . 4.460 4.076 3.788 4.343 . 0 0 "[ . 1 . 2]" 1
1397 1 76 LYS HA 1 80 LEU MD1 . . 3.790 3.305 3.053 3.475 . 0 0 "[ . 1 . 2]" 1
1398 1 76 LYS HB2 1 76 LYS QE . . 4.220 3.855 2.326 4.267 0.047 9 0 "[ . 1 . 2]" 1
1399 1 76 LYS HB2 1 77 LYS H . . 4.320 3.756 3.587 3.960 . 0 0 "[ . 1 . 2]" 1
1400 1 76 LYS HB3 1 76 LYS QD . . 3.600 2.289 2.052 2.608 . 0 0 "[ . 1 . 2]" 1
1401 1 76 LYS HB3 1 76 LYS QE . . 4.720 3.877 2.401 4.309 . 0 0 "[ . 1 . 2]" 1
1402 1 76 LYS HB3 1 77 LYS H . . 3.440 2.358 2.234 2.619 . 0 0 "[ . 1 . 2]" 1
1403 1 76 LYS QD 1 80 LEU MD1 . . 3.310 3.158 1.966 3.318 0.008 20 0 "[ . 1 . 2]" 1
1404 1 76 LYS QE 1 76 LYS QG . . 3.460 2.140 2.045 2.285 . 0 0 "[ . 1 . 2]" 1
1405 1 76 LYS QE 1 80 LEU MD2 . . 3.740 2.894 1.963 3.741 0.001 2 0 "[ . 1 . 2]" 1
1406 1 76 LYS HE2 1 80 LEU MD1 . . 3.630 2.563 1.970 3.629 . 0 0 "[ . 1 . 2]" 1
1407 1 76 LYS HE3 1 80 LEU MD1 . . 3.630 3.239 2.103 3.624 . 0 0 "[ . 1 . 2]" 1
1408 1 76 LYS QG 1 77 LYS H . . 4.000 3.432 2.861 3.973 . 0 0 "[ . 1 . 2]" 1
1409 1 76 LYS QG 1 77 LYS HA . . 4.480 3.595 3.104 4.286 . 0 0 "[ . 1 . 2]" 1
1410 1 76 LYS QG 1 80 LEU H . . 4.430 4.020 3.741 4.400 . 0 0 "[ . 1 . 2]" 1
1411 1 76 LYS QG 1 80 LEU MD1 . . 3.420 1.900 1.732 2.171 . 0 0 "[ . 1 . 2]" 1
1412 1 76 LYS QG 1 80 LEU MD2 . . 3.780 3.443 2.632 3.770 . 0 0 "[ . 1 . 2]" 1
1413 1 76 LYS QG 1 80 LEU HG . . 4.780 4.459 4.071 4.780 . 0 0 "[ . 1 . 2]" 1
1414 1 77 LYS H 1 77 LYS HB2 . . 3.560 3.544 3.499 3.573 0.013 2 0 "[ . 1 . 2]" 1
1415 1 77 LYS H 1 77 LYS HB3 . . 3.680 2.288 2.194 2.381 . 0 0 "[ . 1 . 2]" 1
1416 1 77 LYS H 1 77 LYS QD . . 4.340 4.051 3.597 4.411 0.071 20 0 "[ . 1 . 2]" 1
1417 1 77 LYS H 1 77 LYS HG2 . . 4.130 2.667 2.474 2.899 . 0 0 "[ . 1 . 2]" 1
1418 1 77 LYS H 1 77 LYS HG3 . . 4.130 3.645 3.346 4.111 . 0 0 "[ . 1 . 2]" 1
1419 1 77 LYS H 1 78 GLN H . . 3.220 2.694 2.590 2.782 . 0 0 "[ . 1 . 2]" 1
1420 1 77 LYS H 1 79 LEU H . . 4.580 4.282 4.136 4.476 . 0 0 "[ . 1 . 2]" 1
1421 1 77 LYS H 1 80 LEU MD1 . . 4.620 4.166 3.722 4.412 . 0 0 "[ . 1 . 2]" 1
1422 1 77 LYS HA 1 77 LYS HG2 . . 4.140 3.858 3.687 3.958 . 0 0 "[ . 1 . 2]" 1
1423 1 77 LYS HA 1 77 LYS QG . . 3.510 3.309 3.277 3.328 . 0 0 "[ . 1 . 2]" 1
1424 1 77 LYS HA 1 77 LYS HG3 . . 4.140 3.605 3.566 3.679 . 0 0 "[ . 1 . 2]" 1
1425 1 77 LYS HA 1 79 LEU H . . 4.750 4.456 4.225 4.748 . 0 0 "[ . 1 . 2]" 1
