NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
609828 |
5lw8   |
34043 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5lw8
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 1164
_Distance_constraint_stats_list.Viol_count 1790
_Distance_constraint_stats_list.Viol_total 1582.487
_Distance_constraint_stats_list.Viol_max 0.925
_Distance_constraint_stats_list.Viol_rms 0.0240
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0034
_Distance_constraint_stats_list.Viol_average_violations_only 0.0442
_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 2 ASN 2.551 0.110 14 0 "[ . 1 . 2]"
1 3 GLU 2.295 0.110 14 0 "[ . 1 . 2]"
1 4 PHE 1.145 0.064 12 0 "[ . 1 . 2]"
1 5 LEU 2.629 0.290 11 0 "[ . 1 . 2]"
1 6 MET 0.369 0.056 17 0 "[ . 1 . 2]"
1 7 LYS 0.312 0.063 8 0 "[ . 1 . 2]"
1 8 ILE 3.561 0.114 17 0 "[ . 1 . 2]"
1 9 GLN 2.465 0.290 11 0 "[ . 1 . 2]"
1 10 THR 2.139 0.089 8 0 "[ . 1 . 2]"
1 11 ALA 0.395 0.029 20 0 "[ . 1 . 2]"
1 12 ILE 3.988 0.089 8 0 "[ . 1 . 2]"
1 13 SER 0.606 0.132 12 0 "[ . 1 . 2]"
1 14 SER 0.113 0.026 9 0 "[ . 1 . 2]"
1 15 LYS 0.473 0.045 12 0 "[ . 1 . 2]"
1 16 ASN 1.147 0.088 19 0 "[ . 1 . 2]"
1 17 ARG 0.486 0.051 19 0 "[ . 1 . 2]"
1 18 TYR 1.749 0.500 20 0 "[ . 1 . 2]"
1 19 PRO 0.078 0.066 6 0 "[ . 1 . 2]"
1 21 MET 0.286 0.056 20 0 "[ . 1 . 2]"
1 22 ALA 0.425 0.034 14 0 "[ . 1 . 2]"
1 23 GLN 1.213 0.402 9 0 "[ . 1 . 2]"
1 24 ILE 1.049 0.056 20 0 "[ . 1 . 2]"
1 25 ARG 0.084 0.038 16 0 "[ . 1 . 2]"
1 26 GLY 0.608 0.070 9 0 "[ . 1 . 2]"
1 27 ILE 1.044 0.082 8 0 "[ . 1 . 2]"
1 28 GLU 0.135 0.067 13 0 "[ . 1 . 2]"
1 29 GLY 0.907 0.121 15 0 "[ . 1 . 2]"
1 30 GLU 0.484 0.091 11 0 "[ . 1 . 2]"
1 31 VAL 0.482 0.056 17 0 "[ . 1 . 2]"
1 32 LEU 1.259 0.258 5 0 "[ . 1 . 2]"
1 33 VAL 5.790 0.347 2 0 "[ . 1 . 2]"
1 34 SER 0.880 0.088 13 0 "[ . 1 . 2]"
1 35 PHE 4.910 0.187 15 0 "[ . 1 . 2]"
1 36 THR 2.861 0.156 3 0 "[ . 1 . 2]"
1 37 ILE 5.130 0.156 3 0 "[ . 1 . 2]"
1 38 ASN 7.877 0.925 15 5 "[ *. * 1- + *]"
1 39 ALA 1.177 0.084 1 0 "[ . 1 . 2]"
1 40 ASP 0.245 0.082 20 0 "[ . 1 . 2]"
1 41 GLY 0.368 0.071 18 0 "[ . 1 . 2]"
1 42 SER 0.944 0.094 15 0 "[ . 1 . 2]"
1 43 VAL 6.932 0.925 15 5 "[ *. * 1- + *]"
1 44 THR 1.178 0.068 20 0 "[ . 1 . 2]"
1 45 ASP 3.053 0.124 18 0 "[ . 1 . 2]"
1 46 ILE 2.023 0.085 4 0 "[ . 1 . 2]"
1 47 LYS 2.795 0.124 18 0 "[ . 1 . 2]"
1 48 VAL 1.626 0.347 2 0 "[ . 1 . 2]"
1 49 VAL 0.619 0.258 5 0 "[ . 1 . 2]"
1 50 LYS 1.546 0.095 11 0 "[ . 1 . 2]"
1 51 SER 1.044 0.100 11 0 "[ . 1 . 2]"
1 52 ASN 0.881 0.121 15 0 "[ . 1 . 2]"
1 53 THR 0.179 0.045 19 0 "[ . 1 . 2]"
1 54 THR 0.519 0.068 13 0 "[ . 1 . 2]"
1 55 ASP 0.407 0.068 13 0 "[ . 1 . 2]"
1 56 ILE 0.085 0.025 14 0 "[ . 1 . 2]"
1 57 LEU 1.263 0.500 20 0 "[ . 1 . 2]"
1 58 ASN 2.802 0.100 11 0 "[ . 1 . 2]"
1 59 HIS 0.901 0.075 11 0 "[ . 1 . 2]"
1 60 ALA 1.225 0.075 11 0 "[ . 1 . 2]"
1 61 ALA 1.280 0.073 6 0 "[ . 1 . 2]"
1 62 LEU 2.734 0.084 5 0 "[ . 1 . 2]"
1 63 GLU 1.707 0.136 6 0 "[ . 1 . 2]"
1 64 ALA 1.928 0.084 5 0 "[ . 1 . 2]"
1 65 ILE 0.275 0.030 13 0 "[ . 1 . 2]"
1 66 LYS 0.828 0.097 9 0 "[ . 1 . 2]"
1 67 SER 0.516 0.097 9 0 "[ . 1 . 2]"
1 68 ALA 2.759 0.742 10 1 "[ . + . 2]"
1 69 ALA 1.760 0.506 6 1 "[ .+ 1 . 2]"
1 70 HIS 0.565 0.050 7 0 "[ . 1 . 2]"
1 71 LEU 3.777 0.742 10 2 "[ .- + . 2]"
1 72 PHE 2.478 0.150 15 0 "[ . 1 . 2]"
1 73 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 74 LYS 3.127 0.165 18 0 "[ . 1 . 2]"
1 75 PRO 2.893 0.165 18 0 "[ . 1 . 2]"
1 76 GLU 0.280 0.050 13 0 "[ . 1 . 2]"
1 77 GLU 0.415 0.047 10 0 "[ . 1 . 2]"
1 78 THR 2.590 0.128 6 0 "[ . 1 . 2]"
1 79 VAL 7.387 0.919 11 5 "[ - . **1+ .* 2]"
1 80 HIS 0.231 0.075 1 0 "[ . 1 . 2]"
1 81 LEU 6.904 0.919 11 5 "[ - . **1+ .* 2]"
1 82 LYS 1.347 0.320 14 0 "[ . 1 . 2]"
1 83 ILE 4.053 0.282 5 0 "[ . 1 . 2]"
1 84 PRO 0.180 0.059 3 0 "[ . 1 . 2]"
1 85 ILE 2.632 0.344 1 0 "[ . 1 . 2]"
1 86 ALA 0.287 0.072 7 0 "[ . 1 . 2]"
1 87 TYR 2.129 0.097 1 0 "[ . 1 . 2]"
1 88 SER 0.537 0.097 1 0 "[ . 1 . 2]"
1 89 LEU 1.602 0.402 9 0 "[ . 1 . 2]"
1 90 LYS 0.353 0.062 14 0 "[ . 1 . 2]"
1 91 GLU 0.191 0.084 12 0 "[ . 1 . 2]"
1 92 ASP 0.157 0.084 12 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 2 ASN HA 1 2 ASN HD21 . . 4.330 2.666 2.173 3.243 . 0 0 "[ . 1 . 2]" 1
2 1 2 ASN HA 1 2 ASN QD . . 3.780 2.597 2.150 3.076 . 0 0 "[ . 1 . 2]" 1
3 1 2 ASN HA 1 2 ASN HD22 . . 4.330 3.638 3.414 3.961 . 0 0 "[ . 1 . 2]" 1
4 1 2 ASN HA 1 3 GLU QB . . 5.340 4.945 4.028 5.384 0.044 20 0 "[ . 1 . 2]" 1
5 1 2 ASN HB2 1 3 GLU H . . 4.680 3.851 3.484 4.307 . 0 0 "[ . 1 . 2]" 1
6 1 2 ASN HB2 1 3 GLU HA . . 5.500 5.243 4.296 5.583 0.083 7 0 "[ . 1 . 2]" 1
7 1 2 ASN HB2 1 5 LEU QB . . 4.550 3.942 2.066 4.616 0.066 6 0 "[ . 1 . 2]" 1
8 1 2 ASN HB3 1 3 GLU HA . . 4.960 4.179 3.701 4.801 . 0 0 "[ . 1 . 2]" 1
9 1 2 ASN HB3 1 3 GLU QG . . 4.680 4.332 3.288 4.761 0.081 16 0 "[ . 1 . 2]" 1
10 1 2 ASN HB3 1 5 LEU QB . . 4.530 3.645 2.420 4.582 0.052 9 0 "[ . 1 . 2]" 1
11 1 2 ASN QD 1 3 GLU HA . . 5.340 4.975 3.859 5.450 0.110 14 0 "[ . 1 . 2]" 1
12 1 2 ASN QD 1 5 LEU QB . . 4.760 3.021 2.176 4.644 . 0 0 "[ . 1 . 2]" 1
13 1 2 ASN HD21 1 5 LEU MD1 . . 5.500 4.291 2.069 5.557 0.057 17 0 "[ . 1 . 2]" 1
14 1 2 ASN HD21 1 5 LEU MD2 . . 5.500 4.333 2.400 5.534 0.034 7 0 "[ . 1 . 2]" 1
15 1 2 ASN HD22 1 5 LEU MD1 . . 5.500 4.379 2.628 5.552 0.052 4 0 "[ . 1 . 2]" 1
16 1 2 ASN HD22 1 5 LEU MD2 . . 5.500 4.501 2.519 5.569 0.069 14 0 "[ . 1 . 2]" 1
17 1 3 GLU H 1 3 GLU QB . . 3.520 2.624 2.250 3.416 . 0 0 "[ . 1 . 2]" 1
18 1 3 GLU H 1 3 GLU QG . . 4.610 2.670 2.371 3.253 . 0 0 "[ . 1 . 2]" 1
19 1 3 GLU H 1 4 PHE H . . 4.090 2.684 1.943 3.468 . 0 0 "[ . 1 . 2]" 1
20 1 3 GLU HA 1 6 MET H . . 4.150 3.763 3.319 4.206 0.056 17 0 "[ . 1 . 2]" 1
21 1 3 GLU HA 1 6 MET QB . . 4.580 3.704 2.724 4.587 0.007 19 0 "[ . 1 . 2]" 1
22 1 3 GLU HA 1 6 MET ME . . 4.330 3.279 2.054 4.363 0.033 18 0 "[ . 1 . 2]" 1
23 1 3 GLU QB 1 4 PHE H . . 4.000 2.936 2.005 3.800 . 0 0 "[ . 1 . 2]" 1
24 1 3 GLU HB2 1 4 PHE H . . 4.650 3.085 2.050 4.144 . 0 0 "[ . 1 . 2]" 1
25 1 3 GLU HB3 1 4 PHE H . . 4.650 3.780 2.836 4.416 . 0 0 "[ . 1 . 2]" 1
26 1 3 GLU QG 1 4 PHE H . . 4.430 3.642 2.069 4.494 0.064 12 0 "[ . 1 . 2]" 1
27 1 4 PHE H 1 4 PHE HB2 . . 3.590 2.294 2.090 2.528 . 0 0 "[ . 1 . 2]" 1
28 1 4 PHE H 1 4 PHE QB . . 2.980 2.194 2.048 2.335 . 0 0 "[ . 1 . 2]" 1
29 1 4 PHE H 1 4 PHE HB3 . . 3.590 2.866 2.604 3.600 0.010 19 0 "[ . 1 . 2]" 1
30 1 4 PHE H 1 4 PHE QD . . 4.460 4.011 2.947 4.276 . 0 0 "[ . 1 . 2]" 1
31 1 4 PHE HA 1 4 PHE QD . . 4.120 3.024 2.625 3.184 . 0 0 "[ . 1 . 2]" 1
32 1 4 PHE HA 1 8 ILE MD . . 5.500 5.508 5.275 5.542 0.042 15 0 "[ . 1 . 2]" 1
33 1 4 PHE HA 1 8 ILE MG . . 5.500 4.993 4.090 5.428 . 0 0 "[ . 1 . 2]" 1
34 1 4 PHE QB 1 5 LEU H . . 3.070 2.610 2.484 2.751 . 0 0 "[ . 1 . 2]" 1
35 1 4 PHE QB 1 73 PRO QG . . 4.440 3.055 2.250 3.804 . 0 0 "[ . 1 . 2]" 1
36 1 4 PHE HB2 1 5 LEU H . . 3.670 3.540 2.766 3.690 0.020 1 0 "[ . 1 . 2]" 1
37 1 4 PHE HB3 1 5 LEU H . . 3.670 2.726 2.540 3.163 . 0 0 "[ . 1 . 2]" 1
38 1 4 PHE QD 1 5 LEU H . . 4.500 4.184 3.877 4.541 0.041 19 0 "[ . 1 . 2]" 1
39 1 4 PHE QD 1 5 LEU HA . . 5.270 4.024 3.345 5.318 0.048 5 0 "[ . 1 . 2]" 1
40 1 4 PHE QD 1 72 PHE HA . . 4.340 4.267 3.599 4.392 0.052 7 0 "[ . 1 . 2]" 1
41 1 4 PHE QD 1 73 PRO QB . . 5.130 3.277 3.020 3.505 . 0 0 "[ . 1 . 2]" 1
42 1 4 PHE QD 1 73 PRO QD . . 4.300 2.614 2.424 2.838 . 0 0 "[ . 1 . 2]" 1
43 1 4 PHE QD 1 73 PRO QG . . 4.640 3.143 2.768 3.805 . 0 0 "[ . 1 . 2]" 1
44 1 5 LEU H 1 5 LEU QB . . 3.040 2.188 2.038 2.503 . 0 0 "[ . 1 . 2]" 1
45 1 5 LEU HA 1 5 LEU MD1 . . 4.220 2.822 2.103 3.405 . 0 0 "[ . 1 . 2]" 1
46 1 5 LEU HA 1 5 LEU QD . . 3.680 2.350 1.950 2.911 . 0 0 "[ . 1 . 2]" 1
47 1 5 LEU HA 1 5 LEU MD2 . . 4.220 2.803 2.160 3.795 . 0 0 "[ . 1 . 2]" 1
48 1 5 LEU HA 1 5 LEU HG . . 3.670 3.246 2.232 3.735 0.065 4 0 "[ . 1 . 2]" 1
49 1 5 LEU HA 1 7 LYS H . . 4.520 4.279 3.922 4.536 0.016 11 0 "[ . 1 . 2]" 1
50 1 5 LEU HA 1 8 ILE H . . 3.960 3.482 3.161 3.709 . 0 0 "[ . 1 . 2]" 1
51 1 5 LEU HA 1 8 ILE HB . . 5.130 4.887 4.616 5.149 0.019 5 0 "[ . 1 . 2]" 1
52 1 5 LEU HA 1 8 ILE MD . . 4.190 2.480 2.235 2.833 . 0 0 "[ . 1 . 2]" 1
53 1 5 LEU HA 1 8 ILE QG . . 4.710 2.156 2.008 2.276 . 0 0 "[ . 1 . 2]" 1
54 1 5 LEU HA 1 8 ILE MG . . 4.390 4.335 4.114 4.410 0.020 19 0 "[ . 1 . 2]" 1
55 1 5 LEU QB 1 6 MET H . . 3.640 2.633 2.406 2.903 . 0 0 "[ . 1 . 2]" 1
56 1 5 LEU HB2 1 6 MET H . . 4.240 3.622 2.653 4.058 . 0 0 "[ . 1 . 2]" 1
57 1 5 LEU HB3 1 6 MET H . . 4.240 2.823 2.433 3.562 . 0 0 "[ . 1 . 2]" 1
58 1 5 LEU QD 1 6 MET H . . 4.540 3.534 3.010 4.062 . 0 0 "[ . 1 . 2]" 1
59 1 5 LEU QD 1 9 GLN QE . . 4.200 3.312 2.308 4.490 0.290 11 0 "[ . 1 . 2]" 1
60 1 5 LEU QD 1 9 GLN QG . . 4.690 2.645 1.919 4.088 . 0 0 "[ . 1 . 2]" 1
61 1 5 LEU MD1 1 6 MET H . . 5.380 4.267 3.069 5.138 . 0 0 "[ . 1 . 2]" 1
62 1 5 LEU MD1 1 8 ILE H . . 5.500 5.210 4.690 5.614 0.114 17 0 "[ . 1 . 2]" 1
63 1 5 LEU MD2 1 6 MET H . . 5.380 4.128 3.328 4.834 . 0 0 "[ . 1 . 2]" 1
64 1 5 LEU MD2 1 8 ILE H . . 5.500 5.128 4.456 5.550 0.050 14 0 "[ . 1 . 2]" 1
65 1 6 MET H 1 6 MET QB . . 3.540 2.445 2.339 2.615 . 0 0 "[ . 1 . 2]" 1
66 1 6 MET H 1 6 MET HG2 . . 4.120 3.096 2.128 3.793 . 0 0 "[ . 1 . 2]" 1
67 1 6 MET H 1 6 MET QG . . 3.480 2.295 2.075 3.116 . 0 0 "[ . 1 . 2]" 1
68 1 6 MET H 1 6 MET HG3 . . 4.120 2.758 2.113 3.725 . 0 0 "[ . 1 . 2]" 1
69 1 6 MET HA 1 9 GLN H . . 4.090 3.586 3.382 3.843 . 0 0 "[ . 1 . 2]" 1
70 1 6 MET HA 1 9 GLN HB2 . . 4.000 2.443 2.254 2.774 . 0 0 "[ . 1 . 2]" 1
71 1 6 MET HA 1 9 GLN HB3 . . 3.940 3.900 3.744 3.972 0.032 1 0 "[ . 1 . 2]" 1
72 1 6 MET QB 1 7 LYS H . . 3.850 3.090 2.525 3.774 . 0 0 "[ . 1 . 2]" 1
73 1 6 MET HB2 1 7 LYS H . . 4.640 3.275 2.587 4.211 . 0 0 "[ . 1 . 2]" 1
74 1 6 MET HB3 1 7 LYS H . . 4.640 3.933 3.525 4.262 . 0 0 "[ . 1 . 2]" 1
75 1 6 MET ME 1 6 MET QG . . 3.330 2.353 2.113 2.543 . 0 0 "[ . 1 . 2]" 1
76 1 7 LYS H 1 7 LYS QB . . 3.070 2.494 2.293 2.686 . 0 0 "[ . 1 . 2]" 1
77 1 7 LYS H 1 7 LYS HD2 . . 5.500 4.253 3.097 5.105 . 0 0 "[ . 1 . 2]" 1
78 1 7 LYS H 1 7 LYS QD . . 4.850 3.751 2.959 4.569 . 0 0 "[ . 1 . 2]" 1
79 1 7 LYS H 1 7 LYS HD3 . . 5.500 4.418 3.026 5.158 . 0 0 "[ . 1 . 2]" 1
80 1 7 LYS H 1 7 LYS HE2 . . 5.500 4.708 3.362 5.522 0.022 16 0 "[ . 1 . 2]" 1
81 1 7 LYS H 1 7 LYS HE3 . . 5.500 4.938 3.252 5.563 0.063 8 0 "[ . 1 . 2]" 1
82 1 7 LYS H 1 7 LYS QG . . 3.080 2.384 1.986 2.722 . 0 0 "[ . 1 . 2]" 1