1426 1 77 LYS HA 1 80 LEU H . . 4.010 3.673 3.509 3.845 . 0 0 "[ . 1 . 2]" 1
1427 1 77 LYS HA 1 80 LEU HB2 . . 4.280 2.810 2.659 3.010 . 0 0 "[ . 1 . 2]" 1
1428 1 77 LYS HA 1 80 LEU HB3 . . 4.500 4.304 4.141 4.500 . 0 0 "[ . 1 . 2]" 1
1429 1 77 LYS HA 1 80 LEU MD1 . . 4.380 3.134 2.435 3.693 . 0 0 "[ . 1 . 2]" 1
1430 1 77 LYS HA 1 80 LEU MD2 . . 3.930 3.692 3.240 3.927 . 0 0 "[ . 1 . 2]" 1
1431 1 77 LYS HA 1 81 HIS H . . 4.870 4.155 3.826 4.477 . 0 0 "[ . 1 . 2]" 1
1432 1 77 LYS HB2 1 77 LYS QD . . 3.320 2.428 2.138 2.858 . 0 0 "[ . 1 . 2]" 1
1433 1 77 LYS HB2 1 77 LYS QE . . 4.320 3.223 2.125 4.142 . 0 0 "[ . 1 . 2]" 1
1434 1 77 LYS HB2 1 78 GLN H . . 4.360 4.100 3.991 4.223 . 0 0 "[ . 1 . 2]" 1
1435 1 77 LYS HB3 1 78 GLN H . . 3.890 3.861 3.726 3.907 0.017 20 0 "[ . 1 . 2]" 1
1436 1 77 LYS QE 1 77 LYS QG . . 3.290 2.217 2.063 2.536 . 0 0 "[ . 1 . 2]" 1
1437 1 77 LYS QG 1 78 GLN H . . 3.670 2.328 2.105 2.436 . 0 0 "[ . 1 . 2]" 1
1438 1 77 LYS QG 1 78 GLN HA . . 4.600 3.071 3.015 3.177 . 0 0 "[ . 1 . 2]" 1
1439 1 77 LYS QG 1 78 GLN HB2 . . 4.200 3.723 3.613 3.860 . 0 0 "[ . 1 . 2]" 1
1440 1 77 LYS QG 1 78 GLN HG3 . . 5.340 2.515 2.106 2.842 . 0 0 "[ . 1 . 2]" 1
1441 1 77 LYS HG2 1 78 GLN H . . 4.400 2.689 2.132 2.967 . 0 0 "[ . 1 . 2]" 1
1442 1 77 LYS HG3 1 78 GLN H . . 4.400 2.709 2.278 3.370 . 0 0 "[ . 1 . 2]" 1
1443 1 78 GLN H 1 78 GLN HB2 . . 3.120 2.277 2.221 2.369 . 0 0 "[ . 1 . 2]" 1
1444 1 78 GLN H 1 78 GLN HB3 . . 3.720 3.548 3.517 3.588 . 0 0 "[ . 1 . 2]" 1
1445 1 78 GLN H 1 78 GLN QE . . 4.940 4.272 3.584 4.904 . 0 0 "[ . 1 . 2]" 1
1446 1 78 GLN H 1 78 GLN HG2 . . 4.000 3.812 3.573 4.001 0.001 6 0 "[ . 1 . 2]" 1
1447 1 78 GLN H 1 78 GLN HG3 . . 3.820 2.789 2.523 2.917 . 0 0 "[ . 1 . 2]" 1
1448 1 78 GLN H 1 79 LEU H . . 3.280 2.485 2.389 2.547 . 0 0 "[ . 1 . 2]" 1
1449 1 78 GLN HA 1 78 GLN HG2 . . 4.130 2.423 2.217 2.751 . 0 0 "[ . 1 . 2]" 1
1450 1 78 GLN HA 1 78 GLN HG3 . . 3.700 2.932 2.632 3.208 . 0 0 "[ . 1 . 2]" 1
1451 1 78 GLN HA 1 80 LEU H . . 4.870 4.547 4.309 4.830 . 0 0 "[ . 1 . 2]" 1
1452 1 78 GLN HA 1 81 HIS HB2 . . 3.840 3.507 3.286 3.793 . 0 0 "[ . 1 . 2]" 1
1453 1 78 GLN HA 1 81 HIS HB3 . . 3.720 3.309 3.125 3.517 . 0 0 "[ . 1 . 2]" 1
1454 1 78 GLN HA 1 81 HIS HD2 . . 5.270 5.078 4.711 5.279 0.009 19 0 "[ . 1 . 2]" 1
1455 1 78 GLN HA 1 82 LEU H . . 4.720 4.176 4.033 4.466 . 0 0 "[ . 1 . 2]" 1
1456 1 78 GLN HB2 1 79 LEU H . . 3.580 2.754 2.608 2.880 . 0 0 "[ . 1 . 2]" 1
1457 1 78 GLN HB2 1 79 LEU HA . . 4.790 4.549 4.381 4.632 . 0 0 "[ . 1 . 2]" 1
1458 1 78 GLN HB2 1 82 LEU MD1 . . 4.470 4.253 3.982 4.430 . 0 0 "[ . 1 . 2]" 1
1459 1 78 GLN HB2 1 82 LEU HG . . 5.500 5.487 5.416 5.519 0.019 19 0 "[ . 1 . 2]" 1
1460 1 78 GLN HB3 1 79 LEU H . . 3.660 3.480 3.257 3.649 . 0 0 "[ . 1 . 2]" 1
1461 1 78 GLN HB3 1 79 LEU HA . . 4.490 4.201 4.092 4.326 . 0 0 "[ . 1 . 2]" 1
1462 1 78 GLN HB3 1 82 LEU MD1 . . 4.520 2.961 2.645 3.141 . 0 0 "[ . 1 . 2]" 1
1463 1 78 GLN HB3 1 82 LEU HG . . 4.880 4.056 3.964 4.244 . 0 0 "[ . 1 . 2]" 1
1464 1 78 GLN HG2 1 79 LEU H . . 5.240 5.048 4.910 5.173 . 0 0 "[ . 1 . 2]" 1
1465 1 78 GLN HG2 1 82 LEU MD1 . . 4.870 4.650 4.265 4.822 . 0 0 "[ . 1 . 2]" 1
1466 1 78 GLN HG3 1 79 LEU H . . 5.080 4.618 4.453 4.700 . 0 0 "[ . 1 . 2]" 1
1467 1 79 LEU H 1 79 LEU HB2 . . 3.060 2.210 2.180 2.249 . 0 0 "[ . 1 . 2]" 1
1468 1 79 LEU H 1 79 LEU HB3 . . 3.180 2.864 2.842 2.889 . 0 0 "[ . 1 . 2]" 1
1469 1 79 LEU H 1 79 LEU MD1 . . 4.030 3.679 3.560 3.775 . 0 0 "[ . 1 . 2]" 1
1470 1 79 LEU H 1 79 LEU MD2 . . 4.900 4.336 4.294 4.351 . 0 0 "[ . 1 . 2]" 1
1471 1 79 LEU H 1 79 LEU HG . . 4.680 4.465 4.446 4.482 . 0 0 "[ . 1 . 2]" 1
1472 1 79 LEU H 1 80 LEU H . . 3.390 2.634 2.542 2.706 . 0 0 "[ . 1 . 2]" 1
1473 1 79 LEU H 1 80 LEU HB2 . . 4.540 4.485 4.398 4.563 0.023 19 0 "[ . 1 . 2]" 1
1474 1 79 LEU H 1 80 LEU MD1 . . 4.400 3.856 3.744 3.965 . 0 0 "[ . 1 . 2]" 1
1475 1 79 LEU H 1 82 LEU H . . 5.220 4.967 4.868 5.083 . 0 0 "[ . 1 . 2]" 1
1476 1 79 LEU HA 1 79 LEU MD1 . . 3.040 2.525 2.404 2.636 . 0 0 "[ . 1 . 2]" 1
1477 1 79 LEU HA 1 79 LEU MD2 . . 3.770 3.787 3.781 3.804 0.034 17 0 "[ . 1 . 2]" 1
1478 1 79 LEU HA 1 79 LEU HG . . 3.870 2.486 2.473 2.533 . 0 0 "[ . 1 . 2]" 1
1479 1 79 LEU HA 1 82 LEU H . . 3.830 3.745 3.498 3.850 0.020 19 0 "[ . 1 . 2]" 1
1480 1 79 LEU HA 1 82 LEU HB2 . . 3.470 3.068 2.909 3.196 . 0 0 "[ . 1 . 2]" 1
1481 1 79 LEU HA 1 82 LEU MD1 . . 3.540 2.662 2.324 3.082 . 0 0 "[ . 1 . 2]" 1
1482 1 79 LEU HA 1 82 LEU HG . . 4.010 3.887 3.580 4.012 0.002 2 0 "[ . 1 . 2]" 1
1483 1 79 LEU HB2 1 79 LEU MD1 . . 3.340 2.118 2.009 2.229 . 0 0 "[ . 1 . 2]" 1
1484 1 79 LEU HB2 1 79 LEU MD2 . . 3.670 2.692 2.611 2.714 . 0 0 "[ . 1 . 2]" 1
1485 1 79 LEU HB2 1 80 LEU H . . 3.700 3.531 3.435 3.626 . 0 0 "[ . 1 . 2]" 1