83 1 7 LYS H 1 8 ILE H . . 3.450 2.707 2.431 2.960 . 0 0 "[ . 1 . 2]" 1
84 1 7 LYS H 1 8 ILE QG . . 4.770 3.963 3.606 4.303 . 0 0 "[ . 1 . 2]" 1
85 1 7 LYS HA 1 7 LYS QG . . 3.280 2.739 2.160 3.266 . 0 0 "[ . 1 . 2]" 1
86 1 7 LYS QB 1 8 ILE H . . 3.380 2.701 2.395 3.084 . 0 0 "[ . 1 . 2]" 1
87 1 8 ILE H 1 8 ILE HB . . 3.790 3.715 3.668 3.752 . 0 0 "[ . 1 . 2]" 1
88 1 8 ILE H 1 8 ILE MD . . 4.290 3.745 3.640 3.938 . 0 0 "[ . 1 . 2]" 1
89 1 8 ILE H 1 8 ILE HG12 . . 4.030 2.051 1.905 2.337 . 0 0 "[ . 1 . 2]" 1
90 1 8 ILE H 1 8 ILE QG . . 3.320 2.006 1.877 2.250 . 0 0 "[ . 1 . 2]" 1
91 1 8 ILE H 1 8 ILE HG13 . . 4.030 2.884 2.645 3.348 . 0 0 "[ . 1 . 2]" 1
92 1 8 ILE H 1 8 ILE MG . . 3.820 2.840 2.419 3.094 . 0 0 "[ . 1 . 2]" 1
93 1 8 ILE H 1 9 GLN H . . 3.470 2.707 2.487 2.881 . 0 0 "[ . 1 . 2]" 1
94 1 8 ILE H 1 9 GLN HB2 . . 4.830 4.547 4.280 4.768 . 0 0 "[ . 1 . 2]" 1
95 1 8 ILE HA 1 8 ILE MD . . 4.210 4.209 4.191 4.220 0.010 20 0 "[ . 1 . 2]" 1
96 1 8 ILE HA 1 8 ILE HG12 . . 4.140 3.701 3.628 3.836 . 0 0 "[ . 1 . 2]" 1
97 1 8 ILE HA 1 8 ILE HG13 . . 4.140 3.816 3.782 3.854 . 0 0 "[ . 1 . 2]" 1
98 1 8 ILE HA 1 8 ILE MG . . 3.360 2.125 2.097 2.215 . 0 0 "[ . 1 . 2]" 1
99 1 8 ILE HA 1 11 ALA H . . 3.990 2.976 2.781 3.192 . 0 0 "[ . 1 . 2]" 1
100 1 8 ILE HA 1 11 ALA MB . . 3.690 2.396 2.236 2.601 . 0 0 "[ . 1 . 2]" 1
101 1 8 ILE HA 1 12 ILE MD . . 4.410 3.839 3.704 3.930 . 0 0 "[ . 1 . 2]" 1
102 1 8 ILE HA 1 12 ILE HG13 . . 4.840 3.946 3.597 4.186 . 0 0 "[ . 1 . 2]" 1
103 1 8 ILE HA 1 72 PHE QD . . 5.440 5.120 4.780 5.455 0.015 18 0 "[ . 1 . 2]" 1
104 1 8 ILE HA 1 72 PHE QE . . 5.500 4.733 4.474 5.276 . 0 0 "[ . 1 . 2]" 1
105 1 8 ILE HB 1 8 ILE MD . . 3.620 2.434 2.305 2.487 . 0 0 "[ . 1 . 2]" 1
106 1 8 ILE HB 1 9 GLN H . . 4.100 3.610 3.506 3.761 . 0 0 "[ . 1 . 2]" 1
107 1 8 ILE HB 1 12 ILE MD . . 3.780 2.263 2.181 2.339 . 0 0 "[ . 1 . 2]" 1
108 1 8 ILE MD 1 8 ILE MG . . 3.370 2.085 2.056 2.109 . 0 0 "[ . 1 . 2]" 1
109 1 8 ILE MD 1 11 ALA MB . . 5.500 5.367 5.253 5.512 0.012 7 0 "[ . 1 . 2]" 1
110 1 8 ILE MD 1 12 ILE MD . . 3.570 3.045 2.724 3.389 . 0 0 "[ . 1 . 2]" 1
111 1 8 ILE MD 1 37 ILE MD . . 4.430 3.705 2.886 4.165 . 0 0 "[ . 1 . 2]" 1
112 1 8 ILE MD 1 37 ILE MG . . 5.500 5.350 4.730 5.533 0.033 19 0 "[ . 1 . 2]" 1
113 1 8 ILE MD 1 68 ALA MB . . 5.500 5.340 4.849 5.519 0.019 15 0 "[ . 1 . 2]" 1
114 1 8 ILE MD 1 72 PHE HB2 . . 4.970 4.919 4.662 4.999 0.029 17 0 "[ . 1 . 2]" 1
115 1 8 ILE MD 1 72 PHE QB . . 4.240 3.870 3.613 4.013 . 0 0 "[ . 1 . 2]" 1
116 1 8 ILE MD 1 72 PHE HB3 . . 4.970 4.050 3.754 4.229 . 0 0 "[ . 1 . 2]" 1
117 1 8 ILE MD 1 72 PHE QE . . 3.580 2.900 2.585 3.532 . 0 0 "[ . 1 . 2]" 1
118 1 8 ILE MD 1 73 PRO QD . . 3.540 2.317 2.118 2.722 . 0 0 "[ . 1 . 2]" 1
119 1 8 ILE QG 1 9 GLN H . . 3.670 2.331 2.222 2.413 . 0 0 "[ . 1 . 2]" 1
120 1 8 ILE QG 1 9 GLN HB2 . . 4.170 4.164 3.883 4.208 0.038 4 0 "[ . 1 . 2]" 1
121 1 8 ILE QG 1 9 GLN HB3 . . 5.340 5.262 4.930 5.372 0.032 1 0 "[ . 1 . 2]" 1
122 1 8 ILE QG 1 9 GLN QG . . 4.020 3.120 2.648 3.551 . 0 0 "[ . 1 . 2]" 1
123 1 8 ILE QG 1 72 PHE QD . . 5.340 4.890 4.719 5.100 . 0 0 "[ . 1 . 2]" 1
124 1 8 ILE QG 1 72 PHE QE . . 5.340 4.535 4.284 4.956 . 0 0 "[ . 1 . 2]" 1
125 1 8 ILE HG12 1 9 GLN H . . 4.180 3.297 2.808 3.548 . 0 0 "[ . 1 . 2]" 1
126 1 8 ILE HG13 1 9 GLN H . . 4.180 2.385 2.265 2.473 . 0 0 "[ . 1 . 2]" 1
127 1 8 ILE MG 1 9 GLN H . . 4.380 4.254 4.122 4.315 . 0 0 "[ . 1 . 2]" 1
128 1 8 ILE MG 1 9 GLN HA . . 5.500 5.523 5.502 5.542 0.042 14 0 "[ . 1 . 2]" 1
129 1 8 ILE MG 1 11 ALA H . . 5.080 4.598 4.359 4.837 . 0 0 "[ . 1 . 2]" 1
130 1 8 ILE MG 1 11 ALA MB . . 4.900 3.185 2.903 3.515 . 0 0 "[ . 1 . 2]" 1
131 1 8 ILE MG 1 12 ILE H . . 5.280 4.623 4.351 4.882 . 0 0 "[ . 1 . 2]" 1
132 1 8 ILE MG 1 12 ILE MD . . 3.540 3.577 3.566 3.598 0.058 8 0 "[ . 1 . 2]" 1
133 1 8 ILE MG 1 12 ILE HG13 . . 4.610 4.059 3.753 4.289 . 0 0 "[ . 1 . 2]" 1
134 1 8 ILE MG 1 71 LEU H . . 4.690 4.590 4.320 4.708 0.018 7 0 "[ . 1 . 2]" 1
135 1 8 ILE MG 1 71 LEU HA . . 4.460 4.402 4.218 4.492 0.032 17 0 "[ . 1 . 2]" 1
136 1 8 ILE MG 1 71 LEU QB . . 4.580 2.634 2.375 3.000 . 0 0 "[ . 1 . 2]" 1
137 1 8 ILE MG 1 72 PHE H . . 4.190 3.810 3.607 4.014 . 0 0 "[ . 1 . 2]" 1
138 1 8 ILE MG 1 72 PHE QD . . 3.730 2.749 2.316 3.074 . 0 0 "[ . 1 . 2]" 1
139 1 8 ILE MG 1 73 PRO HD2 . . 4.910 3.366 2.826 3.901 . 0 0 "[ . 1 . 2]" 1
140 1 8 ILE MG 1 73 PRO QD . . 4.190 2.654 2.373 3.005 . 0 0 "[ . 1 . 2]" 1
141 1 8 ILE MG 1 73 PRO HD3 . . 4.910 2.783 2.493 3.125 . 0 0 "[ . 1 . 2]" 1
142 1 9 GLN H 1 9 GLN HB2 . . 3.720 2.263 2.147 2.346 . 0 0 "[ . 1 . 2]" 1
143 1 9 GLN H 1 9 GLN HB3 . . 3.560 3.534 3.463 3.569 0.009 3 0 "[ . 1 . 2]" 1
144 1 9 GLN H 1 9 GLN HG2 . . 4.270 3.120 2.443 3.886 . 0 0 "[ . 1 . 2]" 1
145 1 9 GLN H 1 9 GLN QG . . 3.750 2.559 2.402 3.040 . 0 0 "[ . 1 . 2]" 1
146 1 9 GLN H 1 9 GLN HG3 . . 4.270 3.183 2.469 4.042 . 0 0 "[ . 1 . 2]" 1
147 1 9 GLN HA 1 9 GLN HG2 . . 4.210 2.583 2.240 2.864 . 0 0 "[ . 1 . 2]" 1
148 1 9 GLN HA 1 9 GLN QG . . 3.680 2.485 2.177 2.776 . 0 0 "[ . 1 . 2]" 1
149 1 9 GLN HA 1 9 GLN HG3 . . 4.210 3.316 2.534 3.752 . 0 0 "[ . 1 . 2]" 1
150 1 9 GLN HA 1 12 ILE H . . 4.140 3.827 3.569 4.079 . 0 0 "[ . 1 . 2]" 1
151 1 9 GLN HA 1 12 ILE HB . . 3.750 2.841 2.483 3.412 . 0 0 "[ . 1 . 2]" 1
152 1 9 GLN HA 1 12 ILE MD . . 3.550 2.129 2.040 2.262 . 0 0 "[ . 1 . 2]" 1
153 1 9 GLN HB3 1 9 GLN QE . . 4.560 3.490 2.135 4.207 . 0 0 "[ . 1 . 2]" 1
154 1 9 GLN HB3 1 10 THR H . . 3.390 3.400 3.114 3.458 0.068 6 0 "[ . 1 . 2]" 1
155 1 9 GLN QG 1 12 ILE MD . . 5.340 3.321 3.013 3.710 . 0 0 "[ . 1 . 2]" 1
156 1 10 THR H 1 10 THR HB . . 3.090 2.759 2.437 2.924 . 0 0 "[ . 1 . 2]" 1
157 1 10 THR H 1 10 THR MG . . 3.950 3.825 3.785 3.876 . 0 0 "[ . 1 . 2]" 1
158 1 10 THR H 1 11 ALA H . . 3.250 2.796 2.684 2.985 . 0 0 "[ . 1 . 2]" 1
159 1 10 THR H 1 12 ILE MD . . 4.570 4.639 4.617 4.659 0.089 8 0 "[ . 1 . 2]" 1
160 1 10 THR HA 1 10 THR MG . . 3.200 2.306 2.229 2.472 . 0 0 "[ . 1 . 2]" 1
161 1 10 THR HB 1 11 ALA H . . 3.050 2.628 2.393 2.789 . 0 0 "[ . 1 . 2]" 1
162 1 10 THR MG 1 11 ALA H . . 3.860 3.685 3.277 3.803 . 0 0 "[ . 1 . 2]" 1
163 1 10 THR MG 1 11 ALA MB . . 4.390 4.317 3.798 4.412 0.022 18 0 "[ . 1 . 2]" 1
164 1 10 THR MG 1 14 SER H . . 4.460 4.247 3.981 4.483 0.023 11 0 "[ . 1 . 2]" 1
165 1 10 THR MG 1 14 SER HB2 . . 5.500 3.762 3.314 4.366 . 0 0 "[ . 1 . 2]" 1
166 1 10 THR MG 1 14 SER QB . . 4.770 3.597 3.221 3.992 . 0 0 "[ . 1 . 2]" 1
167 1 10 THR MG 1 14 SER HB3 . . 5.500 4.632 4.068 4.992 . 0 0 "[ . 1 . 2]" 1
168 1 11 ALA H 1 11 ALA MB . . 2.900 2.205 2.176 2.232 . 0 0 "[ . 1 . 2]" 1
169 1 11 ALA H 1 12 ILE H . . 3.320 2.795 2.714 2.886 . 0 0 "[ . 1 . 2]" 1
170 1 11 ALA H 1 12 ILE MD . . 4.910 4.650 4.464 4.747 . 0 0 "[ . 1 . 2]" 1
171 1 11 ALA H 1 12 ILE HG13 . . 4.540 4.551 4.488 4.569 0.029 20 0 "[ . 1 . 2]" 1
172 1 11 ALA HA 1 68 ALA MB . . 5.030 4.488 3.989 5.038 0.008 4 0 "[ . 1 . 2]" 1
173 1 11 ALA MB 1 12 ILE H . . 3.390 2.488 2.328 2.659 . 0 0 "[ . 1 . 2]" 1
174 1 11 ALA MB 1 68 ALA MB . . 3.280 2.688 2.227 3.185 . 0 0 "[ . 1 . 2]" 1
175 1 11 ALA MB 1 71 LEU QD . . 3.590 2.437 1.975 3.044 . 0 0 "[ . 1 . 2]" 1
176 1 11 ALA MB 1 71 LEU HG . . 5.110 3.427 2.127 4.518 . 0 0 "[ . 1 . 2]" 1
177 1 12 ILE H 1 12 ILE HB . . 3.220 2.495 2.404 2.567 . 0 0 "[ . 1 . 2]" 1
178 1 12 ILE H 1 12 ILE MD . . 3.280 3.066 2.957 3.163 . 0 0 "[ . 1 . 2]" 1
179 1 12 ILE H 1 12 ILE HG13 . . 3.360 2.118 2.033 2.226 . 0 0 "[ . 1 . 2]" 1
180 1 12 ILE H 1 68 ALA MB . . 4.240 3.395 3.023 3.671 . 0 0 "[ . 1 . 2]" 1
181 1 12 ILE H 1 72 PHE QE . . 4.690 4.731 4.697 4.773 0.083 15 0 "[ . 1 . 2]" 1
182 1 12 ILE HA 1 12 ILE MG . . 3.230 2.453 2.387 2.510 . 0 0 "[ . 1 . 2]" 1
183 1 12 ILE HA 1 14 SER H . . 4.840 4.466 4.185 4.644 . 0 0 "[ . 1 . 2]" 1
184 1 12 ILE HA 1 14 SER QB . . 5.340 5.107 4.946 5.357 0.017 20 0 "[ . 1 . 2]" 1
185 1 12 ILE HA 1 15 LYS HB2 . . 4.670 2.744 2.397 3.187 . 0 0 "[ . 1 . 2]" 1
186 1 12 ILE HA 1 64 ALA HA . . 5.500 4.811 4.437 5.415 . 0 0 "[ . 1 . 2]" 1
187 1 12 ILE HA 1 64 ALA MB . . 4.830 3.513 3.178 3.880 . 0 0 "[ . 1 . 2]" 1
188 1 12 ILE HA 1 68 ALA HA . . 5.500 5.077 4.845 5.291 . 0 0 "[ . 1 . 2]" 1
189 1 12 ILE HA 1 68 ALA MB . . 3.220 2.482 2.276 2.687 . 0 0 "[ . 1 . 2]" 1
190 1 12 ILE HB 1 12 ILE MD . . 3.530 2.221 2.177 2.260 . 0 0 "[ . 1 . 2]" 1
191 1 12 ILE HB 1 13 SER H . . 3.300 2.509 2.390 2.609 . 0 0 "[ . 1 . 2]" 1
192 1 12 ILE HB 1 14 SER H . . 5.460 5.029 4.913 5.170 . 0 0 "[ . 1 . 2]" 1
193 1 12 ILE MD 1 72 PHE QE . . 3.730 2.727 2.413 3.064 . 0 0 "[ . 1 . 2]" 1
194 1 12 ILE HG12 1 12 ILE MG . . 3.350 2.277 2.238 2.330 . 0 0 "[ . 1 . 2]" 1
195 1 12 ILE HG12 1 65 ILE HA . . 5.070 2.814 2.467 3.272 . 0 0 "[ . 1 . 2]" 1
196 1 12 ILE HG12 1 65 ILE MD . . 3.970 2.713 2.258 3.254 . 0 0 "[ . 1 . 2]" 1
197 1 12 ILE HG13 1 13 SER H . . 4.420 4.423 4.361 4.451 0.031 16 0 "[ . 1 . 2]" 1
198 1 12 ILE MG 1 13 SER H . . 3.600 3.321 3.164 3.478 . 0 0 "[ . 1 . 2]" 1
199 1 12 ILE MG 1 13 SER HA . . 4.410 3.517 3.330 3.617 . 0 0 "[ . 1 . 2]" 1
200 1 12 ILE MG 1 14 SER H . . 5.120 5.070 4.915 5.146 0.026 9 0 "[ . 1 . 2]" 1
201 1 12 ILE MG 1 15 LYS H . . 4.700 4.702 4.617 4.735 0.035 19 0 "[ . 1 . 2]" 1
202 1 12 ILE MG 1 16 ASN H . . 4.310 4.245 3.901 4.354 0.044 9 0 "[ . 1 . 2]" 1
203 1 12 ILE MG 1 16 ASN QB . . 4.300 3.353 2.877 3.659 . 0 0 "[ . 1 . 2]" 1
204 1 12 ILE MG 1 16 ASN QD . . 4.830 3.859 3.354 4.494 . 0 0 "[ . 1 . 2]" 1
205 1 12 ILE MG 1 64 ALA H . . 5.500 4.808 4.418 5.308 . 0 0 "[ . 1 . 2]" 1
206 1 12 ILE MG 1 64 ALA MB . . 3.190 2.344 2.069 2.816 . 0 0 "[ . 1 . 2]" 1
207 1 12 ILE MG 1 65 ILE H . . 4.650 3.715 3.424 4.099 . 0 0 "[ . 1 . 2]" 1
208 1 12 ILE MG 1 65 ILE HA . . 3.700 3.166 2.943 3.359 . 0 0 "[ . 1 . 2]" 1
209 1 12 ILE MG 1 65 ILE QG . . 4.310 3.594 3.198 3.868 . 0 0 "[ . 1 . 2]" 1
210 1 12 ILE MG 1 68 ALA H . . 5.170 4.848 4.467 5.175 0.005 18 0 "[ . 1 . 2]" 1
211 1 13 SER H 1 13 SER HB2 . . 3.400 2.518 2.322 2.749 . 0 0 "[ . 1 . 2]" 1
212 1 13 SER H 1 13 SER QB . . 2.830 2.254 2.151 2.426 . 0 0 "[ . 1 . 2]" 1
213 1 13 SER H 1 13 SER HB3 . . 3.400 2.661 2.273 3.532 0.132 12 0 "[ . 1 . 2]" 1
214 1 13 SER H 1 14 SER H . . 3.380 2.820 2.730 2.971 . 0 0 "[ . 1 . 2]" 1
215 1 13 SER H 1 15 LYS H . . 4.910 4.258 4.108 4.395 . 0 0 "[ . 1 . 2]" 1
216 1 13 SER HA 1 15 LYS H . . 5.010 4.440 4.160 4.726 . 0 0 "[ . 1 . 2]" 1
217 1 13 SER HA 1 16 ASN H . . 3.990 3.473 3.265 3.885 . 0 0 "[ . 1 . 2]" 1