1486 1 79 LEU HB3 1 79 LEU MD2 . . 3.550 2.033 1.975 2.187 . 0 0 "[ . 1 . 2]" 1
1487 1 79 LEU HB3 1 80 LEU H . . 3.400 2.561 2.360 2.746 . 0 0 "[ . 1 . 2]" 1
1488 1 79 LEU HB3 1 80 LEU MD1 . . 4.040 2.779 2.478 2.930 . 0 0 "[ . 1 . 2]" 1
1489 1 79 LEU MD1 1 82 LEU MD1 . . 3.560 3.377 3.038 3.574 0.014 5 0 "[ . 1 . 2]" 1
1490 1 79 LEU MD1 1 83 ALA MB . . 4.910 4.639 4.458 4.907 . 0 0 "[ . 1 . 2]" 1
1491 1 79 LEU MD2 1 83 ALA MB . . 4.160 3.811 3.646 4.043 . 0 0 "[ . 1 . 2]" 1
1492 1 80 LEU H 1 80 LEU HB2 . . 3.170 2.183 2.167 2.207 . 0 0 "[ . 1 . 2]" 1
1493 1 80 LEU H 1 80 LEU HB3 . . 3.630 3.494 3.485 3.509 . 0 0 "[ . 1 . 2]" 1
1494 1 80 LEU H 1 80 LEU MD1 . . 3.430 2.123 1.881 2.413 . 0 0 "[ . 1 . 2]" 1
1495 1 80 LEU H 1 80 LEU MD2 . . 4.210 4.097 3.923 4.181 . 0 0 "[ . 1 . 2]" 1
1496 1 80 LEU H 1 80 LEU HG . . 3.950 3.763 3.620 3.939 . 0 0 "[ . 1 . 2]" 1
1497 1 80 LEU H 1 81 HIS H . . 3.200 2.764 2.655 2.995 . 0 0 "[ . 1 . 2]" 1
1498 1 80 LEU H 1 81 HIS HB2 . . 4.960 4.893 4.782 4.961 0.001 15 0 "[ . 1 . 2]" 1
1499 1 80 LEU H 1 81 HIS HB3 . . 5.410 5.184 5.032 5.395 . 0 0 "[ . 1 . 2]" 1
1500 1 80 LEU HA 1 80 LEU MD1 . . 3.010 2.879 2.639 3.011 0.001 6 0 "[ . 1 . 2]" 1
1501 1 80 LEU HA 1 80 LEU MD2 . . 4.140 3.655 3.566 3.765 . 0 0 "[ . 1 . 2]" 1
1502 1 80 LEU HA 1 80 LEU HG . . 3.710 2.314 2.251 2.438 . 0 0 "[ . 1 . 2]" 1
1503 1 80 LEU HA 1 83 ALA MB . . 3.630 2.725 2.491 2.896 . 0 0 "[ . 1 . 2]" 1
1504 1 80 LEU HA 1 84 GLU H . . 5.060 4.173 3.646 4.676 . 0 0 "[ . 1 . 2]" 1
1505 1 80 LEU HB2 1 80 LEU MD1 . . 3.460 2.199 2.058 2.367 . 0 0 "[ . 1 . 2]" 1
1506 1 80 LEU HB2 1 80 LEU MD2 . . 3.300 2.541 2.405 2.663 . 0 0 "[ . 1 . 2]" 1
1507 1 80 LEU HB2 1 81 HIS H . . 3.350 2.693 2.376 2.888 . 0 0 "[ . 1 . 2]" 1
1508 1 80 LEU HB2 1 81 HIS HB2 . . 4.870 4.463 4.362 4.563 . 0 0 "[ . 1 . 2]" 1
1509 1 80 LEU HB2 1 81 HIS HB3 . . 5.500 5.419 5.285 5.500 0.000 4 0 "[ . 1 . 2]" 1
1510 1 80 LEU HB3 1 80 LEU MD1 . . 3.220 3.154 3.125 3.188 . 0 0 "[ . 1 . 2]" 1
1511 1 80 LEU HB3 1 80 LEU MD2 . . 3.320 2.167 1.984 2.304 . 0 0 "[ . 1 . 2]" 1
1512 1 80 LEU HB3 1 81 HIS H . . 3.850 3.142 2.640 3.348 . 0 0 "[ . 1 . 2]" 1
1513 1 81 HIS H 1 81 HIS HB2 . . 3.040 2.308 2.209 2.429 . 0 0 "[ . 1 . 2]" 1
1514 1 81 HIS H 1 81 HIS HB3 . . 3.150 2.786 2.646 2.962 . 0 0 "[ . 1 . 2]" 1
1515 1 81 HIS H 1 82 LEU HG . . 4.750 4.495 4.299 4.751 0.001 2 0 "[ . 1 . 2]" 1
1516 1 81 HIS H 1 83 ALA H . . 4.810 4.493 4.190 4.737 . 0 0 "[ . 1 . 2]" 1
1517 1 81 HIS H 1 84 GLU H . . 5.300 5.017 4.817 5.165 . 0 0 "[ . 1 . 2]" 1
1518 1 81 HIS HA 1 81 HIS HD2 . . 5.110 4.583 4.486 4.732 . 0 0 "[ . 1 . 2]" 1
1519 1 81 HIS HA 1 83 ALA H . . 5.500 5.037 4.672 5.298 . 0 0 "[ . 1 . 2]" 1
1520 1 81 HIS HA 1 84 GLU H . . 4.230 4.023 3.814 4.175 . 0 0 "[ . 1 . 2]" 1
1521 1 81 HIS HA 1 84 GLU QB . . 3.920 3.526 3.108 3.977 0.057 19 0 "[ . 1 . 2]" 1
1522 1 81 HIS HA 1 84 GLU HG2 . . 5.230 4.565 2.221 5.227 . 0 0 "[ . 1 . 2]" 1
1523 1 81 HIS HA 1 84 GLU QG . . 4.450 3.688 2.051 4.425 . 0 0 "[ . 1 . 2]" 1
1524 1 81 HIS HA 1 84 GLU HG3 . . 5.230 4.020 2.411 4.855 . 0 0 "[ . 1 . 2]" 1
1525 1 81 HIS HA 1 85 GLU H . . 4.750 4.202 3.921 4.597 . 0 0 "[ . 1 . 2]" 1
1526 1 81 HIS HA 1 85 GLU QG . . 5.300 4.061 3.550 5.244 . 0 0 "[ . 1 . 2]" 1
1527 1 81 HIS HB2 1 82 LEU H . . 3.690 3.556 3.390 3.734 0.044 19 0 "[ . 1 . 2]" 1
1528 1 81 HIS HB2 1 82 LEU HG . . 5.020 4.657 4.504 4.752 . 0 0 "[ . 1 . 2]" 1
1529 1 81 HIS HB3 1 82 LEU H . . 3.600 2.293 2.064 2.703 . 0 0 "[ . 1 . 2]" 1
1530 1 81 HIS HB3 1 82 LEU HB3 . . 5.500 5.406 5.301 5.535 0.035 19 0 "[ . 1 . 2]" 1
1531 1 81 HIS HB3 1 83 ALA H . . 5.500 5.088 4.826 5.387 . 0 0 "[ . 1 . 2]" 1
1532 1 81 HIS HD2 1 82 LEU H . . 4.910 4.438 3.924 4.925 0.015 19 0 "[ . 1 . 2]" 1
1533 1 81 HIS HD2 1 82 LEU HA . . 4.910 4.608 4.084 4.894 . 0 0 "[ . 1 . 2]" 1
1534 1 81 HIS HD2 1 82 LEU MD2 . . 4.300 3.646 3.209 4.176 . 0 0 "[ . 1 . 2]" 1
1535 1 81 HIS HD2 1 82 LEU HG . . 4.730 4.317 3.852 4.679 . 0 0 "[ . 1 . 2]" 1
1536 1 81 HIS HD2 1 85 GLU HG2 . . 5.500 4.584 4.078 5.171 . 0 0 "[ . 1 . 2]" 1
1537 1 81 HIS HD2 1 85 GLU QG . . 4.830 3.620 2.883 3.964 . 0 0 "[ . 1 . 2]" 1
1538 1 81 HIS HD2 1 85 GLU HG3 . . 5.500 3.820 2.943 4.319 . 0 0 "[ . 1 . 2]" 1
1539 1 81 HIS HE1 1 85 GLU HG2 . . 5.500 4.591 3.984 5.224 . 0 0 "[ . 1 . 2]" 1
1540 1 81 HIS HE1 1 85 GLU HG3 . . 5.500 5.001 4.559 5.502 0.002 17 0 "[ . 1 . 2]" 1
1541 1 82 LEU H 1 82 LEU HB2 . . 3.480 2.585 2.506 2.675 . 0 0 "[ . 1 . 2]" 1
1542 1 82 LEU H 1 82 LEU HB3 . . 3.670 3.587 3.576 3.605 . 0 0 "[ . 1 . 2]" 1
1543 1 82 LEU H 1 82 LEU MD1 . . 4.550 3.382 3.266 3.490 . 0 0 "[ . 1 . 2]" 1
1544 1 82 LEU H 1 82 LEU MD2 . . 3.780 3.385 3.263 3.625 . 0 0 "[ . 1 . 2]" 1