218 1 13 SER HA 1 16 ASN QB . . 4.150 2.586 2.187 3.025 . 0 0 "[ . 1 . 2]" 1
219 1 14 SER H 1 14 SER HB2 . . 3.120 2.533 2.199 2.893 . 0 0 "[ . 1 . 2]" 1
220 1 14 SER H 1 14 SER QB . . 2.730 2.216 2.094 2.272 . 0 0 "[ . 1 . 2]" 1
221 1 14 SER H 1 14 SER HB3 . . 3.120 2.500 2.240 2.698 . 0 0 "[ . 1 . 2]" 1
222 1 14 SER H 1 15 LYS H . . 3.440 2.713 2.579 2.844 . 0 0 "[ . 1 . 2]" 1
223 1 14 SER H 1 15 LYS HB2 . . 5.500 4.879 4.600 5.149 . 0 0 "[ . 1 . 2]" 1
224 1 14 SER HA 1 15 LYS HA . . 4.830 4.760 4.706 4.837 0.007 4 0 "[ . 1 . 2]" 1
225 1 14 SER QB 1 15 LYS H . . 3.990 2.741 2.577 3.002 . 0 0 "[ . 1 . 2]" 1
226 1 14 SER HB2 1 15 LYS H . . 4.570 4.006 3.832 4.182 . 0 0 "[ . 1 . 2]" 1
227 1 14 SER HB3 1 15 LYS H . . 4.570 2.793 2.613 3.091 . 0 0 "[ . 1 . 2]" 1
228 1 15 LYS H 1 15 LYS HB2 . . 3.630 2.400 2.250 2.562 . 0 0 "[ . 1 . 2]" 1
229 1 15 LYS H 1 15 LYS HB3 . . 3.910 3.609 3.540 3.701 . 0 0 "[ . 1 . 2]" 1
230 1 15 LYS H 1 15 LYS HG2 . . 4.210 2.695 2.482 3.371 . 0 0 "[ . 1 . 2]" 1
231 1 15 LYS H 1 16 ASN H . . 3.100 2.586 2.303 2.733 . 0 0 "[ . 1 . 2]" 1
232 1 15 LYS HB2 1 16 ASN H . . 3.910 3.327 3.051 3.715 . 0 0 "[ . 1 . 2]" 1
233 1 15 LYS HB2 1 64 ALA MB . . 3.890 3.577 3.094 3.905 0.015 14 0 "[ . 1 . 2]" 1
234 1 15 LYS HB2 1 67 SER QB . . 5.340 3.243 2.727 4.385 . 0 0 "[ . 1 . 2]" 1
235 1 15 LYS HB2 1 68 ALA H . . 4.430 4.234 3.719 4.469 0.039 14 0 "[ . 1 . 2]" 1
236 1 15 LYS HB3 1 16 ASN H . . 4.480 4.039 3.719 4.327 . 0 0 "[ . 1 . 2]" 1
237 1 15 LYS HB3 1 64 ALA HA . . 4.010 3.452 2.943 3.933 . 0 0 "[ . 1 . 2]" 1
238 1 15 LYS HB3 1 68 ALA MB . . 4.410 3.802 3.386 4.252 . 0 0 "[ . 1 . 2]" 1
239 1 15 LYS HG3 1 68 ALA H . . 5.340 3.998 3.571 5.135 . 0 0 "[ . 1 . 2]" 1
240 1 15 LYS HG3 1 68 ALA HA . . 4.030 2.999 2.476 4.075 0.045 12 0 "[ . 1 . 2]" 1
241 1 16 ASN H 1 16 ASN HB2 . . 3.290 2.288 2.155 2.505 . 0 0 "[ . 1 . 2]" 1
242 1 16 ASN H 1 16 ASN HB3 . . 3.290 2.710 2.403 2.933 . 0 0 "[ . 1 . 2]" 1
243 1 16 ASN H 1 17 ARG H . . 5.370 4.634 4.550 4.714 . 0 0 "[ . 1 . 2]" 1
244 1 16 ASN H 1 64 ALA HA . . 5.500 4.693 4.336 5.034 . 0 0 "[ . 1 . 2]" 1
245 1 16 ASN H 1 64 ALA MB . . 3.870 3.249 2.922 3.687 . 0 0 "[ . 1 . 2]" 1
246 1 16 ASN H 1 68 ALA MB . . 5.500 5.467 5.178 5.552 0.052 8 0 "[ . 1 . 2]" 1
247 1 16 ASN HA 1 17 ARG H . . 2.870 2.237 2.090 2.367 . 0 0 "[ . 1 . 2]" 1
248 1 16 ASN HA 1 64 ALA HA . . 5.500 3.472 2.966 3.701 . 0 0 "[ . 1 . 2]" 1
249 1 16 ASN HA 1 64 ALA MB . . 3.400 2.131 2.045 2.313 . 0 0 "[ . 1 . 2]" 1
250 1 16 ASN HA 1 87 TYR QE . . 4.950 4.920 4.514 5.038 0.088 19 0 "[ . 1 . 2]" 1
251 1 16 ASN QB 1 17 ARG H . . 4.050 3.509 3.122 3.830 . 0 0 "[ . 1 . 2]" 1
252 1 16 ASN QB 1 64 ALA MB . . 4.190 2.598 2.150 3.180 . 0 0 "[ . 1 . 2]" 1
253 1 16 ASN HB2 1 17 ARG H . . 4.660 4.161 3.966 4.379 . 0 0 "[ . 1 . 2]" 1
254 1 16 ASN HB3 1 17 ARG H . . 4.660 3.796 3.267 4.247 . 0 0 "[ . 1 . 2]" 1
255 1 16 ASN QD 1 85 ILE MG . . 4.340 2.360 2.069 3.178 . 0 0 "[ . 1 . 2]" 1
256 1 16 ASN QD 1 87 TYR QE . . 4.550 2.562 2.250 3.001 . 0 0 "[ . 1 . 2]" 1
257 1 16 ASN HD21 1 17 ARG H . . 5.500 4.979 3.616 5.549 0.049 16 0 "[ . 1 . 2]" 1
258 1 16 ASN HD21 1 85 ILE MG . . 4.970 2.769 2.323 4.025 . 0 0 "[ . 1 . 2]" 1
259 1 16 ASN HD22 1 17 ARG H . . 5.500 4.539 3.533 5.192 . 0 0 "[ . 1 . 2]" 1
260 1 16 ASN HD22 1 85 ILE MG . . 4.970 2.595 2.172 3.329 . 0 0 "[ . 1 . 2]" 1
261 1 17 ARG H 1 17 ARG QB . . 3.620 2.672 2.321 3.473 . 0 0 "[ . 1 . 2]" 1
262 1 17 ARG H 1 17 ARG HD2 . . 5.500 4.894 2.238 5.457 . 0 0 "[ . 1 . 2]" 1
263 1 17 ARG H 1 17 ARG HD3 . . 5.500 4.621 3.522 5.401 . 0 0 "[ . 1 . 2]" 1
264 1 17 ARG H 1 18 TYR H . . 4.620 3.677 2.549 4.532 . 0 0 "[ . 1 . 2]" 1
265 1 17 ARG H 1 64 ALA HA . . 5.350 5.122 4.274 5.384 0.034 11 0 "[ . 1 . 2]" 1
266 1 17 ARG H 1 64 ALA MB . . 3.560 3.507 3.198 3.611 0.051 19 0 "[ . 1 . 2]" 1
267 1 17 ARG H 1 87 TYR QE . . 4.800 3.948 2.785 4.829 0.029 19 0 "[ . 1 . 2]" 1
268 1 17 ARG HB2 1 18 TYR H . . 5.260 4.120 2.521 4.633 . 0 0 "[ . 1 . 2]" 1
269 1 17 ARG HB3 1 18 TYR H . . 5.260 4.221 3.029 4.525 . 0 0 "[ . 1 . 2]" 1
270 1 18 TYR H 1 18 TYR HB2 . . 4.140 2.890 2.335 4.012 . 0 0 "[ . 1 . 2]" 1
271 1 18 TYR H 1 18 TYR HB3 . . 4.140 2.606 2.242 3.635 . 0 0 "[ . 1 . 2]" 1
272 1 18 TYR H 1 18 TYR QD . . 5.270 3.830 2.392 4.364 . 0 0 "[ . 1 . 2]" 1
273 1 18 TYR H 1 57 LEU QD . . 5.440 4.936 4.302 5.940 0.500 20 0 "[ . 1 . 2]" 1
274 1 18 TYR HA 1 19 PRO HD2 . . 4.050 2.629 2.204 3.335 . 0 0 "[ . 1 . 2]" 1
275 1 18 TYR HA 1 19 PRO QD . . 3.450 2.071 1.924 2.341 . 0 0 "[ . 1 . 2]" 1
276 1 18 TYR HA 1 19 PRO HD3 . . 4.050 2.242 1.954 2.521 . 0 0 "[ . 1 . 2]" 1
277 1 18 TYR QD 1 19 PRO QD . . 3.860 3.269 2.660 3.683 . 0 0 "[ . 1 . 2]" 1
278 1 18 TYR QD 1 57 LEU MD1 . . 5.500 3.291 2.765 4.212 . 0 0 "[ . 1 . 2]" 1
279 1 18 TYR QD 1 57 LEU QD . . 4.150 2.349 2.043 2.967 . 0 0 "[ . 1 . 2]" 1
280 1 18 TYR QD 1 57 LEU MD2 . . 5.500 2.469 2.059 3.758 . 0 0 "[ . 1 . 2]" 1
281 1 18 TYR QD 1 87 TYR QD . . 5.250 2.786 2.388 3.805 . 0 0 "[ . 1 . 2]" 1
282 1 18 TYR QD 1 88 SER H . . 5.250 4.582 3.152 5.320 0.070 20 0 "[ . 1 . 2]" 1
283 1 18 TYR QE 1 19 PRO QD . . 5.350 4.481 3.787 5.416 0.066 6 0 "[ . 1 . 2]" 1
284 1 18 TYR QE 1 22 ALA MB . . 3.910 2.992 2.665 3.910 . 0 0 "[ . 1 . 2]" 1
285 1 18 TYR QE 1 23 GLN HA . . 5.060 3.944 2.647 4.992 . 0 0 "[ . 1 . 2]" 1
286 1 18 TYR QE 1 23 GLN QB . . 4.610 2.384 2.112 3.329 . 0 0 "[ . 1 . 2]" 1
287 1 18 TYR QE 1 24 ILE MD . . 5.500 5.516 5.454 5.547 0.047 12 0 "[ . 1 . 2]" 1
288 1 18 TYR QE 1 57 LEU MD1 . . 5.100 3.269 2.386 5.113 0.013 6 0 "[ . 1 . 2]" 1
289 1 18 TYR QE 1 57 LEU QD . . 4.180 2.827 2.275 4.101 . 0 0 "[ . 1 . 2]" 1
290 1 18 TYR QE 1 57 LEU MD2 . . 5.100 3.296 2.306 4.318 . 0 0 "[ . 1 . 2]" 1
291 1 18 TYR QE 1 87 TYR HA . . 5.500 4.998 4.228 5.501 0.001 13 0 "[ . 1 . 2]" 1
292 1 18 TYR QE 1 87 TYR QD . . 4.390 3.788 2.724 4.320 . 0 0 "[ . 1 . 2]" 1
293 1 18 TYR QE 1 88 SER H . . 4.600 4.138 2.673 4.677 0.077 9 0 "[ . 1 . 2]" 1
294 1 19 PRO QD 1 22 ALA MB . . 4.010 3.034 2.242 3.897 . 0 0 "[ . 1 . 2]" 1
295 1 19 PRO QD 1 57 LEU QD . . 4.010 2.185 1.920 3.219 . 0 0 "[ . 1 . 2]" 1
296 1 19 PRO QG 1 57 LEU QD . . 4.490 3.164 2.378 4.241 . 0 0 "[ . 1 . 2]" 1
297 1 21 MET H 1 22 ALA H . . 4.850 2.691 1.784 3.447 . 0 0 "[ . 1 . 2]" 1
298 1 21 MET H 1 24 ILE QG . . 4.830 4.362 3.862 4.879 0.049 11 0 "[ . 1 . 2]" 1
299 1 21 MET HA 1 24 ILE H . . 4.170 3.358 3.089 3.590 . 0 0 "[ . 1 . 2]" 1
300 1 21 MET HA 1 24 ILE HB . . 3.470 3.082 2.418 3.420 . 0 0 "[ . 1 . 2]" 1
301 1 21 MET HA 1 24 ILE MD . . 3.900 3.746 2.537 3.906 0.006 6 0 "[ . 1 . 2]" 1
302 1 21 MET HA 1 24 ILE HG12 . . 4.370 2.268 2.137 2.919 . 0 0 "[ . 1 . 2]" 1
303 1 21 MET HA 1 24 ILE HG13 . . 4.370 2.971 2.582 4.374 0.004 11 0 "[ . 1 . 2]" 1
304 1 21 MET HA 1 24 ILE MG . . 4.280 4.210 3.727 4.336 0.056 20 0 "[ . 1 . 2]" 1
305 1 22 ALA H 1 22 ALA MB . . 3.520 2.189 2.137 2.229 . 0 0 "[ . 1 . 2]" 1
306 1 22 ALA H 1 23 GLN H . . 4.110 2.799 2.586 3.187 . 0 0 "[ . 1 . 2]" 1
307 1 22 ALA H 1 24 ILE MD . . 5.500 5.420 4.125 5.534 0.034 14 0 "[ . 1 . 2]" 1
308 1 22 ALA H 1 27 ILE MD . . 5.330 5.179 4.689 5.354 0.024 18 0 "[ . 1 . 2]" 1
309 1 22 ALA HA 1 27 ILE HB . . 3.670 2.915 2.394 3.671 0.001 15 0 "[ . 1 . 2]" 1
310 1 22 ALA MB 1 23 GLN H . . 4.250 2.639 2.470 2.886 . 0 0 "[ . 1 . 2]" 1
311 1 22 ALA MB 1 26 GLY H . . 4.950 4.721 4.444 4.954 0.004 19 0 "[ . 1 . 2]" 1
312 1 22 ALA MB 1 27 ILE H . . 4.350 3.615 3.263 3.950 . 0 0 "[ . 1 . 2]" 1
313 1 22 ALA MB 1 27 ILE HA . . 5.200 4.736 4.397 5.070 . 0 0 "[ . 1 . 2]" 1
314 1 22 ALA MB 1 27 ILE MD . . 3.640 3.371 2.885 3.653 0.013 14 0 "[ . 1 . 2]" 1
315 1 22 ALA MB 1 27 ILE MG . . 3.160 2.664 2.281 3.063 . 0 0 "[ . 1 . 2]" 1
316 1 22 ALA MB 1 57 LEU MD1 . . 4.650 3.155 2.312 3.655 . 0 0 "[ . 1 . 2]" 1
317 1 22 ALA MB 1 57 LEU QD . . 3.330 2.799 2.168 3.235 . 0 0 "[ . 1 . 2]" 1
318 1 22 ALA MB 1 57 LEU MD2 . . 4.650 3.241 2.619 3.957 . 0 0 "[ . 1 . 2]" 1
319 1 23 GLN H 1 24 ILE H . . 3.860 2.656 2.556 2.890 . 0 0 "[ . 1 . 2]" 1
320 1 23 GLN HA 1 24 ILE MD . . 5.390 4.631 4.217 4.876 . 0 0 "[ . 1 . 2]" 1
321 1 23 GLN HA 1 89 LEU QD . . 4.130 3.244 2.261 4.532 0.402 9 0 "[ . 1 . 2]" 1
322 1 23 GLN QB 1 23 GLN QE . . 3.700 3.300 2.340 3.739 0.039 14 0 "[ . 1 . 2]" 1
323 1 23 GLN QB 1 24 ILE H . . 4.340 2.992 2.515 3.712 . 0 0 "[ . 1 . 2]" 1
324 1 23 GLN QB 1 24 ILE MD . . 3.770 2.952 2.200 3.779 0.009 16 0 "[ . 1 . 2]" 1
325 1 23 GLN QG 1 89 LEU QD . . 4.670 2.922 2.113 4.953 0.283 5 0 "[ . 1 . 2]" 1
326 1 24 ILE H 1 24 ILE HB . . 3.220 2.734 2.446 2.865 . 0 0 "[ . 1 . 2]" 1
327 1 24 ILE H 1 24 ILE HG12 . . 3.800 2.087 1.900 3.596 . 0 0 "[ . 1 . 2]" 1
328 1 24 ILE H 1 24 ILE QG . . 3.320 2.057 1.891 3.204 . 0 0 "[ . 1 . 2]" 1
329 1 24 ILE H 1 24 ILE HG13 . . 3.800 3.549 3.442 3.690 . 0 0 "[ . 1 . 2]" 1
330 1 24 ILE H 1 24 ILE MG . . 3.790 3.784 3.734 3.811 0.021 19 0 "[ . 1 . 2]" 1
331 1 24 ILE H 1 25 ARG H . . 4.030 2.554 2.303 2.783 . 0 0 "[ . 1 . 2]" 1
332 1 24 ILE HA 1 24 ILE QG . . 3.730 3.253 2.749 3.309 . 0 0 "[ . 1 . 2]" 1
333 1 24 ILE HA 1 24 ILE MG . . 3.460 2.295 2.238 2.460 . 0 0 "[ . 1 . 2]" 1
334 1 25 ARG H 1 26 GLY H . . 3.910 2.538 2.061 2.722 . 0 0 "[ . 1 . 2]" 1
335 1 25 ARG H 1 27 ILE H . . 4.680 4.106 3.571 4.604 . 0 0 "[ . 1 . 2]" 1
336 1 25 ARG HA 1 25 ARG QG . . 3.250 2.627 2.252 3.111 . 0 0 "[ . 1 . 2]" 1
337 1 25 ARG QB 1 27 ILE H . . 4.470 3.593 3.160 4.193 . 0 0 "[ . 1 . 2]" 1
338 1 25 ARG HB2 1 26 GLY H . . 5.430 3.684 3.113 4.201 . 0 0 "[ . 1 . 2]" 1
339 1 25 ARG HB2 1 27 ILE H . . 5.200 4.432 3.519 5.238 0.038 16 0 "[ . 1 . 2]" 1
340 1 25 ARG HB3 1 26 GLY H . . 5.430 3.627 2.855 4.244 . 0 0 "[ . 1 . 2]" 1
341 1 25 ARG HB3 1 27 ILE H . . 5.200 4.169 3.201 5.207 0.007 8 0 "[ . 1 . 2]" 1
342 1 26 GLY H 1 27 ILE H . . 3.580 2.270 2.054 2.509 . 0 0 "[ . 1 . 2]" 1
343 1 26 GLY H 1 27 ILE HB . . 4.530 4.289 4.050 4.476 . 0 0 "[ . 1 . 2]" 1
344 1 26 GLY H 1 27 ILE MG . . 5.500 5.507 5.322 5.570 0.070 9 0 "[ . 1 . 2]" 1
345 1 26 GLY HA2 1 27 ILE MD . . 4.820 4.377 3.933 4.830 0.010 13 0 "[ . 1 . 2]" 1
346 1 26 GLY HA3 1 27 ILE MD . . 4.820 3.894 3.450 4.500 . 0 0 "[ . 1 . 2]" 1
347 1 27 ILE H 1 27 ILE HB . . 3.250 2.347 2.184 2.601 . 0 0 "[ . 1 . 2]" 1
348 1 27 ILE H 1 27 ILE MD . . 3.640 2.416 1.953 2.956 . 0 0 "[ . 1 . 2]" 1
349 1 27 ILE H 1 27 ILE HG12 . . 4.370 4.228 3.902 4.452 0.082 8 0 "[ . 1 . 2]" 1