1545 1 82 LEU H 1 82 LEU HG . . 3.360 2.069 1.901 2.279 . 0 0 "[ . 1 . 2]" 1
1546 1 82 LEU H 1 83 ALA H . . 3.350 2.884 2.674 3.031 . 0 0 "[ . 1 . 2]" 1
1547 1 82 LEU H 1 84 GLU H . . 4.740 4.330 3.900 4.615 . 0 0 "[ . 1 . 2]" 1
1548 1 82 LEU HA 1 82 LEU MD2 . . 3.190 2.259 2.057 2.479 . 0 0 "[ . 1 . 2]" 1
1549 1 82 LEU HA 1 82 LEU HG . . 3.810 3.041 2.966 3.097 . 0 0 "[ . 1 . 2]" 1
1550 1 82 LEU HA 1 85 GLU H . . 3.370 3.287 3.049 3.416 0.046 19 0 "[ . 1 . 2]" 1
1551 1 82 LEU HA 1 85 GLU QB . . 3.440 2.145 1.922 2.414 . 0 0 "[ . 1 . 2]" 1
1552 1 82 LEU HA 1 85 GLU HG2 . . 4.410 3.850 3.115 4.408 . 0 0 "[ . 1 . 2]" 1
1553 1 82 LEU HA 1 85 GLU QG . . 3.820 3.050 2.640 3.530 . 0 0 "[ . 1 . 2]" 1
1554 1 82 LEU HA 1 85 GLU HG3 . . 4.410 3.268 2.742 3.952 . 0 0 "[ . 1 . 2]" 1
1555 1 82 LEU HA 1 86 LYS H . . 3.630 3.600 3.514 3.642 0.012 5 0 "[ . 1 . 2]" 1
1556 1 82 LEU HB2 1 82 LEU MD1 . . 3.490 2.148 2.052 2.317 . 0 0 "[ . 1 . 2]" 1
1557 1 82 LEU HB2 1 82 LEU MD2 . . 3.190 3.169 3.150 3.184 . 0 0 "[ . 1 . 2]" 1
1558 1 82 LEU HB2 1 83 ALA H . . 3.880 2.178 2.054 2.409 . 0 0 "[ . 1 . 2]" 1
1559 1 82 LEU HB3 1 82 LEU MD1 . . 3.510 2.523 2.401 2.597 . 0 0 "[ . 1 . 2]" 1
1560 1 82 LEU HB3 1 82 LEU MD2 . . 3.470 2.233 2.093 2.353 . 0 0 "[ . 1 . 2]" 1
1561 1 82 LEU HB3 1 83 ALA H . . 3.810 3.352 3.178 3.571 . 0 0 "[ . 1 . 2]" 1
1562 1 82 LEU HB3 1 86 LYS QE . . 4.510 2.896 1.996 3.773 . 0 0 "[ . 1 . 2]" 1
1563 1 82 LEU MD1 1 83 ALA H . . 4.980 3.937 3.793 4.212 . 0 0 "[ . 1 . 2]" 1
1564 1 82 LEU MD2 1 85 GLU H . . 5.230 5.068 4.676 5.231 0.001 19 0 "[ . 1 . 2]" 1
1565 1 82 LEU MD2 1 85 GLU QB . . 4.190 3.394 2.940 3.741 . 0 0 "[ . 1 . 2]" 1
1566 1 82 LEU MD2 1 86 LYS H . . 5.000 4.780 4.463 4.950 . 0 0 "[ . 1 . 2]" 1
1567 1 82 LEU MD2 1 86 LYS QE . . 4.400 3.345 2.166 4.287 . 0 0 "[ . 1 . 2]" 1
1568 1 82 LEU HG 1 83 ALA H . . 4.460 4.126 4.035 4.245 . 0 0 "[ . 1 . 2]" 1
1569 1 83 ALA H 1 83 ALA MB . . 3.030 2.140 2.043 2.274 . 0 0 "[ . 1 . 2]" 1
1570 1 83 ALA H 1 84 GLU H . . 3.280 3.062 2.847 3.177 . 0 0 "[ . 1 . 2]" 1
1571 1 83 ALA H 1 85 GLU H . . 4.570 4.407 4.281 4.554 . 0 0 "[ . 1 . 2]" 1
1572 1 83 ALA MB 1 84 GLU H . . 3.310 2.468 2.274 2.704 . 0 0 "[ . 1 . 2]" 1
1573 1 83 ALA MB 1 84 GLU HA . . 4.550 3.752 3.637 3.897 . 0 0 "[ . 1 . 2]" 1
1574 1 83 ALA MB 1 84 GLU QB . . 4.480 4.132 3.727 4.295 . 0 0 "[ . 1 . 2]" 1