350 1 27 ILE H 1 27 ILE HG13 . . 3.870 3.664 3.060 3.898 0.028 11 0 "[ . 1 . 2]" 1
351 1 27 ILE HA 1 27 ILE HG13 . . 3.960 2.320 2.186 2.447 . 0 0 "[ . 1 . 2]" 1
352 1 27 ILE HA 1 27 ILE MG . . 3.420 2.570 2.367 2.761 . 0 0 "[ . 1 . 2]" 1
353 1 27 ILE HA 1 28 GLU H . . 2.830 2.121 2.053 2.180 . 0 0 "[ . 1 . 2]" 1
354 1 27 ILE HB 1 28 GLU H . . 4.600 4.341 4.172 4.484 . 0 0 "[ . 1 . 2]" 1
355 1 27 ILE HG12 1 27 ILE MG . . 3.320 2.149 2.109 2.188 . 0 0 "[ . 1 . 2]" 1
356 1 27 ILE HG12 1 28 GLU H . . 5.400 5.017 4.759 5.409 0.009 19 0 "[ . 1 . 2]" 1
357 1 27 ILE HG12 1 54 THR MG . . 3.800 3.099 2.239 3.814 0.014 8 0 "[ . 1 . 2]" 1
358 1 27 ILE HG13 1 28 GLU H . . 4.620 4.083 3.705 4.547 . 0 0 "[ . 1 . 2]" 1
359 1 27 ILE MG 1 28 GLU H . . 3.460 2.772 2.540 3.237 . 0 0 "[ . 1 . 2]" 1
360 1 27 ILE MG 1 54 THR H . . 3.830 3.412 3.081 3.847 0.017 9 0 "[ . 1 . 2]" 1
361 1 27 ILE MG 1 54 THR MG . . 3.550 2.224 1.958 2.734 . 0 0 "[ . 1 . 2]" 1
362 1 28 GLU H 1 28 GLU QB . . 3.550 3.140 2.705 3.435 . 0 0 "[ . 1 . 2]" 1
363 1 28 GLU H 1 28 GLU QG . . 4.580 2.960 2.344 4.354 . 0 0 "[ . 1 . 2]" 1
364 1 28 GLU HA 1 29 GLY H . . 3.390 2.460 2.291 2.673 . 0 0 "[ . 1 . 2]" 1
365 1 28 GLU HA 1 57 LEU QD . . 3.820 3.072 2.129 3.531 . 0 0 "[ . 1 . 2]" 1
366 1 28 GLU HA 1 87 TYR QB . . 4.610 3.187 2.657 4.169 . 0 0 "[ . 1 . 2]" 1
367 1 28 GLU QB 1 29 GLY H . . 3.450 2.568 2.129 3.517 0.067 13 0 "[ . 1 . 2]" 1
368 1 28 GLU HB2 1 29 GLY H . . 4.050 2.831 2.144 4.055 0.005 13 0 "[ . 1 . 2]" 1
369 1 28 GLU HB3 1 29 GLY H . . 4.050 3.629 2.223 4.064 0.014 4 0 "[ . 1 . 2]" 1
370 1 28 GLU QG 1 29 GLY H . . 4.730 3.705 2.008 4.512 . 0 0 "[ . 1 . 2]" 1
371 1 29 GLY H 1 30 GLU H . . 4.680 4.389 4.235 4.464 . 0 0 "[ . 1 . 2]" 1
372 1 29 GLY H 1 57 LEU QD . . 4.180 3.734 3.209 3.909 . 0 0 "[ . 1 . 2]" 1
373 1 29 GLY H 1 87 TYR H . . 4.650 3.566 3.058 4.655 0.005 11 0 "[ . 1 . 2]" 1
374 1 29 GLY H 1 87 TYR QB . . 3.740 2.383 1.760 3.356 . 0 0 "[ . 1 . 2]" 1
375 1 29 GLY HA2 1 53 THR MG . . 5.120 4.075 3.680 4.725 . 0 0 "[ . 1 . 2]" 1
376 1 29 GLY HA3 1 52 ASN H . . 5.290 4.588 4.293 5.055 . 0 0 "[ . 1 . 2]" 1
377 1 29 GLY HA3 1 52 ASN HD21 . . 4.830 4.598 2.823 4.907 0.077 8 0 "[ . 1 . 2]" 1
378 1 29 GLY HA3 1 52 ASN QD . . 4.030 3.405 2.679 3.954 . 0 0 "[ . 1 . 2]" 1
379 1 29 GLY HA3 1 52 ASN HD22 . . 4.830 3.666 3.320 4.951 0.121 15 0 "[ . 1 . 2]" 1
380 1 29 GLY HA3 1 53 THR MG . . 4.230 2.690 2.217 3.473 . 0 0 "[ . 1 . 2]" 1
381 1 29 GLY HA3 1 57 LEU QD . . 4.960 4.260 3.745 4.646 . 0 0 "[ . 1 . 2]" 1
382 1 30 GLU H 1 30 GLU QB . . 3.520 2.628 2.446 2.791 . 0 0 "[ . 1 . 2]" 1
383 1 30 GLU H 1 52 ASN H . . 4.640 3.389 3.192 3.853 . 0 0 "[ . 1 . 2]" 1
384 1 30 GLU H 1 52 ASN HD21 . . 4.800 3.825 2.451 4.499 . 0 0 "[ . 1 . 2]" 1
385 1 30 GLU H 1 52 ASN QD . . 4.120 2.713 1.974 3.193 . 0 0 "[ . 1 . 2]" 1
386 1 30 GLU H 1 52 ASN HD22 . . 4.800 2.971 2.036 4.174 . 0 0 "[ . 1 . 2]" 1
387 1 30 GLU H 1 53 THR H . . 5.030 4.517 4.113 5.046 0.016 11 0 "[ . 1 . 2]" 1
388 1 30 GLU H 1 53 THR MG . . 4.530 3.361 2.882 4.530 . 0 0 "[ . 1 . 2]" 1
389 1 30 GLU HA 1 30 GLU QG . . 3.670 2.447 2.270 3.416 . 0 0 "[ . 1 . 2]" 1
390 1 30 GLU HA 1 31 VAL H . . 3.110 2.160 2.098 2.255 . 0 0 "[ . 1 . 2]" 1
391 1 30 GLU QB 1 52 ASN QD . . 3.750 3.105 2.303 3.832 0.082 11 0 "[ . 1 . 2]" 1
392 1 30 GLU QB 1 87 TYR H . . 5.340 4.646 3.011 5.187 . 0 0 "[ . 1 . 2]" 1
393 1 30 GLU QG 1 31 VAL H . . 4.690 3.660 2.402 4.277 . 0 0 "[ . 1 . 2]" 1
394 1 30 GLU QG 1 86 ALA MB . . 3.750 2.353 2.146 3.393 . 0 0 "[ . 1 . 2]" 1
395 1 30 GLU HG2 1 31 VAL H . . 5.500 3.938 2.424 5.095 . 0 0 "[ . 1 . 2]" 1
396 1 30 GLU HG2 1 86 ALA MB . . 4.270 2.853 2.185 4.276 0.006 11 0 "[ . 1 . 2]" 1
397 1 30 GLU HG2 1 87 TYR H . . 5.500 4.452 3.058 5.591 0.091 11 0 "[ . 1 . 2]" 1
398 1 30 GLU HG3 1 31 VAL H . . 5.500 4.562 3.089 5.240 . 0 0 "[ . 1 . 2]" 1
399 1 30 GLU HG3 1 86 ALA MB . . 4.270 3.104 2.164 3.897 . 0 0 "[ . 1 . 2]" 1
400 1 30 GLU HG3 1 87 TYR H . . 5.500 4.281 3.486 5.467 . 0 0 "[ . 1 . 2]" 1
401 1 31 VAL H 1 31 VAL HB . . 3.730 2.760 2.653 2.873 . 0 0 "[ . 1 . 2]" 1
402 1 31 VAL H 1 31 VAL MG2 . . 3.620 2.535 2.254 2.868 . 0 0 "[ . 1 . 2]" 1
403 1 31 VAL H 1 87 TYR QD . . 5.300 4.786 4.324 5.147 . 0 0 "[ . 1 . 2]" 1
404 1 31 VAL H 1 87 TYR QE . . 5.500 5.177 4.864 5.513 0.013 15 0 "[ . 1 . 2]" 1
405 1 31 VAL HA 1 31 VAL MG1 . . 3.440 2.338 2.296 2.392 . 0 0 "[ . 1 . 2]" 1
406 1 31 VAL HA 1 31 VAL MG2 . . 3.740 2.557 2.496 2.627 . 0 0 "[ . 1 . 2]" 1
407 1 31 VAL HA 1 32 LEU H . . 3.110 2.190 2.151 2.285 . 0 0 "[ . 1 . 2]" 1
408 1 31 VAL HA 1 51 SER HA . . 3.530 2.622 2.391 2.982 . 0 0 "[ . 1 . 2]" 1
409 1 31 VAL HA 1 52 ASN H . . 4.590 3.944 3.305 4.371 . 0 0 "[ . 1 . 2]" 1
410 1 31 VAL HB 1 61 ALA MB . . 3.480 2.560 2.338 2.730 . 0 0 "[ . 1 . 2]" 1
411 1 31 VAL HB 1 85 ILE HB . . 3.550 2.627 2.315 2.780 . 0 0 "[ . 1 . 2]" 1
412 1 31 VAL MG1 1 32 LEU H . . 3.580 2.693 2.284 2.889 . 0 0 "[ . 1 . 2]" 1
413 1 31 VAL MG1 1 48 VAL QG . . 2.660 2.083 1.896 2.225 . 0 0 "[ . 1 . 2]" 1
414 1 31 VAL MG1 1 51 SER HA . . 4.650 3.680 3.418 4.082 . 0 0 "[ . 1 . 2]" 1
415 1 31 VAL MG1 1 51 SER HB2 . . 4.260 2.233 2.119 2.376 . 0 0 "[ . 1 . 2]" 1
416 1 31 VAL MG1 1 51 SER HB3 . . 4.260 3.755 3.495 3.996 . 0 0 "[ . 1 . 2]" 1
417 1 31 VAL MG1 1 58 ASN HA . . 3.470 2.196 2.092 2.381 . 0 0 "[ . 1 . 2]" 1
418 1 31 VAL MG1 1 58 ASN QD . . 4.840 3.771 3.530 4.051 . 0 0 "[ . 1 . 2]" 1
419 1 31 VAL MG1 1 61 ALA MB . . 3.100 2.434 2.259 2.662 . 0 0 "[ . 1 . 2]" 1
420 1 31 VAL MG2 1 51 SER HA . . 5.140 3.891 3.592 4.239 . 0 0 "[ . 1 . 2]" 1
421 1 31 VAL MG2 1 58 ASN HA . . 3.430 2.244 2.136 2.305 . 0 0 "[ . 1 . 2]" 1
422 1 31 VAL MG2 1 58 ASN HB2 . . 4.660 4.531 4.457 4.593 . 0 0 "[ . 1 . 2]" 1
423 1 31 VAL MG2 1 58 ASN HB3 . . 4.250 3.852 3.649 4.018 . 0 0 "[ . 1 . 2]" 1
424 1 31 VAL MG2 1 58 ASN QD . . 4.400 4.029 3.913 4.190 . 0 0 "[ . 1 . 2]" 1
425 1 31 VAL MG2 1 59 HIS H . . 5.240 5.257 5.172 5.296 0.056 17 0 "[ . 1 . 2]" 1
426 1 31 VAL MG2 1 60 ALA H . . 5.350 5.235 4.993 5.369 0.019 5 0 "[ . 1 . 2]" 1
427 1 31 VAL MG2 1 61 ALA H . . 4.200 4.015 3.780 4.201 0.001 16 0 "[ . 1 . 2]" 1
428 1 31 VAL MG2 1 61 ALA MB . . 2.840 2.408 2.128 2.609 . 0 0 "[ . 1 . 2]" 1
429 1 31 VAL MG2 1 87 TYR QD . . 4.130 3.037 2.685 3.425 . 0 0 "[ . 1 . 2]" 1
430 1 31 VAL MG2 1 87 TYR QE . . 4.300 2.499 2.227 2.774 . 0 0 "[ . 1 . 2]" 1
431 1 32 LEU H 1 32 LEU HB2 . . 3.670 2.578 2.221 3.050 . 0 0 "[ . 1 . 2]" 1
432 1 32 LEU H 1 32 LEU QB . . 3.200 2.334 2.165 2.543 . 0 0 "[ . 1 . 2]" 1
433 1 32 LEU H 1 32 LEU HB3 . . 3.670 2.908 2.447 3.685 0.015 15 0 "[ . 1 . 2]" 1
434 1 32 LEU H 1 33 VAL H . . 4.650 4.440 4.359 4.515 . 0 0 "[ . 1 . 2]" 1
435 1 32 LEU H 1 48 VAL QG . . 3.950 3.371 2.994 3.625 . 0 0 "[ . 1 . 2]" 1
436 1 32 LEU H 1 50 LYS H . . 4.160 3.210 2.989 3.496 . 0 0 "[ . 1 . 2]" 1
437 1 32 LEU H 1 51 SER HA . . 4.020 3.298 3.016 3.614 . 0 0 "[ . 1 . 2]" 1
438 1 32 LEU H 1 51 SER QB . . 4.770 3.680 3.355 3.933 . 0 0 "[ . 1 . 2]" 1
439 1 32 LEU HA 1 32 LEU QD . . 3.390 2.113 1.956 2.230 . 0 0 "[ . 1 . 2]" 1
440 1 32 LEU HA 1 33 VAL H . . 3.050 2.150 2.082 2.201 . 0 0 "[ . 1 . 2]" 1
441 1 32 LEU HA 1 49 VAL MG2 . . 4.970 4.784 4.477 4.988 0.018 6 0 "[ . 1 . 2]" 1
442 1 32 LEU QB 1 32 LEU QD . . 2.830 2.002 1.953 2.096 . 0 0 "[ . 1 . 2]" 1
443 1 32 LEU QB 1 33 VAL H . . 4.110 3.660 3.127 3.925 . 0 0 "[ . 1 . 2]" 1
444 1 32 LEU QB 1 48 VAL QG . . 3.850 3.838 3.771 3.931 0.081 18 0 "[ . 1 . 2]" 1
445 1 32 LEU QB 1 49 VAL HB . . 3.900 2.489 2.167 2.806 . 0 0 "[ . 1 . 2]" 1
446 1 32 LEU QB 1 50 LYS H . . 3.380 2.197 2.070 2.359 . 0 0 "[ . 1 . 2]" 1
447 1 32 LEU QD 1 33 VAL H . . 3.570 2.849 2.298 3.742 0.172 9 0 "[ . 1 . 2]" 1
448 1 32 LEU QD 1 49 VAL HB . . 3.640 2.637 2.208 3.898 0.258 5 0 "[ . 1 . 2]" 1
449 1 32 LEU QD 1 84 PRO HA . . 3.800 2.683 2.168 3.858 0.058 4 0 "[ . 1 . 2]" 1
450 1 32 LEU QD 1 84 PRO QB . . 3.470 2.477 2.124 3.529 0.059 3 0 "[ . 1 . 2]" 1
451 1 32 LEU QD 1 84 PRO HD3 . . 4.000 3.122 2.555 3.950 . 0 0 "[ . 1 . 2]" 1
452 1 32 LEU QD 1 84 PRO QG . . 3.920 3.196 2.197 3.627 . 0 0 "[ . 1 . 2]" 1
453 1 32 LEU HG 1 33 VAL H . . 5.380 4.225 3.209 5.381 0.001 4 0 "[ . 1 . 2]" 1
454 1 32 LEU HG 1 50 LYS H . . 4.450 4.114 3.687 4.470 0.020 18 0 "[ . 1 . 2]" 1
455 1 33 VAL H 1 33 VAL HB . . 3.940 3.446 2.608 3.961 0.021 7 0 "[ . 1 . 2]" 1
456 1 33 VAL H 1 33 VAL QG . . 3.490 2.438 2.219 2.768 . 0 0 "[ . 1 . 2]" 1
457 1 33 VAL H 1 34 SER H . . 4.880 4.408 4.280 4.505 . 0 0 "[ . 1 . 2]" 1
458 1 33 VAL H 1 48 VAL HA . . 4.940 4.829 4.647 4.943 0.003 9 0 "[ . 1 . 2]" 1
459 1 33 VAL H 1 49 VAL HB . . 5.310 5.056 4.640 5.326 0.016 1 0 "[ . 1 . 2]" 1
460 1 33 VAL H 1 50 LYS H . . 5.290 5.348 5.298 5.385 0.095 11 0 "[ . 1 . 2]" 1
461 1 33 VAL H 1 83 ILE H . . 4.480 3.565 3.187 4.481 0.001 4 0 "[ . 1 . 2]" 1
462 1 33 VAL H 1 84 PRO HA . . 3.570 3.353 2.391 3.594 0.024 9 0 "[ . 1 . 2]" 1
463 1 33 VAL H 1 85 ILE H . . 4.440 4.304 3.951 4.478 0.038 18 0 "[ . 1 . 2]" 1
464 1 33 VAL HA 1 34 SER H . . 2.970 2.150 2.028 2.294 . 0 0 "[ . 1 . 2]" 1
465 1 33 VAL HA 1 48 VAL HA . . 3.470 2.274 2.148 2.349 . 0 0 "[ . 1 . 2]" 1
466 1 33 VAL HA 1 48 VAL MG1 . . 4.270 3.781 3.507 3.920 . 0 0 "[ . 1 . 2]" 1
467 1 33 VAL HA 1 48 VAL QG . . 3.620 3.400 3.236 3.554 . 0 0 "[ . 1 . 2]" 1
468 1 33 VAL HA 1 48 VAL MG2 . . 4.270 3.888 3.504 4.136 . 0 0 "[ . 1 . 2]" 1
469 1 33 VAL HA 1 49 VAL H . . 3.750 2.655 2.394 2.942 . 0 0 "[ . 1 . 2]" 1
470 1 33 VAL HA 1 49 VAL MG2 . . 4.070 2.759 2.321 3.065 . 0 0 "[ . 1 . 2]" 1
471 1 33 VAL HB 1 34 SER H . . 4.220 3.618 2.804 4.272 0.052 19 0 "[ . 1 . 2]" 1
472 1 33 VAL HB 1 48 VAL QG . . 4.340 3.602 2.649 4.687 0.347 2 0 "[ . 1 . 2]" 1
473 1 33 VAL QG 1 34 SER H . . 3.790 3.046 2.332 3.568 . 0 0 "[ . 1 . 2]" 1
474 1 33 VAL QG 1 35 PHE QD . . 4.420 2.409 2.081 3.019 . 0 0 "[ . 1 . 2]" 1
475 1 33 VAL QG 1 35 PHE QE . . 4.370 3.255 2.125 4.289 . 0 0 "[ . 1 . 2]" 1
476 1 33 VAL QG 1 83 ILE H . . 4.150 3.516 3.092 4.432 0.282 5 0 "[ . 1 . 2]" 1
477 1 33 VAL QG 1 83 ILE HB . . 4.320 3.265 2.396 4.437 0.117 2 0 "[ . 1 . 2]" 1
478 1 33 VAL QG 1 85 ILE H . . 3.790 3.821 3.238 4.134 0.344 1 0 "[ . 1 . 2]" 1
479 1 33 VAL QG 1 85 ILE HB . . 4.900 3.594 3.196 4.152 . 0 0 "[ . 1 . 2]" 1
480 1 34 SER H 1 34 SER QB . . 3.560 2.758 2.197 3.127 . 0 0 "[ . 1 . 2]" 1
481 1 34 SER H 1 35 PHE H . . 4.660 4.498 4.376 4.582 . 0 0 "[ . 1 . 2]" 1