1575 1 83 ALA MB 1 85 GLU H . . 4.930 4.534 4.318 4.717 . 0 0 "[ . 1 . 2]" 1
1576 1 83 ALA MB 1 87 GLN QE . . 4.710 4.127 3.500 4.678 . 0 0 "[ . 1 . 2]" 1
1577 1 84 GLU H 1 84 GLU QB . . 2.860 2.449 2.335 2.615 . 0 0 "[ . 1 . 2]" 1
1578 1 84 GLU H 1 84 GLU HG2 . . 3.780 2.580 2.182 3.679 . 0 0 "[ . 1 . 2]" 1
1579 1 84 GLU H 1 84 GLU HG3 . . 3.780 3.138 1.886 3.732 . 0 0 "[ . 1 . 2]" 1
1580 1 84 GLU H 1 85 GLU H . . 3.240 2.593 2.365 2.775 . 0 0 "[ . 1 . 2]" 1
1581 1 84 GLU H 1 86 LYS H . . 4.730 4.440 4.057 4.677 . 0 0 "[ . 1 . 2]" 1
1582 1 84 GLU HA 1 84 GLU HG2 . . 4.080 2.896 2.425 4.190 0.110 19 0 "[ . 1 . 2]" 1
1583 1 84 GLU HA 1 84 GLU HG3 . . 4.080 3.641 2.948 3.864 . 0 0 "[ . 1 . 2]" 1
1584 1 84 GLU HA 1 87 GLN H . . 4.660 3.693 3.289 4.089 . 0 0 "[ . 1 . 2]" 1
1585 1 84 GLU HA 1 87 GLN QE . . 4.620 2.311 1.884 3.288 . 0 0 "[ . 1 . 2]" 1
1586 1 84 GLU HA 1 87 GLN HG2 . . 4.950 3.758 2.094 4.861 . 0 0 "[ . 1 . 2]" 1
1587 1 84 GLU HA 1 87 GLN QG . . 4.230 2.801 1.832 4.177 . 0 0 "[ . 1 . 2]" 1
1588 1 84 GLU HA 1 87 GLN HG3 . . 4.950 3.107 1.999 4.691 . 0 0 "[ . 1 . 2]" 1
1589 1 84 GLU QB 1 85 GLU H . . 3.280 2.527 2.322 3.324 0.044 19 0 "[ . 1 . 2]" 1
1590 1 84 GLU QB 1 87 GLN HE21 . . 5.500 4.061 3.275 5.206 . 0 0 "[ . 1 . 2]" 1
1591 1 84 GLU QB 1 87 GLN QE . . 4.840 3.764 3.203 4.551 . 0 0 "[ . 1 . 2]" 1
1592 1 84 GLU QB 1 87 GLN HE22 . . 5.500 4.625 3.700 5.407 . 0 0 "[ . 1 . 2]" 1
1593 1 84 GLU QG 1 85 GLU H . . 4.760 3.759 1.891 4.111 . 0 0 "[ . 1 . 2]" 1
1594 1 85 GLU H 1 85 GLU QB . . 2.950 2.297 2.119 2.495 . 0 0 "[ . 1 . 2]" 1
1595 1 85 GLU H 1 85 GLU QG . . 3.560 2.626 2.121 3.660 0.100 16 0 "[ . 1 . 2]" 1
1596 1 85 GLU H 1 86 LYS H . . 3.470 2.993 2.860 3.241 . 0 0 "[ . 1 . 2]" 1
1597 1 85 GLU HA 1 85 GLU QG . . 3.740 2.561 2.146 2.984 . 0 0 "[ . 1 . 2]" 1
1598 1 85 GLU QB 1 86 LYS H . . 3.480 2.311 2.079 2.496 . 0 0 "[ . 1 . 2]" 1
1599 1 86 LYS H 1 86 LYS HB2 . . 3.720 2.471 2.204 2.706 . 0 0 "[ . 1 . 2]" 1
1600 1 86 LYS H 1 86 LYS HB3 . . 3.720 3.582 3.506 3.624 . 0 0 "[ . 1 . 2]" 1
1601 1 86 LYS H 1 86 LYS QD . . 4.640 2.899 1.869 4.578 . 0 0 "[ . 1 . 2]" 1
1602 1 86 LYS H 1 86 LYS HG2 . . 4.130 2.972 1.891 4.125 . 0 0 "[ . 1 . 2]" 1
1603 1 86 LYS H 1 86 LYS QG . . 3.490 2.649 1.882 3.458 . 0 0 "[ . 1 . 2]" 1
1604 1 86 LYS H 1 86 LYS HG3 . . 4.130 3.508 3.001 3.820 . 0 0 "[ . 1 . 2]" 1