482 1 34 SER H 1 47 LYS QB . . 5.100 4.703 4.575 4.847 . 0 0 "[ . 1 . 2]" 1
483 1 34 SER H 1 47 LYS QG . . 4.340 3.107 2.813 3.484 . 0 0 "[ . 1 . 2]" 1
484 1 34 SER H 1 48 VAL HA . . 3.780 3.533 3.219 3.729 . 0 0 "[ . 1 . 2]" 1
485 1 34 SER H 1 49 VAL MG2 . . 3.540 2.559 2.344 3.028 . 0 0 "[ . 1 . 2]" 1
486 1 34 SER HA 1 35 PHE H . . 2.940 2.183 2.073 2.269 . 0 0 "[ . 1 . 2]" 1
487 1 34 SER HA 1 35 PHE QD . . 4.610 3.728 3.121 4.360 . 0 0 "[ . 1 . 2]" 1
488 1 34 SER HA 1 49 VAL MG2 . . 4.280 3.750 3.440 4.287 0.007 4 0 "[ . 1 . 2]" 1
489 1 34 SER HA 1 81 LEU H . . 5.500 4.653 4.346 4.899 . 0 0 "[ . 1 . 2]" 1
490 1 34 SER HA 1 82 LYS H . . 5.300 4.646 4.456 4.911 . 0 0 "[ . 1 . 2]" 1
491 1 34 SER HA 1 82 LYS HA . . 3.340 2.144 1.939 2.345 . 0 0 "[ . 1 . 2]" 1
492 1 34 SER HA 1 82 LYS QB . . 4.960 3.762 2.279 4.202 . 0 0 "[ . 1 . 2]" 1
493 1 34 SER HA 1 82 LYS QD . . 5.340 4.782 3.455 5.371 0.031 10 0 "[ . 1 . 2]" 1
494 1 34 SER HA 1 82 LYS QG . . 4.930 3.384 2.419 4.750 . 0 0 "[ . 1 . 2]" 1
495 1 34 SER HA 1 83 ILE H . . 4.110 3.199 2.834 3.537 . 0 0 "[ . 1 . 2]" 1
496 1 34 SER HA 1 83 ILE QG . . 5.340 4.578 4.249 4.933 . 0 0 "[ . 1 . 2]" 1
497 1 34 SER QB 1 35 PHE H . . 3.430 2.999 2.624 3.518 0.088 13 0 "[ . 1 . 2]" 1
498 1 34 SER QB 1 47 LYS H . . 5.340 4.545 3.588 5.361 0.021 18 0 "[ . 1 . 2]" 1
499 1 34 SER QB 1 47 LYS QD . . 4.760 4.017 2.343 4.817 0.057 20 0 "[ . 1 . 2]" 1
500 1 34 SER QB 1 47 LYS QG . . 4.100 3.296 2.164 3.945 . 0 0 "[ . 1 . 2]" 1
501 1 34 SER QB 1 49 VAL MG2 . . 3.210 2.314 1.990 2.812 . 0 0 "[ . 1 . 2]" 1
502 1 34 SER QB 1 81 LEU H . . 4.850 4.574 4.098 4.867 0.017 5 0 "[ . 1 . 2]" 1
503 1 34 SER QB 1 82 LYS QB . . 5.180 3.498 2.026 4.567 . 0 0 "[ . 1 . 2]" 1
504 1 34 SER QB 1 82 LYS QD . . 5.180 3.476 2.589 4.432 . 0 0 "[ . 1 . 2]" 1
505 1 34 SER QB 1 82 LYS QG . . 3.780 2.646 2.076 3.829 0.049 9 0 "[ . 1 . 2]" 1
506 1 34 SER QB 1 83 ILE H . . 5.040 4.683 4.020 5.087 0.047 1 0 "[ . 1 . 2]" 1
507 1 34 SER HB2 1 49 VAL MG2 . . 4.060 3.313 2.139 3.805 . 0 0 "[ . 1 . 2]" 1
508 1 34 SER HB2 1 82 LYS HA . . 4.680 3.827 2.751 4.702 0.022 1 0 "[ . 1 . 2]" 1
509 1 34 SER HB3 1 49 VAL MG2 . . 4.060 2.577 2.118 3.850 . 0 0 "[ . 1 . 2]" 1
510 1 34 SER HB3 1 82 LYS HA . . 4.680 3.527 2.770 4.544 . 0 0 "[ . 1 . 2]" 1
511 1 35 PHE H 1 35 PHE QD . . 4.020 3.387 2.972 3.636 . 0 0 "[ . 1 . 2]" 1
512 1 35 PHE H 1 47 LYS QG . . 5.340 5.298 4.821 5.412 0.072 3 0 "[ . 1 . 2]" 1
513 1 35 PHE H 1 81 LEU H . . 4.110 3.133 2.719 3.776 . 0 0 "[ . 1 . 2]" 1
514 1 35 PHE H 1 82 LYS HA . . 3.880 3.583 3.109 3.909 0.029 5 0 "[ . 1 . 2]" 1
515 1 35 PHE H 1 82 LYS QG . . 5.340 4.624 3.684 5.368 0.028 3 0 "[ . 1 . 2]" 1
516 1 35 PHE H 1 83 ILE H . . 4.720 4.371 3.693 4.666 . 0 0 "[ . 1 . 2]" 1
517 1 35 PHE H 1 83 ILE QG . . 4.630 4.558 3.570 4.706 0.076 15 0 "[ . 1 . 2]" 1
518 1 35 PHE HA 1 35 PHE QD . . 3.930 3.779 3.740 3.812 . 0 0 "[ . 1 . 2]" 1
519 1 35 PHE HA 1 36 THR H . . 3.220 2.465 2.357 2.639 . 0 0 "[ . 1 . 2]" 1
520 1 35 PHE HB2 1 36 THR H . . 3.400 2.533 2.116 2.751 . 0 0 "[ . 1 . 2]" 1
521 1 35 PHE HB2 1 43 VAL QG . . 3.900 3.159 2.314 3.742 . 0 0 "[ . 1 . 2]" 1
522 1 35 PHE HB2 1 44 THR H . . 5.120 4.189 3.622 4.840 . 0 0 "[ . 1 . 2]" 1
523 1 35 PHE HB2 1 46 ILE HA . . 4.090 2.996 2.527 3.409 . 0 0 "[ . 1 . 2]" 1
524 1 35 PHE HB2 1 46 ILE MD . . 4.260 2.140 2.035 2.407 . 0 0 "[ . 1 . 2]" 1
525 1 35 PHE HB2 1 46 ILE HG13 . . 5.500 4.846 4.544 5.365 . 0 0 "[ . 1 . 2]" 1
526 1 35 PHE HB2 1 47 LYS H . . 5.010 4.711 4.192 5.034 0.024 7 0 "[ . 1 . 2]" 1
527 1 35 PHE HB3 1 36 THR H . . 4.020 3.900 3.631 4.067 0.047 13 0 "[ . 1 . 2]" 1
528 1 35 PHE HB3 1 46 ILE H . . 5.280 4.793 4.198 5.281 0.001 9 0 "[ . 1 . 2]" 1
529 1 35 PHE HB3 1 46 ILE HA . . 4.040 2.400 2.116 2.750 . 0 0 "[ . 1 . 2]" 1
530 1 35 PHE HB3 1 46 ILE MD . . 4.130 2.804 2.368 3.247 . 0 0 "[ . 1 . 2]" 1
531 1 35 PHE HB3 1 46 ILE HG13 . . 5.500 5.029 4.591 5.523 0.023 18 0 "[ . 1 . 2]" 1
532 1 35 PHE HB3 1 46 ILE MG . . 4.030 2.583 2.368 3.060 . 0 0 "[ . 1 . 2]" 1
533 1 35 PHE HB3 1 47 LYS H . . 4.220 3.520 2.968 3.686 . 0 0 "[ . 1 . 2]" 1
534 1 35 PHE HB3 1 47 LYS QD . . 5.340 5.191 4.283 5.440 0.100 16 0 "[ . 1 . 2]" 1
535 1 35 PHE HB3 1 83 ILE H . . 5.500 5.636 5.588 5.687 0.187 15 0 "[ . 1 . 2]" 1
536 1 35 PHE QD 1 36 THR H . . 4.230 3.002 2.629 3.932 . 0 0 "[ . 1 . 2]" 1
537 1 35 PHE QD 1 37 ILE H . . 4.560 4.123 3.546 4.576 0.016 12 0 "[ . 1 . 2]" 1
538 1 35 PHE QD 1 46 ILE MG . . 4.580 3.290 2.377 3.709 . 0 0 "[ . 1 . 2]" 1
539 1 35 PHE QD 1 47 LYS H . . 5.090 4.848 4.170 5.110 0.020 1 0 "[ . 1 . 2]" 1
540 1 35 PHE QD 1 83 ILE H . . 5.020 3.760 3.494 4.077 . 0 0 "[ . 1 . 2]" 1
541 1 35 PHE QE 1 43 VAL MG1 . . 3.940 2.740 2.295 3.977 0.037 15 0 "[ . 1 . 2]" 1
542 1 35 PHE QE 1 43 VAL QG . . 3.220 2.623 2.275 3.039 . 0 0 "[ . 1 . 2]" 1
543 1 35 PHE QE 1 43 VAL MG2 . . 3.940 3.719 2.875 3.950 0.010 9 0 "[ . 1 . 2]" 1
544 1 35 PHE QE 1 65 ILE MD . . 3.690 2.675 2.317 3.233 . 0 0 "[ . 1 . 2]" 1
545 1 35 PHE QE 1 65 ILE MG . . 3.590 3.031 2.722 3.380 . 0 0 "[ . 1 . 2]" 1
546 1 35 PHE QE 1 83 ILE H . . 5.500 3.838 3.487 4.451 . 0 0 "[ . 1 . 2]" 1
547 1 35 PHE QE 1 83 ILE HB . . 4.160 2.293 2.127 2.497 . 0 0 "[ . 1 . 2]" 1
548 1 35 PHE QE 1 83 ILE MD . . 4.750 3.973 3.722 4.326 . 0 0 "[ . 1 . 2]" 1
549 1 36 THR H 1 36 THR HB . . 3.400 3.240 3.032 3.440 0.040 6 0 "[ . 1 . 2]" 1
550 1 36 THR H 1 36 THR MG . . 4.170 3.999 3.846 4.137 . 0 0 "[ . 1 . 2]" 1
551 1 36 THR H 1 46 ILE MD . . 4.490 3.540 3.224 4.178 . 0 0 "[ . 1 . 2]" 1
552 1 36 THR HA 1 36 THR MG . . 3.320 2.201 2.155 2.276 . 0 0 "[ . 1 . 2]" 1
553 1 36 THR HA 1 37 ILE H . . 2.880 2.219 2.135 2.280 . 0 0 "[ . 1 . 2]" 1
554 1 36 THR HB 1 37 ILE H . . 4.360 3.335 3.219 3.516 . 0 0 "[ . 1 . 2]" 1
555 1 36 THR HB 1 37 ILE HB . . 5.440 5.462 5.045 5.596 0.156 3 0 "[ . 1 . 2]" 1
556 1 36 THR MG 1 37 ILE H . . 3.050 2.029 1.824 2.370 . 0 0 "[ . 1 . 2]" 1
557 1 36 THR MG 1 37 ILE HA . . 4.490 4.041 3.791 4.260 . 0 0 "[ . 1 . 2]" 1
558 1 36 THR MG 1 37 ILE HB . . 4.040 3.912 3.364 4.156 0.116 17 0 "[ . 1 . 2]" 1
559 1 37 ILE H 1 37 ILE HB . . 3.680 2.694 2.583 2.997 . 0 0 "[ . 1 . 2]" 1
560 1 37 ILE H 1 37 ILE MD . . 4.620 3.273 1.689 4.128 . 0 0 "[ . 1 . 2]" 1
561 1 37 ILE H 1 37 ILE QG . . 3.800 2.724 1.924 3.053 . 0 0 "[ . 1 . 2]" 1
562 1 37 ILE HA 1 37 ILE MD . . 3.990 3.813 2.286 4.055 0.065 7 0 "[ . 1 . 2]" 1
563 1 37 ILE HA 1 37 ILE MG . . 3.600 2.310 2.144 2.451 . 0 0 "[ . 1 . 2]" 1
564 1 37 ILE HA 1 38 ASN H . . 2.920 2.200 2.170 2.269 . 0 0 "[ . 1 . 2]" 1
565 1 37 ILE HA 1 38 ASN HD22 . . 5.400 4.974 4.217 5.408 0.008 6 0 "[ . 1 . 2]" 1
566 1 37 ILE HA 1 43 VAL HA . . 3.770 2.375 1.998 2.550 . 0 0 "[ . 1 . 2]" 1
567 1 37 ILE HA 1 43 VAL MG1 . . 4.470 3.195 2.465 4.558 0.088 15 0 "[ . 1 . 2]" 1
568 1 37 ILE HA 1 43 VAL QG . . 3.650 2.767 2.216 3.385 . 0 0 "[ . 1 . 2]" 1
569 1 37 ILE HA 1 43 VAL MG2 . . 4.470 3.077 2.396 3.632 . 0 0 "[ . 1 . 2]" 1
570 1 37 ILE HA 1 44 THR H . . 4.770 3.567 3.282 3.923 . 0 0 "[ . 1 . 2]" 1
571 1 37 ILE HB 1 37 ILE MD . . 3.350 2.407 2.254 3.238 . 0 0 "[ . 1 . 2]" 1
572 1 37 ILE HB 1 72 PHE QD . . 5.180 4.948 4.644 5.205 0.025 8 0 "[ . 1 . 2]" 1
573 1 37 ILE HB 1 75 PRO HA . . 5.500 5.561 5.429 5.618 0.118 8 0 "[ . 1 . 2]" 1
574 1 37 ILE HB 1 75 PRO HD3 . . 3.940 3.095 2.031 3.946 0.006 14 0 "[ . 1 . 2]" 1
575 1 37 ILE MD 1 72 PHE HB2 . . 4.740 4.445 3.247 4.761 0.021 10 0 "[ . 1 . 2]" 1
576 1 37 ILE MD 1 72 PHE QB . . 3.950 3.151 2.191 3.708 . 0 0 "[ . 1 . 2]" 1
577 1 37 ILE MD 1 72 PHE HB3 . . 4.740 3.231 2.208 3.868 . 0 0 "[ . 1 . 2]" 1
578 1 37 ILE MD 1 72 PHE QD . . 3.110 2.297 1.965 2.530 . 0 0 "[ . 1 . 2]" 1
579 1 37 ILE MD 1 75 PRO HD3 . . 5.010 3.583 2.320 4.975 . 0 0 "[ . 1 . 2]" 1
580 1 37 ILE HG12 1 72 PHE QD . . 3.830 2.549 2.265 3.980 0.150 15 0 "[ . 1 . 2]" 1
581 1 37 ILE HG13 1 72 PHE QD . . 3.830 3.558 2.574 3.881 0.051 3 0 "[ . 1 . 2]" 1
582 1 37 ILE MG 1 38 ASN H . . 3.360 2.580 2.377 2.807 . 0 0 "[ . 1 . 2]" 1
583 1 37 ILE MG 1 41 GLY H . . 4.070 3.568 3.117 3.866 . 0 0 "[ . 1 . 2]" 1
584 1 37 ILE MG 1 41 GLY QA . . 4.050 2.910 2.152 3.430 . 0 0 "[ . 1 . 2]" 1
585 1 37 ILE MG 1 72 PHE HB2 . . 5.160 3.641 2.743 4.252 . 0 0 "[ . 1 . 2]" 1
586 1 37 ILE MG 1 72 PHE QB . . 4.500 2.888 2.299 3.341 . 0 0 "[ . 1 . 2]" 1
587 1 37 ILE MG 1 72 PHE HB3 . . 5.160 3.038 2.467 3.494 . 0 0 "[ . 1 . 2]" 1
588 1 37 ILE MG 1 72 PHE QD . . 4.000 3.485 3.034 3.968 . 0 0 "[ . 1 . 2]" 1
589 1 37 ILE MG 1 74 LYS H . . 5.150 4.953 3.973 5.207 0.057 20 0 "[ . 1 . 2]" 1
590 1 37 ILE MG 1 75 PRO HD2 . . 3.850 2.958 2.638 3.284 . 0 0 "[ . 1 . 2]" 1
591 1 37 ILE MG 1 75 PRO HD3 . . 3.580 2.230 1.950 2.968 . 0 0 "[ . 1 . 2]" 1
592 1 38 ASN H 1 38 ASN HB2 . . 3.290 2.502 2.332 2.595 . 0 0 "[ . 1 . 2]" 1
593 1 38 ASN H 1 38 ASN HB3 . . 3.760 3.647 3.584 3.707 . 0 0 "[ . 1 . 2]" 1
594 1 38 ASN H 1 38 ASN HD21 . . 3.740 2.633 2.078 3.759 0.019 6 0 "[ . 1 . 2]" 1
595 1 38 ASN H 1 38 ASN HD22 . . 4.340 3.830 3.509 4.071 . 0 0 "[ . 1 . 2]" 1
596 1 38 ASN H 1 40 ASP H . . 5.320 5.035 4.702 5.314 . 0 0 "[ . 1 . 2]" 1
597 1 38 ASN H 1 42 SER H . . 4.430 3.649 3.109 3.950 . 0 0 "[ . 1 . 2]" 1
598 1 38 ASN H 1 43 VAL HA . . 4.020 3.380 3.025 3.670 . 0 0 "[ . 1 . 2]" 1
599 1 38 ASN HA 1 38 ASN HD21 . . 4.760 4.124 3.646 4.571 . 0 0 "[ . 1 . 2]" 1
600 1 38 ASN HA 1 39 ALA H . . 2.950 2.333 2.255 2.444 . 0 0 "[ . 1 . 2]" 1
601 1 38 ASN HA 1 39 ALA MB . . 4.290 4.068 3.933 4.132 . 0 0 "[ . 1 . 2]" 1
602 1 38 ASN HA 1 78 THR HA . . 3.890 3.127 2.449 3.893 0.003 13 0 "[ . 1 . 2]" 1
603 1 38 ASN HA 1 78 THR MG . . 3.250 2.206 2.063 2.619 . 0 0 "[ . 1 . 2]" 1
604 1 38 ASN HB2 1 38 ASN HD21 . . 3.510 2.283 2.156 2.464 . 0 0 "[ . 1 . 2]" 1
605 1 38 ASN HB2 1 38 ASN HD22 . . 3.920 3.520 3.457 3.595 . 0 0 "[ . 1 . 2]" 1
606 1 38 ASN HB2 1 39 ALA H . . 3.810 3.811 3.703 3.894 0.084 1 0 "[ . 1 . 2]" 1
607 1 38 ASN HB2 1 40 ASP H . . 3.560 3.222 2.870 3.501 . 0 0 "[ . 1 . 2]" 1
608 1 38 ASN HB2 1 42 SER H . . 3.720 2.721 2.251 3.002 . 0 0 "[ . 1 . 2]" 1
609 1 38 ASN HB2 1 43 VAL QG . . 5.190 5.494 5.031 6.115 0.925 15 5 "[ *. * 1- + *]" 1
610 1 38 ASN HB2 1 78 THR MG . . 5.270 4.508 4.287 5.026 . 0 0 "[ . 1 . 2]" 1
611 1 38 ASN HB3 1 39 ALA H . . 3.260 2.747 2.535 2.897 . 0 0 "[ . 1 . 2]" 1
612 1 38 ASN HB3 1 40 ASP H . . 3.440 2.831 2.380 3.249 . 0 0 "[ . 1 . 2]" 1
613 1 38 ASN HB3 1 41 GLY H . . 4.510 4.267 3.789 4.577 0.067 18 0 "[ . 1 . 2]" 1
614 1 38 ASN HB3 1 78 THR MG . . 3.890 3.686 3.329 3.950 0.060 7 0 "[ . 1 . 2]" 1
615 1 38 ASN HD21 1 42 SER H . . 4.670 3.699 3.475 3.978 . 0 0 "[ . 1 . 2]" 1
616 1 38 ASN HD21 1 42 SER HA . . 5.280 4.493 4.271 4.874 . 0 0 "[ . 1 . 2]" 1
617 1 38 ASN HD21 1 42 SER HB2 . . 4.850 3.346 1.717 4.870 0.020 18 0 "[ . 1 . 2]" 1
618 1 38 ASN HD21 1 42 SER QB . . 4.250 2.859 1.705 3.674 . 0 0 "[ . 1 . 2]" 1
619 1 38 ASN HD21 1 42 SER HB3 . . 4.850 3.615 2.528 4.656 . 0 0 "[ . 1 . 2]" 1
620 1 38 ASN HD21 1 43 VAL HA . . 4.940 3.853 3.249 4.729 . 0 0 "[ . 1 . 2]" 1
621 1 38 ASN HD21 1 44 THR H . . 5.020 4.255 3.645 5.034 0.014 13 0 "[ . 1 . 2]" 1
622 1 38 ASN HD21 1 44 THR HB . . 5.500 4.055 3.150 5.084 . 0 0 "[ . 1 . 2]" 1
623 1 38 ASN HD21 1 44 THR MG . . 3.630 3.011 2.426 3.640 0.010 20 0 "[ . 1 . 2]" 1
624 1 38 ASN HD22 1 42 SER H . . 5.310 5.331 5.175 5.404 0.094 15 0 "[ . 1 . 2]" 1
625 1 38 ASN HD22 1 44 THR H . . 4.400 4.082 3.052 4.455 0.055 4 0 "[ . 1 . 2]" 1
626 1 38 ASN HD22 1 44 THR HB . . 4.950 3.165 2.141 4.269 . 0 0 "[ . 1 . 2]" 1
627 1 38 ASN HD22 1 44 THR MG . . 3.460 2.151 1.826 2.424 . 0 0 "[ . 1 . 2]" 1
628 1 39 ALA H 1 39 ALA MB . . 2.900 2.193 2.149 2.241 . 0 0 "[ . 1 . 2]" 1
629 1 39 ALA H 1 40 ASP H . . 3.360 2.837 2.498 3.020 . 0 0 "[ . 1 . 2]" 1
630 1 39 ALA H 1 78 THR HA . . 4.580 3.716 2.954 4.603 0.023 7 0 "[ . 1 . 2]" 1
631 1 39 ALA H 1 78 THR MG . . 3.850 3.558 3.024 3.867 0.017 8 0 "[ . 1 . 2]" 1
632 1 39 ALA HA 1 41 GLY H . . 4.010 3.546 3.257 3.808 . 0 0 "[ . 1 . 2]" 1
633 1 39 ALA HA 1 74 LYS QB . . 3.620 3.524 2.387 3.694 0.074 4 0 "[ . 1 . 2]" 1
634 1 39 ALA HA 1 77 GLU HA . . 5.000 4.612 4.106 5.032 0.032 13 0 "[ . 1 . 2]" 1
635 1 39 ALA MB 1 40 ASP H . . 3.520 2.952 2.688 3.195 . 0 0 "[ . 1 . 2]" 1
636 1 39 ALA MB 1 74 LYS HA . . 5.500 5.327 4.709 5.541 0.041 18 0 "[ . 1 . 2]" 1
637 1 39 ALA MB 1 77 GLU H . . 5.070 4.220 3.533 5.012 . 0 0 "[ . 1 . 2]" 1
638 1 39 ALA MB 1 77 GLU HA . . 3.510 2.612 2.234 3.039 . 0 0 "[ . 1 . 2]" 1
639 1 39 ALA MB 1 78 THR H . . 4.070 3.186 2.593 4.083 0.013 17 0 "[ . 1 . 2]" 1
640 1 40 ASP H 1 40 ASP HB2 . . 3.750 2.853 2.303 3.718 . 0 0 "[ . 1 . 2]" 1
641 1 40 ASP H 1 40 ASP QB . . 3.180 2.437 2.211 2.777 . 0 0 "[ . 1 . 2]" 1
642 1 40 ASP H 1 40 ASP HB3 . . 3.750 3.226 2.269 3.658 . 0 0 "[ . 1 . 2]" 1
643 1 40 ASP H 1 41 GLY H . . 3.220 2.755 2.508 2.981 . 0 0 "[ . 1 . 2]" 1
644 1 40 ASP H 1 41 GLY QA . . 5.110 4.657 4.403 4.824 . 0 0 "[ . 1 . 2]" 1
645 1 40 ASP H 1 42 SER H . . 4.280 4.048 3.506 4.317 0.037 1 0 "[ . 1 . 2]" 1
646 1 40 ASP HA 1 42 SER H . . 4.940 4.769 4.340 5.022 0.082 20 0 "[ . 1 . 2]" 1
647 1 41 GLY H 1 42 SER H . . 3.310 2.665 2.494 2.959 . 0 0 "[ . 1 . 2]" 1
648 1 41 GLY H 1 74 LYS QB . . 4.830 4.290 2.567 4.787 . 0 0 "[ . 1 . 2]" 1
649 1 41 GLY H 1 74 LYS QE . . 4.720 4.232 3.693 4.791 0.071 18 0 "[ . 1 . 2]" 1
650 1 41 GLY H 1 74 LYS HG2 . . 5.090 4.105 3.041 4.803 . 0 0 "[ . 1 . 2]" 1
651 1 41 GLY H 1 74 LYS QG . . 4.400 3.115 2.726 3.381 . 0 0 "[ . 1 . 2]" 1
652 1 41 GLY H 1 74 LYS HG3 . . 5.090 3.747 2.816 5.128 0.038 6 0 "[ . 1 . 2]" 1
653 1 41 GLY QA 1 74 LYS HA . . 4.150 2.943 2.348 4.152 0.002 18 0 "[ . 1 . 2]" 1
654 1 41 GLY QA 1 74 LYS QD . . 4.540 3.084 2.139 4.539 . 0 0 "[ . 1 . 2]" 1
655 1 41 GLY QA 1 74 LYS QG . . 3.800 2.401 2.065 2.745 . 0 0 "[ . 1 . 2]" 1
656 1 41 GLY HA2 1 74 LYS HG2 . . 5.050 3.787 2.144 4.863 . 0 0 "[ . 1 . 2]" 1
657 1 41 GLY HA2 1 74 LYS HG3 . . 5.050 3.142 2.218 4.258 . 0 0 "[ . 1 . 2]" 1
658 1 41 GLY HA3 1 74 LYS HG2 . . 5.050 3.752 2.462 4.669 . 0 0 "[ . 1 . 2]" 1
659 1 41 GLY HA3 1 74 LYS HG3 . . 5.050 3.264 2.584 4.533 . 0 0 "[ . 1 . 2]" 1
660 1 42 SER H 1 42 SER QB . . 2.860 2.606 2.218 2.897 0.037 20 0 "[ . 1 . 2]" 1
661 1 42 SER HA 1 43 VAL H . . 2.700 2.256 2.146 2.435 . 0 0 "[ . 1 . 2]" 1
662 1 42 SER QB 1 43 VAL H . . 3.840 3.046 2.503 3.839 . 0 0 "[ . 1 . 2]" 1
663 1 43 VAL H 1 43 VAL HB . . 2.900 2.827 2.689 2.925 0.025 18 0 "[ . 1 . 2]" 1
664 1 43 VAL H 1 43 VAL QG . . 3.320 2.427 1.963 2.844 . 0 0 "[ . 1 . 2]" 1
665 1 43 VAL HA 1 43 VAL MG1 . . 3.530 2.337 2.233 3.231 . 0 0 "[ . 1 . 2]" 1
666 1 43 VAL HA 1 43 VAL MG2 . . 3.530 2.519 2.410 2.657 . 0 0 "[ . 1 . 2]" 1
667 1 43 VAL HA 1 44 THR H . . 2.940 2.166 2.078 2.214 . 0 0 "[ . 1 . 2]" 1
668 1 43 VAL HB 1 44 THR H . . 4.520 4.049 3.782 4.353 . 0 0 "[ . 1 . 2]" 1
669 1 43 VAL QG 1 44 THR H . . 3.260 2.561 2.253 2.949 . 0 0 "[ . 1 . 2]" 1
670 1 43 VAL QG 1 65 ILE MG . . 4.240 2.131 1.909 2.410 . 0 0 "[ . 1 . 2]" 1
671 1 43 VAL QG 1 72 PHE H . . 4.980 3.957 3.557 4.454 . 0 0 "[ . 1 . 2]" 1
672 1 43 VAL QG 1 72 PHE QB . . 5.250 2.482 2.149 2.881 . 0 0 "[ . 1 . 2]" 1
673 1 43 VAL QG 1 72 PHE QD . . 4.180 2.762 2.357 3.399 . 0 0 "[ . 1 . 2]" 1
674 1 43 VAL MG1 1 44 THR H . . 4.160 2.673 2.263 4.059 . 0 0 "[ . 1 . 2]" 1
675 1 43 VAL MG2 1 44 THR H . . 4.160 4.075 2.388 4.203 0.043 14 0 "[ . 1 . 2]" 1
676 1 44 THR H 1 44 THR MG . . 3.550 2.798 2.501 3.157 . 0 0 "[ . 1 . 2]" 1
677 1 44 THR H 1 45 ASP H . . 4.450 4.459 4.356 4.491 0.041 5 0 "[ . 1 . 2]" 1
678 1 44 THR HA 1 44 THR MG . . 3.370 3.015 2.352 3.254 . 0 0 "[ . 1 . 2]" 1
679 1 44 THR HB 1 45 ASP H . . 3.800 3.408 2.137 3.868 0.068 20 0 "[ . 1 . 2]" 1
680 1 44 THR MG 1 45 ASP H . . 3.900 3.298 2.735 3.902 0.002 10 0 "[ . 1 . 2]" 1
681 1 45 ASP H 1 45 ASP HB2 . . 4.150 3.372 2.997 3.621 . 0 0 "[ . 1 . 2]" 1
682 1 45 ASP H 1 45 ASP HB3 . . 4.150 3.899 3.438 4.157 0.007 12 0 "[ . 1 . 2]" 1
683 1 45 ASP H 1 46 ILE H . . 3.460 2.695 2.522 2.818 . 0 0 "[ . 1 . 2]" 1
684 1 45 ASP H 1 46 ILE HB . . 5.340 5.384 5.351 5.419 0.079 3 0 "[ . 1 . 2]" 1
685 1 45 ASP H 1 46 ILE HG12 . . 4.420 3.707 3.548 3.840 . 0 0 "[ . 1 . 2]" 1
686 1 45 ASP H 1 46 ILE HG13 . . 5.490 5.403 5.214 5.514 0.024 4 0 "[ . 1 . 2]" 1
687 1 45 ASP HA 1 46 ILE H . . 3.100 2.491 2.309 2.733 . 0 0 "[ . 1 . 2]" 1
688 1 45 ASP HA 1 47 LYS H . . 5.500 5.570 5.469 5.624 0.124 18 0 "[ . 1 . 2]" 1
689 1 45 ASP QB 1 46 ILE H . . 4.190 3.981 3.920 4.058 . 0 0 "[ . 1 . 2]" 1
690 1 45 ASP HB2 1 46 ILE H . . 4.770 4.523 4.351 4.645 . 0 0 "[ . 1 . 2]" 1
691 1 45 ASP HB3 1 46 ILE H . . 4.770 4.421 4.326 4.565 . 0 0 "[ . 1 . 2]" 1
692 1 46 ILE H 1 46 ILE HB . . 3.030 2.838 2.698 2.989 . 0 0 "[ . 1 . 2]" 1
693 1 46 ILE H 1 46 ILE MD . . 3.240 2.628 2.396 2.806 . 0 0 "[ . 1 . 2]" 1
694 1 46 ILE H 1 46 ILE HG13 . . 3.770 3.567 3.473 3.671 . 0 0 "[ . 1 . 2]" 1
695 1 46 ILE H 1 46 ILE MG . . 4.220 3.768 3.731 3.816 . 0 0 "[ . 1 . 2]" 1
696 1 46 ILE H 1 47 LYS H . . 4.590 4.501 4.462 4.544 . 0 0 "[ . 1 . 2]" 1
697 1 46 ILE HA 1 46 ILE MD . . 4.550 2.696 2.432 2.875 . 0 0 "[ . 1 . 2]" 1
698 1 46 ILE HA 1 46 ILE MG . . 3.570 2.243 2.186 2.317 . 0 0 "[ . 1 . 2]" 1
699 1 46 ILE HB 1 46 ILE MD . . 3.400 3.274 3.266 3.285 . 0 0 "[ . 1 . 2]" 1
700 1 46 ILE MD 1 65 ILE MG . . 4.120 2.220 2.069 2.658 . 0 0 "[ . 1 . 2]" 1
701 1 46 ILE MD 1 66 LYS H . . 4.610 4.090 3.732 4.452 . 0 0 "[ . 1 . 2]" 1
702 1 46 ILE MD 1 66 LYS HA . . 4.350 3.835 3.368 4.147 . 0 0 "[ . 1 . 2]" 1
703 1 46 ILE HG13 1 63 GLU HA . . 4.760 4.729 4.432 4.845 0.085 4 0 "[ . 1 . 2]" 1
704 1 46 ILE HG13 1 66 LYS H . . 4.190 3.702 2.973 4.210 0.020 6 0 "[ . 1 . 2]" 1
705 1 46 ILE HG13 1 66 LYS HA . . 4.720 4.332 3.718 4.789 0.069 5 0 "[ . 1 . 2]" 1
706 1 46 ILE MG 1 47 LYS H . . 3.490 2.853 2.649 3.045 . 0 0 "[ . 1 . 2]" 1
707 1 46 ILE MG 1 63 GLU HA . . 4.560 4.502 4.105 4.630 0.070 15 0 "[ . 1 . 2]" 1
708 1 46 ILE MG 1 65 ILE MG . . 3.960 3.074 2.698 3.344 . 0 0 "[ . 1 . 2]" 1
709 1 47 LYS H 1 47 LYS QE . . 5.340 4.320 3.111 5.128 . 0 0 "[ . 1 . 2]" 1
710 1 47 LYS H 1 47 LYS HG2 . . 4.220 2.528 2.267 3.134 . 0 0 "[ . 1 . 2]" 1
711 1 47 LYS H 1 47 LYS QG . . 3.570 2.498 2.218 3.058 . 0 0 "[ . 1 . 2]" 1
712 1 47 LYS H 1 47 LYS HG3 . . 4.220 3.986 2.984 4.254 0.034 5 0 "[ . 1 . 2]" 1
713 1 47 LYS HA 1 48 VAL H . . 3.140 2.233 2.116 2.350 . 0 0 "[ . 1 . 2]" 1
714 1 47 LYS QB 1 48 VAL H . . 4.030 2.780 2.489 3.092 . 0 0 "[ . 1 . 2]" 1
715 1 47 LYS HG2 1 48 VAL H . . 4.900 4.479 4.099 4.925 0.025 18 0 "[ . 1 . 2]" 1
716 1 47 LYS HG3 1 48 VAL H . . 4.900 4.595 4.106 4.924 0.024 1 0 "[ . 1 . 2]" 1
717 1 48 VAL H 1 48 VAL HB . . 3.010 2.593 2.427 2.745 . 0 0 "[ . 1 . 2]" 1
718 1 48 VAL H 1 48 VAL MG1 . . 3.960 3.859 3.806 3.926 . 0 0 "[ . 1 . 2]" 1
719 1 48 VAL H 1 48 VAL QG . . 3.030 2.265 2.053 2.559 . 0 0 "[ . 1 . 2]" 1
720 1 48 VAL H 1 48 VAL MG2 . . 3.960 2.282 2.060 2.598 . 0 0 "[ . 1 . 2]" 1
721 1 48 VAL H 1 49 VAL H . . 4.660 4.556 4.418 4.657 . 0 0 "[ . 1 . 2]" 1
722 1 48 VAL HA 1 48 VAL MG1 . . 3.520 2.404 2.321 2.487 . 0 0 "[ . 1 . 2]" 1
723 1 48 VAL HA 1 48 VAL MG2 . . 3.520 2.457 2.338 2.567 . 0 0 "[ . 1 . 2]" 1
724 1 48 VAL HA 1 49 VAL H . . 3.130 2.134 2.077 2.207 . 0 0 "[ . 1 . 2]" 1
725 1 48 VAL HA 1 49 VAL HB . . 4.820 4.779 4.493 4.842 0.022 9 0 "[ . 1 . 2]" 1
726 1 48 VAL HA 1 50 LYS H . . 5.010 4.078 3.802 4.404 . 0 0 "[ . 1 . 2]" 1
727 1 48 VAL QG 1 49 VAL H . . 3.570 2.579 2.253 2.935 . 0 0 "[ . 1 . 2]" 1
728 1 48 VAL QG 1 50 LYS H . . 3.290 2.623 2.435 2.854 . 0 0 "[ . 1 . 2]" 1
729 1 48 VAL QG 1 51 SER QB . . 3.710 2.834 2.512 3.204 . 0 0 "[ . 1 . 2]" 1
730 1 48 VAL QG 1 58 ASN HB2 . . 4.930 3.197 2.762 3.621 . 0 0 "[ . 1 . 2]" 1
731 1 48 VAL QG 1 58 ASN HB3 . . 4.430 2.121 1.976 2.364 . 0 0 "[ . 1 . 2]" 1
732 1 48 VAL QG 1 58 ASN QD . . 4.710 3.180 2.776 3.595 . 0 0 "[ . 1 . 2]" 1
733 1 49 VAL H 1 49 VAL HB . . 3.590 2.707 2.513 2.838 . 0 0 "[ . 1 . 2]" 1
734 1 49 VAL H 1 49 VAL MG2 . . 3.310 2.329 2.065 2.557 . 0 0 "[ . 1 . 2]" 1
735 1 49 VAL H 1 50 LYS H . . 3.180 2.378 2.188 2.627 . 0 0 "[ . 1 . 2]" 1
736 1 49 VAL H 1 50 LYS HA . . 5.130 4.885 4.627 5.127 . 0 0 "[ . 1 . 2]" 1
737 1 49 VAL HA 1 49 VAL MG1 . . 3.260 2.315 2.256 2.418 . 0 0 "[ . 1 . 2]" 1
738 1 49 VAL HA 1 49 VAL MG2 . . 3.530 2.531 2.453 2.640 . 0 0 "[ . 1 . 2]" 1
739 1 49 VAL HA 1 50 LYS H . . 3.570 3.579 3.561 3.601 0.031 18 0 "[ . 1 . 2]" 1
740 1 49 VAL HB 1 50 LYS H . . 2.940 2.532 2.254 2.803 . 0 0 "[ . 1 . 2]" 1
741 1 50 LYS H 1 50 LYS QD . . 5.340 4.942 4.514 5.344 0.004 2 0 "[ . 1 . 2]" 1
742 1 50 LYS HA 1 51 SER H . . 3.090 2.314 2.244 2.417 . 0 0 "[ . 1 . 2]" 1
743 1 50 LYS HA 1 51 SER QB . . 4.800 4.061 3.933 4.193 . 0 0 "[ . 1 . 2]" 1
744 1 50 LYS QB 1 51 SER H . . 4.130 3.414 2.369 3.710 . 0 0 "[ . 1 . 2]" 1
745 1 50 LYS HB2 1 51 SER H . . 4.710 3.997 2.393 4.418 . 0 0 "[ . 1 . 2]" 1