1605 1 86 LYS HA 1 86 LYS HD2 . . 4.120 3.132 2.523 3.918 . 0 0 "[ . 1 . 2]" 1
1606 1 86 LYS HA 1 86 LYS QD . . 3.570 2.520 1.990 3.588 0.018 20 0 "[ . 1 . 2]" 1
1607 1 86 LYS HA 1 86 LYS HD3 . . 4.120 3.065 2.010 4.220 0.100 20 0 "[ . 1 . 2]" 1
1608 1 86 LYS HA 1 86 LYS QG . . 3.560 2.550 2.121 2.994 . 0 0 "[ . 1 . 2]" 1
1609 1 86 LYS QB 1 86 LYS QD . . 3.000 2.228 2.000 2.379 . 0 0 "[ . 1 . 2]" 1
1610 1 86 LYS QB 1 87 GLN H . . 4.460 2.459 2.221 2.879 . 0 0 "[ . 1 . 2]" 1
1611 1 86 LYS HB2 1 87 GLN HA . . 5.010 4.444 4.075 4.789 . 0 0 "[ . 1 . 2]" 1
1612 1 86 LYS HB3 1 87 GLN HA . . 5.010 4.219 3.917 4.726 . 0 0 "[ . 1 . 2]" 1
1613 1 86 LYS QD 1 86 LYS QG . . 2.320 2.077 2.029 2.092 . 0 0 "[ . 1 . 2]" 1
1614 1 87 GLN H 1 87 GLN HB2 . . 4.180 2.867 2.255 3.614 . 0 0 "[ . 1 . 2]" 1
1615 1 87 GLN H 1 87 GLN QB . . 3.610 2.501 2.185 2.842 . 0 0 "[ . 1 . 2]" 1
1616 1 87 GLN H 1 87 GLN HB3 . . 4.180 3.181 2.417 3.622 . 0 0 "[ . 1 . 2]" 1
1617 1 87 GLN H 1 87 GLN QG . . 4.600 2.435 1.841 4.059 . 0 0 "[ . 1 . 2]" 1
1618 1 87 GLN HA 1 87 GLN QG . . 3.680 2.684 2.276 3.410 . 0 0 "[ . 1 . 2]" 1
1619 1 87 GLN HB2 1 88 THR H . . 4.980 3.748 2.390 4.518 . 0 0 "[ . 1 . 2]" 1
1620 1 87 GLN HB3 1 88 THR H . . 4.980 3.645 2.456 4.516 . 0 0 "[ . 1 . 2]" 1
1621 1 88 THR HA 1 88 THR MG . . 3.420 2.593 2.190 3.204 . 0 0 "[ . 1 . 2]" 1
1622 1 88 THR HB 1 89 LYS H . . 5.000 3.907 2.340 4.653 . 0 0 "[ . 1 . 2]" 1
1623 1 89 LYS HA 1 89 LYS QD . . 4.720 3.484 2.025 4.375 . 0 0 "[ . 1 . 2]" 1
1624 1 89 LYS QB 1 90 SER H . . 3.420 2.766 1.960 3.427 0.007 9 0 "[ . 1 . 2]" 1
1625 1 89 LYS HB2 1 90 SER H . . 4.130 3.564 1.972 4.157 0.027 6 0 "[ . 1 . 2]" 1
1626 1 89 LYS HB3 1 90 SER H . . 4.130 3.192 2.123 4.000 . 0 0 "[ . 1 . 2]" 1
1627 1 89 LYS QG 1 90 SER H . . 3.620 2.741 1.892 3.541 . 0 0 "[ . 1 . 2]" 1
1628 1 89 LYS HG2 1 90 SER H . . 4.260 3.174 1.898 4.260 . 0 0 "[ . 1 . 2]" 1
1629 1 89 LYS HG3 1 90 SER H . . 4.260 3.539 2.018 4.241 . 0 0 "[ . 1 . 2]" 1
1630 1 91 GLY QA 1 92 PRO QD . . 3.100 1.998 1.885 2.334 . 0 0 "[ . 1 . 2]" 1
1631 1 91 GLY QA 1 92 PRO QG . . 4.890 3.741 3.647 4.103 . 0 0 "[ . 1 . 2]" 1
1632 1 91 GLY HA2 1 92 PRO QD . . 3.560 2.460 1.908 3.471 . 0 0 "[ . 1 . 2]" 1
1633 1 91 GLY HA3 1 92 PRO QD . . 3.560 2.471 1.940 3.398 . 0 0 "[ . 1 . 2]" 1
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