746 1 50 LYS HB3 1 51 SER H . . 4.710 3.834 2.680 4.147 . 0 0 "[ . 1 . 2]" 1
747 1 50 LYS QG 1 51 SER H . . 4.010 2.589 1.897 3.592 . 0 0 "[ . 1 . 2]" 1
748 1 50 LYS HG2 1 51 SER H . . 4.650 3.183 1.909 4.691 0.041 5 0 "[ . 1 . 2]" 1
749 1 50 LYS HG3 1 51 SER H . . 4.650 3.002 2.179 4.727 0.077 1 0 "[ . 1 . 2]" 1
750 1 51 SER H 1 51 SER QB . . 3.630 2.670 2.572 2.805 . 0 0 "[ . 1 . 2]" 1
751 1 51 SER H 1 58 ASN HD21 . . 5.450 5.492 5.422 5.550 0.100 11 0 "[ . 1 . 2]" 1
752 1 51 SER H 1 58 ASN QD . . 4.680 4.624 4.369 4.701 0.021 5 0 "[ . 1 . 2]" 1
753 1 51 SER H 1 58 ASN HD22 . . 5.450 4.983 4.581 5.134 . 0 0 "[ . 1 . 2]" 1
754 1 51 SER HA 1 52 ASN H . . 3.160 2.280 2.057 2.483 . 0 0 "[ . 1 . 2]" 1
755 1 51 SER QB 1 52 ASN H . . 4.100 3.432 3.087 3.614 . 0 0 "[ . 1 . 2]" 1
756 1 51 SER QB 1 53 THR H . . 4.260 2.974 2.665 3.334 . 0 0 "[ . 1 . 2]" 1
757 1 51 SER QB 1 58 ASN HB2 . . 5.340 4.489 4.307 4.714 . 0 0 "[ . 1 . 2]" 1
758 1 51 SER QB 1 58 ASN QD . . 3.690 2.193 1.946 2.329 . 0 0 "[ . 1 . 2]" 1
759 1 51 SER HB2 1 52 ASN H . . 4.770 3.900 3.610 4.010 . 0 0 "[ . 1 . 2]" 1
760 1 51 SER HB2 1 53 THR H . . 4.870 3.892 3.711 4.264 . 0 0 "[ . 1 . 2]" 1
761 1 51 SER HB2 1 58 ASN HD21 . . 5.210 3.764 3.379 4.303 . 0 0 "[ . 1 . 2]" 1
762 1 51 SER HB2 1 58 ASN HD22 . . 5.210 3.184 2.655 3.443 . 0 0 "[ . 1 . 2]" 1
763 1 51 SER HB3 1 52 ASN H . . 4.770 3.820 3.353 4.245 . 0 0 "[ . 1 . 2]" 1
764 1 51 SER HB3 1 53 THR H . . 4.870 3.094 2.728 3.599 . 0 0 "[ . 1 . 2]" 1
765 1 51 SER HB3 1 58 ASN HD21 . . 5.210 3.269 3.031 3.513 . 0 0 "[ . 1 . 2]" 1
766 1 51 SER HB3 1 58 ASN HD22 . . 5.210 2.303 2.007 2.456 . 0 0 "[ . 1 . 2]" 1
767 1 52 ASN H 1 53 THR H . . 3.410 2.402 2.009 2.703 . 0 0 "[ . 1 . 2]" 1
768 1 52 ASN H 1 53 THR HB . . 5.500 4.174 3.774 4.542 . 0 0 "[ . 1 . 2]" 1
769 1 52 ASN H 1 53 THR MG . . 4.180 3.545 2.854 3.957 . 0 0 "[ . 1 . 2]" 1
770 1 53 THR H 1 53 THR HB . . 3.830 3.103 2.993 3.301 . 0 0 "[ . 1 . 2]" 1
771 1 53 THR H 1 53 THR MG . . 3.290 2.634 2.427 2.772 . 0 0 "[ . 1 . 2]" 1
772 1 53 THR HA 1 54 THR H . . 3.430 2.584 2.439 2.828 . 0 0 "[ . 1 . 2]" 1
773 1 53 THR HB 1 54 THR H . . 3.890 3.645 3.567 3.735 . 0 0 "[ . 1 . 2]" 1
774 1 53 THR HB 1 57 LEU QD . . 4.130 3.933 3.663 4.070 . 0 0 "[ . 1 . 2]" 1
775 1 53 THR MG 1 57 LEU HB2 . . 3.850 2.355 2.101 2.496 . 0 0 "[ . 1 . 2]" 1
776 1 53 THR MG 1 57 LEU QB . . 3.250 2.242 2.028 2.363 . 0 0 "[ . 1 . 2]" 1
777 1 53 THR MG 1 57 LEU HB3 . . 3.850 2.861 2.456 3.144 . 0 0 "[ . 1 . 2]" 1
778 1 53 THR MG 1 57 LEU QD . . 3.570 2.258 2.149 2.452 . 0 0 "[ . 1 . 2]" 1
779 1 53 THR MG 1 58 ASN H . . 3.810 3.603 2.964 3.821 0.011 2 0 "[ . 1 . 2]" 1
780 1 53 THR MG 1 58 ASN HD21 . . 5.290 5.011 4.545 5.335 0.045 19 0 "[ . 1 . 2]" 1
781 1 53 THR MG 1 58 ASN QD . . 4.600 3.680 3.319 4.107 . 0 0 "[ . 1 . 2]" 1
782 1 53 THR MG 1 58 ASN HD22 . . 5.290 3.787 3.411 4.272 . 0 0 "[ . 1 . 2]" 1
783 1 54 THR H 1 54 THR MG . . 3.110 2.037 1.860 2.301 . 0 0 "[ . 1 . 2]" 1
784 1 54 THR HA 1 54 THR MG . . 3.550 2.925 2.583 3.271 . 0 0 "[ . 1 . 2]" 1
785 1 54 THR HA 1 56 ILE MD . . 5.500 5.029 4.297 5.525 0.025 14 0 "[ . 1 . 2]" 1
786 1 54 THR HB 1 55 ASP H . . 3.810 3.254 2.555 3.878 0.068 13 0 "[ . 1 . 2]" 1
787 1 54 THR MG 1 55 ASP H . . 4.490 3.937 3.404 4.300 . 0 0 "[ . 1 . 2]" 1
788 1 55 ASP H 1 55 ASP HB2 . . 4.180 2.876 2.358 3.724 . 0 0 "[ . 1 . 2]" 1
789 1 55 ASP H 1 55 ASP QB . . 3.610 2.521 2.196 2.889 . 0 0 "[ . 1 . 2]" 1
790 1 55 ASP H 1 55 ASP HB3 . . 4.180 3.302 2.279 3.638 . 0 0 "[ . 1 . 2]" 1
791 1 55 ASP H 1 56 ILE H . . 4.560 2.828 2.587 2.981 . 0 0 "[ . 1 . 2]" 1
792 1 55 ASP H 1 56 ILE MD . . 5.400 4.104 3.236 5.073 . 0 0 "[ . 1 . 2]" 1
793 1 55 ASP HA 1 58 ASN H . . 3.530 3.121 2.715 3.404 . 0 0 "[ . 1 . 2]" 1
794 1 55 ASP HA 1 58 ASN HB2 . . 3.350 2.308 2.076 2.793 . 0 0 "[ . 1 . 2]" 1
795 1 55 ASP HA 1 58 ASN HB3 . . 4.390 3.879 3.684 4.201 . 0 0 "[ . 1 . 2]" 1
796 1 55 ASP HA 1 58 ASN HD21 . . 4.450 2.600 2.120 3.366 . 0 0 "[ . 1 . 2]" 1
797 1 55 ASP HA 1 58 ASN QD . . 3.680 2.497 2.084 3.133 . 0 0 "[ . 1 . 2]" 1
798 1 55 ASP HA 1 58 ASN HD22 . . 4.450 3.312 2.783 3.745 . 0 0 "[ . 1 . 2]" 1
799 1 55 ASP QB 1 56 ILE H . . 4.210 3.327 2.739 3.872 . 0 0 "[ . 1 . 2]" 1
800 1 55 ASP HB2 1 56 ILE H . . 4.830 3.575 2.849 4.507 . 0 0 "[ . 1 . 2]" 1
801 1 55 ASP HB3 1 56 ILE H . . 4.830 4.056 3.539 4.571 . 0 0 "[ . 1 . 2]" 1
802 1 56 ILE H 1 56 ILE MD . . 3.790 2.619 1.875 3.473 . 0 0 "[ . 1 . 2]" 1
803 1 56 ILE H 1 56 ILE MG . . 4.410 3.759 3.586 3.814 . 0 0 "[ . 1 . 2]" 1
804 1 56 ILE H 1 57 LEU H . . 3.640 2.651 2.441 2.853 . 0 0 "[ . 1 . 2]" 1
805 1 56 ILE HA 1 56 ILE MD . . 4.330 3.343 2.553 3.981 . 0 0 "[ . 1 . 2]" 1
806 1 56 ILE HA 1 56 ILE HG12 . . 4.030 3.292 2.642 3.710 . 0 0 "[ . 1 . 2]" 1
807 1 56 ILE HA 1 56 ILE QG . . 3.400 2.443 2.293 2.573 . 0 0 "[ . 1 . 2]" 1
808 1 56 ILE HA 1 56 ILE HG13 . . 4.030 2.617 2.320 3.044 . 0 0 "[ . 1 . 2]" 1
809 1 56 ILE HA 1 56 ILE MG . . 3.600 2.540 2.396 2.860 . 0 0 "[ . 1 . 2]" 1
810 1 56 ILE HB 1 56 ILE MD . . 3.370 2.373 2.276 2.503 . 0 0 "[ . 1 . 2]" 1
811 1 56 ILE HB 1 57 LEU H . . 3.920 2.790 2.587 3.093 . 0 0 "[ . 1 . 2]" 1
812 1 56 ILE MG 1 57 LEU H . . 3.660 3.382 2.847 3.616 . 0 0 "[ . 1 . 2]" 1
813 1 56 ILE MG 1 57 LEU HA . . 3.770 3.609 3.242 3.780 0.010 9 0 "[ . 1 . 2]" 1
814 1 56 ILE MG 1 57 LEU QD . . 4.190 3.156 2.616 3.640 . 0 0 "[ . 1 . 2]" 1
815 1 57 LEU H 1 57 LEU QD . . 4.650 3.187 2.424 3.578 . 0 0 "[ . 1 . 2]" 1
816 1 57 LEU H 1 57 LEU HG . . 4.030 3.041 2.384 4.113 0.083 6 0 "[ . 1 . 2]" 1
817 1 57 LEU H 1 58 ASN H . . 3.100 2.559 2.323 2.712 . 0 0 "[ . 1 . 2]" 1
818 1 57 LEU H 1 58 ASN HB2 . . 5.340 4.811 4.531 5.008 . 0 0 "[ . 1 . 2]" 1
819 1 57 LEU H 1 59 HIS H . . 4.400 4.164 3.943 4.318 . 0 0 "[ . 1 . 2]" 1
820 1 57 LEU HA 1 57 LEU MD1 . . 4.640 3.567 2.414 3.882 . 0 0 "[ . 1 . 2]" 1
821 1 57 LEU HA 1 57 LEU QD . . 3.290 2.157 2.016 2.535 . 0 0 "[ . 1 . 2]" 1
822 1 57 LEU HA 1 57 LEU MD2 . . 4.640 2.422 2.024 3.786 . 0 0 "[ . 1 . 2]" 1
823 1 57 LEU HB2 1 58 ASN H . . 3.690 2.711 2.609 2.961 . 0 0 "[ . 1 . 2]" 1
824 1 57 LEU HB3 1 58 ASN H . . 3.690 3.411 2.909 3.652 . 0 0 "[ . 1 . 2]" 1
825 1 57 LEU QD 1 60 ALA H . . 5.300 4.681 4.269 5.145 . 0 0 "[ . 1 . 2]" 1
826 1 57 LEU QD 1 61 ALA H . . 5.440 4.830 4.517 5.435 . 0 0 "[ . 1 . 2]" 1
827 1 57 LEU QD 1 87 TYR H . . 5.440 4.934 4.639 5.246 . 0 0 "[ . 1 . 2]" 1
828 1 57 LEU QD 1 87 TYR QB . . 3.830 2.984 2.602 3.770 . 0 0 "[ . 1 . 2]" 1
829 1 57 LEU QD 1 87 TYR QD . . 3.880 2.662 2.432 2.903 . 0 0 "[ . 1 . 2]" 1
830 1 57 LEU QD 1 87 TYR QE . . 5.200 2.931 2.590 3.409 . 0 0 "[ . 1 . 2]" 1
831 1 57 LEU MD1 1 87 TYR QD . . 5.040 3.234 2.541 5.069 0.029 6 0 "[ . 1 . 2]" 1
832 1 57 LEU MD2 1 87 TYR QD . . 5.040 3.232 2.440 3.748 . 0 0 "[ . 1 . 2]" 1
833 1 58 ASN H 1 58 ASN HB2 . . 3.350 2.675 2.549 2.842 . 0 0 "[ . 1 . 2]" 1
834 1 58 ASN H 1 58 ASN QD . . 4.060 3.584 3.366 3.884 . 0 0 "[ . 1 . 2]" 1
835 1 58 ASN H 1 59 HIS H . . 3.590 2.930 2.805 3.035 . 0 0 "[ . 1 . 2]" 1
836 1 58 ASN H 1 59 HIS QB . . 4.760 4.738 4.585 4.797 0.037 15 0 "[ . 1 . 2]" 1
837 1 58 ASN H 1 61 ALA MB . . 4.580 4.615 4.586 4.652 0.072 12 0 "[ . 1 . 2]" 1
838 1 58 ASN H 1 87 TYR QE . . 4.610 4.649 4.607 4.673 0.063 15 0 "[ . 1 . 2]" 1
839 1 58 ASN HA 1 61 ALA H . . 3.900 3.480 3.240 3.712 . 0 0 "[ . 1 . 2]" 1
840 1 58 ASN HA 1 61 ALA MB . . 3.520 2.572 2.415 2.791 . 0 0 "[ . 1 . 2]" 1
841 1 58 ASN HB2 1 59 HIS H . . 3.810 2.669 2.442 2.855 . 0 0 "[ . 1 . 2]" 1
842 1 58 ASN HB3 1 59 HIS H . . 4.470 3.780 3.530 3.942 . 0 0 "[ . 1 . 2]" 1
843 1 58 ASN QD 1 59 HIS H . . 5.000 4.783 4.658 5.015 0.015 5 0 "[ . 1 . 2]" 1
844 1 59 HIS H 1 59 HIS HB2 . . 3.880 2.290 2.154 2.438 . 0 0 "[ . 1 . 2]" 1
845 1 59 HIS H 1 59 HIS HB3 . . 3.880 3.379 2.685 3.603 . 0 0 "[ . 1 . 2]" 1
846 1 59 HIS H 1 60 ALA H . . 3.980 2.709 2.602 2.784 . 0 0 "[ . 1 . 2]" 1
847 1 59 HIS H 1 60 ALA MB . . 4.910 4.383 4.276 4.476 . 0 0 "[ . 1 . 2]" 1
848 1 59 HIS H 1 61 ALA H . . 4.440 4.354 4.249 4.455 0.015 1 0 "[ . 1 . 2]" 1
849 1 59 HIS H 1 61 ALA MB . . 5.470 4.856 4.729 5.006 . 0 0 "[ . 1 . 2]" 1
850 1 59 HIS HA 1 62 LEU H . . 4.130 3.621 3.288 4.132 0.002 1 0 "[ . 1 . 2]" 1
851 1 59 HIS HA 1 62 LEU QB . . 4.280 3.580 3.199 4.085 . 0 0 "[ . 1 . 2]" 1
852 1 59 HIS HA 1 62 LEU QD . . 3.680 2.088 2.018 2.210 . 0 0 "[ . 1 . 2]" 1
853 1 59 HIS HA 1 62 LEU HG . . 3.620 2.712 2.346 3.178 . 0 0 "[ . 1 . 2]" 1
854 1 59 HIS QB 1 61 ALA H . . 5.340 5.015 4.799 5.319 . 0 0 "[ . 1 . 2]" 1
855 1 59 HIS HB2 1 60 ALA H . . 4.420 3.390 2.973 3.852 . 0 0 "[ . 1 . 2]" 1
856 1 59 HIS HB2 1 60 ALA HA . . 5.500 5.097 4.700 5.575 0.075 11 0 "[ . 1 . 2]" 1
857 1 59 HIS HB3 1 60 ALA H . . 4.420 3.601 2.700 4.150 . 0 0 "[ . 1 . 2]" 1
858 1 59 HIS HB3 1 60 ALA HA . . 5.500 4.399 4.080 4.830 . 0 0 "[ . 1 . 2]" 1
859 1 59 HIS HD2 1 62 LEU QD . . 4.900 3.408 2.350 4.356 . 0 0 "[ . 1 . 2]" 1
860 1 60 ALA H 1 60 ALA MB . . 3.310 2.260 2.212 2.340 . 0 0 "[ . 1 . 2]" 1
861 1 60 ALA H 1 61 ALA H . . 3.370 2.446 2.246 2.711 . 0 0 "[ . 1 . 2]" 1
862 1 60 ALA H 1 62 LEU H . . 4.350 4.018 3.781 4.161 . 0 0 "[ . 1 . 2]" 1
863 1 60 ALA H 1 62 LEU QB . . 5.340 5.387 5.340 5.410 0.070 19 0 "[ . 1 . 2]" 1
864 1 60 ALA HA 1 63 GLU QB . . 3.360 2.616 2.193 2.801 . 0 0 "[ . 1 . 2]" 1
865 1 60 ALA MB 1 63 GLU QB . . 4.250 4.023 3.671 4.255 0.005 12 0 "[ . 1 . 2]" 1
866 1 60 ALA MB 1 87 TYR QE . . 4.310 3.537 3.391 3.859 . 0 0 "[ . 1 . 2]" 1
867 1 61 ALA H 1 61 ALA MB . . 2.790 2.168 2.125 2.221 . 0 0 "[ . 1 . 2]" 1
868 1 61 ALA H 1 62 LEU H . . 3.390 2.864 2.766 2.972 . 0 0 "[ . 1 . 2]" 1
869 1 61 ALA H 1 62 LEU QB . . 5.230 4.733 4.575 4.996 . 0 0 "[ . 1 . 2]" 1
870 1 61 ALA H 1 62 LEU HG . . 5.500 5.077 4.765 5.472 . 0 0 "[ . 1 . 2]" 1
871 1 61 ALA H 1 85 ILE MG . . 5.480 4.621 4.272 5.173 . 0 0 "[ . 1 . 2]" 1
872 1 61 ALA H 1 87 TYR QE . . 4.090 3.684 3.226 4.089 . 0 0 "[ . 1 . 2]" 1
873 1 61 ALA HA 1 64 ALA H . . 3.760 3.530 3.291 3.762 0.002 18 0 "[ . 1 . 2]" 1
874 1 61 ALA HA 1 85 ILE MG . . 4.260 2.677 2.393 3.196 . 0 0 "[ . 1 . 2]" 1
875 1 61 ALA HA 1 87 TYR QE . . 4.740 4.224 3.980 4.495 . 0 0 "[ . 1 . 2]" 1
876 1 61 ALA MB 1 62 LEU H . . 3.280 2.585 2.413 2.709 . 0 0 "[ . 1 . 2]" 1
877 1 61 ALA MB 1 85 ILE H . . 4.560 4.452 4.243 4.633 0.073 6 0 "[ . 1 . 2]" 1
878 1 61 ALA MB 1 85 ILE HB . . 3.400 2.409 2.149 2.664 . 0 0 "[ . 1 . 2]" 1
879 1 61 ALA MB 1 85 ILE MD . . 4.040 3.479 2.192 4.072 0.032 1 0 "[ . 1 . 2]" 1
880 1 61 ALA MB 1 85 ILE MG . . 3.380 2.332 2.164 2.610 . 0 0 "[ . 1 . 2]" 1
881 1 61 ALA MB 1 86 ALA H . . 5.390 5.342 5.157 5.462 0.072 7 0 "[ . 1 . 2]" 1
882 1 61 ALA MB 1 87 TYR QE . . 3.620 2.497 2.215 2.983 . 0 0 "[ . 1 . 2]" 1
883 1 62 LEU H 1 62 LEU HB2 . . 3.750 3.504 3.455 3.579 . 0 0 "[ . 1 . 2]" 1
884 1 62 LEU H 1 62 LEU QB . . 2.870 2.172 2.113 2.315 . 0 0 "[ . 1 . 2]" 1
885 1 62 LEU H 1 62 LEU HB3 . . 3.750 2.194 2.132 2.345 . 0 0 "[ . 1 . 2]" 1
886 1 62 LEU H 1 62 LEU MD1 . . 4.090 4.109 4.031 4.156 0.066 9 0 "[ . 1 . 2]" 1
887 1 62 LEU H 1 62 LEU QD . . 3.350 3.229 3.124 3.350 . 0 0 "[ . 1 . 2]" 1
888 1 62 LEU H 1 62 LEU MD2 . . 4.090 3.377 3.254 3.534 . 0 0 "[ . 1 . 2]" 1
889 1 62 LEU H 1 62 LEU HG . . 3.420 2.856 2.639 3.035 . 0 0 "[ . 1 . 2]" 1
890 1 62 LEU H 1 63 GLU H . . 3.500 2.704 2.569 2.810 . 0 0 "[ . 1 . 2]" 1
891 1 62 LEU H 1 63 GLU HA . . 5.460 5.342 5.233 5.427 . 0 0 "[ . 1 . 2]" 1
892 1 62 LEU H 1 64 ALA H . . 4.310 4.021 3.873 4.153 . 0 0 "[ . 1 . 2]" 1
893 1 62 LEU HA 1 62 LEU MD1 . . 4.520 3.465 3.330 3.592 . 0 0 "[ . 1 . 2]" 1
894 1 62 LEU HA 1 62 LEU QD . . 3.340 3.299 3.202 3.384 0.044 6 0 "[ . 1 . 2]" 1
895 1 62 LEU HA 1 62 LEU MD2 . . 4.520 4.145 4.132 4.160 . 0 0 "[ . 1 . 2]" 1
896 1 62 LEU HA 1 65 ILE HB . . 4.490 3.807 3.367 4.099 . 0 0 "[ . 1 . 2]" 1
897 1 62 LEU HA 1 65 ILE MD . . 4.930 4.429 3.786 4.933 0.003 19 0 "[ . 1 . 2]" 1
898 1 62 LEU QB 1 63 GLU H . . 4.040 3.516 3.393 3.665 . 0 0 "[ . 1 . 2]" 1
899 1 62 LEU HB2 1 63 GLU H . . 4.730 4.175 4.110 4.215 . 0 0 "[ . 1 . 2]" 1
900 1 62 LEU HB3 1 63 GLU H . . 4.730 3.787 3.596 4.040 . 0 0 "[ . 1 . 2]" 1
901 1 62 LEU QD 1 63 GLU H . . 4.500 3.017 2.922 3.127 . 0 0 "[ . 1 . 2]" 1
902 1 62 LEU QD 1 64 ALA H . . 5.440 4.666 4.603 4.758 . 0 0 "[ . 1 . 2]" 1
903 1 62 LEU HG 1 63 GLU H . . 3.230 2.241 2.175 2.373 . 0 0 "[ . 1 . 2]" 1
904 1 62 LEU HG 1 64 ALA H . . 4.750 4.812 4.779 4.834 0.084 5 0 "[ . 1 . 2]" 1
905 1 63 GLU H 1 63 GLU HB2 . . 3.370 2.420 2.064 2.644 . 0 0 "[ . 1 . 2]" 1
906 1 63 GLU H 1 63 GLU QB . . 2.900 2.193 2.047 2.280 . 0 0 "[ . 1 . 2]" 1
907 1 63 GLU H 1 63 GLU HB3 . . 3.370 2.755 2.273 3.506 0.136 6 0 "[ . 1 . 2]" 1
908 1 63 GLU H 1 63 GLU HG2 . . 5.350 4.011 2.550 4.584 . 0 0 "[ . 1 . 2]" 1
909 1 63 GLU H 1 63 GLU QG . . 4.590 3.588 2.457 4.045 . 0 0 "[ . 1 . 2]" 1
910 1 63 GLU H 1 63 GLU HG3 . . 5.350 4.137 2.586 4.584 . 0 0 "[ . 1 . 2]" 1
911 1 63 GLU HA 1 65 ILE H . . 4.200 4.121 3.927 4.230 0.030 13 0 "[ . 1 . 2]" 1
912 1 63 GLU HA 1 66 LYS H . . 3.750 3.218 2.920 3.536 . 0 0 "[ . 1 . 2]" 1
913 1 63 GLU HA 1 66 LYS QB . . 3.310 2.657 2.264 3.191 . 0 0 "[ . 1 . 2]" 1
914 1 63 GLU HA 1 66 LYS QD . . 4.330 4.001 2.313 4.364 0.034 19 0 "[ . 1 . 2]" 1
915 1 63 GLU QB 1 64 ALA H . . 3.280 2.910 2.758 3.104 . 0 0 "[ . 1 . 2]" 1
916 1 64 ALA H 1 64 ALA MB . . 2.830 2.219 2.190 2.283 . 0 0 "[ . 1 . 2]" 1
917 1 64 ALA H 1 65 ILE H . . 3.360 2.773 2.637 2.843 . 0 0 "[ . 1 . 2]" 1
918 1 64 ALA H 1 65 ILE HA . . 5.500 5.445 5.341 5.503 0.003 2 0 "[ . 1 . 2]" 1
919 1 64 ALA H 1 65 ILE QG . . 4.280 4.231 4.050 4.296 0.016 19 0 "[ . 1 . 2]" 1
920 1 64 ALA H 1 66 LYS H . . 4.560 4.351 4.139 4.555 . 0 0 "[ . 1 . 2]" 1
921 1 64 ALA H 1 85 ILE MG . . 5.500 5.333 4.532 5.541 0.041 4 0 "[ . 1 . 2]" 1
922 1 64 ALA HA 1 66 LYS H . . 5.030 4.555 4.305 4.708 . 0 0 "[ . 1 . 2]" 1
923 1 64 ALA MB 1 67 SER H . . 4.960 4.662 4.456 4.839 . 0 0 "[ . 1 . 2]" 1
924 1 65 ILE H 1 65 ILE HB . . 3.280 2.577 2.419 2.753 . 0 0 "[ . 1 . 2]" 1
925 1 65 ILE H 1 65 ILE MD . . 4.470 3.187 2.822 3.423 . 0 0 "[ . 1 . 2]" 1
926 1 65 ILE H 1 65 ILE QG . . 3.270 2.134 1.989 2.229 . 0 0 "[ . 1 . 2]" 1
927 1 65 ILE H 1 65 ILE MG . . 4.190 3.809 3.772 3.831 . 0 0 "[ . 1 . 2]" 1
928 1 65 ILE H 1 66 LYS H . . 3.540 2.713 2.580 2.830 . 0 0 "[ . 1 . 2]" 1
929 1 65 ILE HA 1 65 ILE MD . . 3.760 2.258 2.170 2.371 . 0 0 "[ . 1 . 2]" 1
930 1 65 ILE HA 1 65 ILE MG . . 3.540 2.392 2.292 2.494 . 0 0 "[ . 1 . 2]" 1
931 1 65 ILE HA 1 67 SER H . . 4.810 4.535 4.328 4.810 0.000 10 0 "[ . 1 . 2]" 1
932 1 65 ILE HA 1 68 ALA H . . 4.310 3.605 3.403 3.784 . 0 0 "[ . 1 . 2]" 1
933 1 65 ILE HA 1 68 ALA MB . . 4.480 3.223 2.843 3.837 . 0 0 "[ . 1 . 2]" 1
934 1 65 ILE HA 1 69 ALA H . . 5.220 5.059 4.788 5.245 0.025 5 0 "[ . 1 . 2]" 1
935 1 65 ILE HB 1 66 LYS H . . 4.020 2.490 2.341 2.803 . 0 0 "[ . 1 . 2]" 1
936 1 65 ILE MD 1 65 ILE MG . . 3.060 2.158 2.119 2.191 . 0 0 "[ . 1 . 2]" 1
937 1 65 ILE QG 1 66 LYS H . . 4.210 3.916 3.715 4.158 . 0 0 "[ . 1 . 2]" 1
938 1 65 ILE MG 1 66 LYS H . . 4.150 3.414 3.182 3.606 . 0 0 "[ . 1 . 2]" 1
939 1 65 ILE MG 1 66 LYS HA . . 4.550 3.602 3.298 3.777 . 0 0 "[ . 1 . 2]" 1
940 1 65 ILE MG 1 68 ALA H . . 4.950 4.717 4.386 4.969 0.019 12 0 "[ . 1 . 2]" 1
941 1 66 LYS H 1 66 LYS QB . . 2.960 2.282 2.112 2.526 . 0 0 "[ . 1 . 2]" 1
942 1 66 LYS H 1 66 LYS QD . . 5.340 4.439 3.680 4.680 . 0 0 "[ . 1 . 2]" 1
943 1 66 LYS H 1 66 LYS HE2 . . 5.500 4.374 3.877 5.072 . 0 0 "[ . 1 . 2]" 1
944 1 66 LYS H 1 66 LYS HE3 . . 5.500 5.082 3.893 5.547 0.047 17 0 "[ . 1 . 2]" 1
945 1 66 LYS H 1 66 LYS HG2 . . 5.500 4.111 3.206 4.551 . 0 0 "[ . 1 . 2]" 1
946 1 66 LYS H 1 66 LYS HG3 . . 5.500 3.676 2.161 4.577 . 0 0 "[ . 1 . 2]" 1
947 1 66 LYS H 1 67 SER H . . 3.590 2.720 2.602 2.785 . 0 0 "[ . 1 . 2]" 1
948 1 66 LYS HA 1 69 ALA H . . 4.110 3.560 3.228 3.828 . 0 0 "[ . 1 . 2]" 1
949 1 66 LYS HA 1 69 ALA MB . . 3.860 2.374 2.104 2.656 . 0 0 "[ . 1 . 2]" 1
950 1 66 LYS QB 1 67 SER H . . 3.260 2.616 2.307 2.831 . 0 0 "[ . 1 . 2]" 1
951 1 66 LYS QD 1 67 SER H . . 5.340 5.146 3.629 5.381 0.041 20 0 "[ . 1 . 2]" 1
952 1 66 LYS HE2 1 67 SER H . . 5.500 4.820 3.381 5.597 0.097 9 0 "[ . 1 . 2]" 1
953 1 66 LYS HE3 1 67 SER H . . 5.500 4.930 4.231 5.580 0.080 15 0 "[ . 1 . 2]" 1
954 1 67 SER H 1 67 SER QB . . 3.050 2.410 2.197 2.641 . 0 0 "[ . 1 . 2]" 1
955 1 67 SER H 1 68 ALA H . . 3.180 2.825 2.636 3.026 . 0 0 "[ . 1 . 2]" 1
956 1 67 SER H 1 69 ALA H . . 4.280 4.205 4.013 4.326 0.046 18 0 "[ . 1 . 2]" 1
957 1 67 SER HA 1 68 ALA HA . . 4.990 4.641 4.549 4.700 . 0 0 "[ . 1 . 2]" 1
958 1 67 SER HA 1 69 ALA H . . 4.470 3.929 3.720 4.119 . 0 0 "[ . 1 . 2]" 1
959 1 67 SER QB 1 68 ALA H . . 3.460 2.990 2.746 3.519 0.059 12 0 "[ . 1 . 2]" 1
960 1 67 SER QB 1 68 ALA MB . . 4.460 3.805 3.534 4.463 0.003 12 0 "[ . 1 . 2]" 1
961 1 68 ALA H 1 68 ALA MB . . 3.120 2.342 2.251 2.478 . 0 0 "[ . 1 . 2]" 1
962 1 68 ALA H 1 69 ALA H . . 3.110 2.600 2.325 2.848 . 0 0 "[ . 1 . 2]" 1
963 1 68 ALA HA 1 71 LEU QB . . 4.330 3.759 3.450 4.123 . 0 0 "[ . 1 . 2]" 1
964 1 68 ALA HA 1 71 LEU QD . . 3.910 2.803 2.284 3.610 . 0 0 "[ . 1 . 2]" 1
965 1 68 ALA HA 1 71 LEU HG . . 4.720 3.946 2.722 4.728 0.008 5 0 "[ . 1 . 2]" 1
966 1 68 ALA MB 1 71 LEU H . . 4.120 3.956 3.859 4.053 . 0 0 "[ . 1 . 2]" 1
967 1 68 ALA MB 1 71 LEU HB2 . . 4.080 2.908 2.738 3.115 . 0 0 "[ . 1 . 2]" 1
968 1 68 ALA MB 1 71 LEU QB . . 3.320 2.852 2.697 3.027 . 0 0 "[ . 1 . 2]" 1
969 1 68 ALA MB 1 71 LEU HB3 . . 4.080 4.125 4.054 4.172 0.092 14 0 "[ . 1 . 2]" 1
970 1 68 ALA MB 1 71 LEU QD . . 3.260 2.855 2.151 4.002 0.742 10 1 "[ . + . 2]" 1
971 1 68 ALA MB 1 71 LEU HG . . 4.860 3.882 3.411 4.862 0.002 6 0 "[ . 1 . 2]" 1
972 1 68 ALA MB 1 72 PHE H . . 5.500 5.036 4.631 5.296 . 0 0 "[ . 1 . 2]" 1
973 1 68 ALA MB 1 72 PHE QE . . 3.310 2.425 2.214 2.931 . 0 0 "[ . 1 . 2]" 1
974 1 69 ALA H 1 69 ALA MB . . 2.770 2.183 2.146 2.214 . 0 0 "[ . 1 . 2]" 1
975 1 69 ALA H 1 70 HIS H . . 4.510 3.042 2.876 3.216 . 0 0 "[ . 1 . 2]" 1
976 1 69 ALA H 1 70 HIS QB . . 4.920 4.899 4.692 4.970 0.050 7 0 "[ . 1 . 2]" 1
977 1 69 ALA H 1 71 LEU QD . . 5.200 4.971 4.361 5.706 0.506 6 1 "[ .+ 1 . 2]" 1
978 1 69 ALA HA 1 72 PHE H . . 4.080 3.862 3.503 4.123 0.043 7 0 "[ . 1 . 2]" 1
979 1 69 ALA MB 1 70 HIS H . . 4.610 2.862 2.648 3.359 . 0 0 "[ . 1 . 2]" 1
980 1 69 ALA MB 1 70 HIS HA . . 4.970 4.045 3.842 4.347 . 0 0 "[ . 1 . 2]" 1
981 1 69 ALA MB 1 72 PHE H . . 5.500 4.803 4.492 5.227 . 0 0 "[ . 1 . 2]" 1
982 1 70 HIS H 1 71 LEU H . . 3.960 2.673 2.055 2.915 . 0 0 "[ . 1 . 2]" 1
983 1 70 HIS H 1 71 LEU QD . . 5.440 3.997 2.842 4.888 . 0 0 "[ . 1 . 2]" 1
984 1 70 HIS H 1 72 PHE H . . 4.670 4.393 3.752 4.554 . 0 0 "[ . 1 . 2]" 1
985 1 70 HIS HA 1 72 PHE H . . 4.280 3.809 3.314 4.035 . 0 0 "[ . 1 . 2]" 1
986 1 70 HIS QB 1 71 LEU H . . 3.750 3.193 2.853 3.777 0.027 14 0 "[ . 1 . 2]" 1
987 1 70 HIS HB2 1 71 LEU H . . 4.310 3.684 3.149 4.287 . 0 0 "[ . 1 . 2]" 1
988 1 70 HIS HB3 1 71 LEU H . . 4.310 3.757 2.934 4.349 0.039 17 0 "[ . 1 . 2]" 1
989 1 71 LEU H 1 71 LEU HB2 . . 3.610 2.339 2.157 2.546 . 0 0 "[ . 1 . 2]" 1
990 1 71 LEU H 1 71 LEU QB . . 3.010 2.308 2.136 2.499 . 0 0 "[ . 1 . 2]" 1
991 1 71 LEU H 1 71 LEU HB3 . . 3.610 3.552 3.434 3.642 0.032 17 0 "[ . 1 . 2]" 1
992 1 71 LEU H 1 71 LEU QD . . 3.580 2.839 2.221 3.455 . 0 0 "[ . 1 . 2]" 1
993 1 71 LEU H 1 71 LEU HG . . 4.830 3.184 2.287 4.132 . 0 0 "[ . 1 . 2]" 1
994 1 71 LEU H 1 72 PHE H . . 3.000 2.546 2.247 2.664 . 0 0 "[ . 1 . 2]" 1
995 1 71 LEU HA 1 71 LEU QD . . 3.050 2.116 2.004 2.206 . 0 0 "[ . 1 . 2]" 1
996 1 71 LEU QB 1 71 LEU QD . . 2.780 2.027 1.957 2.107 . 0 0 "[ . 1 . 2]" 1
997 1 71 LEU QB 1 72 PHE H . . 3.540 3.313 3.103 3.487 . 0 0 "[ . 1 . 2]" 1
998 1 71 LEU HB2 1 72 PHE H . . 4.210 3.490 3.210 3.761 . 0 0 "[ . 1 . 2]" 1
999 1 71 LEU HB3 1 72 PHE H . . 4.210 4.148 3.828 4.262 0.052 4 0 "[ . 1 . 2]" 1
1000 1 71 LEU QD 1 72 PHE H . . 4.790 4.281 4.015 4.570 . 0 0 "[ . 1 . 2]" 1
1001 1 72 PHE H 1 72 PHE HB2 . . 3.540 2.288 2.170 2.345 . 0 0 "[ . 1 . 2]" 1
1002 1 72 PHE H 1 72 PHE QB . . 2.960 2.261 2.149 2.315 . 0 0 "[ . 1 . 2]" 1
1003 1 72 PHE H 1 72 PHE HB3 . . 3.540 3.540 3.464 3.573 0.033 6 0 "[ . 1 . 2]" 1
1004 1 72 PHE H 1 72 PHE QD . . 3.430 2.436 2.262 2.602 . 0 0 "[ . 1 . 2]" 1
1005 1 72 PHE H 1 73 PRO QD . . 4.920 4.473 4.429 4.505 . 0 0 "[ . 1 . 2]" 1
1006 1 72 PHE HA 1 72 PHE QD . . 3.440 2.914 2.466 3.068 . 0 0 "[ . 1 . 2]" 1
1007 1 72 PHE HA 1 73 PRO HD2 . . 3.470 2.530 2.307 2.669 . 0 0 "[ . 1 . 2]" 1
1008 1 72 PHE HA 1 73 PRO HD3 . . 3.470 2.315 2.213 2.462 . 0 0 "[ . 1 . 2]" 1
1009 1 72 PHE QB 1 73 PRO QD . . 4.100 2.327 2.179 2.851 . 0 0 "[ . 1 . 2]" 1
1010 1 72 PHE QD 1 73 PRO HD2 . . 4.650 2.894 2.535 3.684 . 0 0 "[ . 1 . 2]" 1
1011 1 72 PHE QD 1 73 PRO QD . . 3.880 2.838 2.501 3.481 . 0 0 "[ . 1 . 2]" 1
1012 1 72 PHE QD 1 73 PRO HD3 . . 4.650 4.169 3.843 4.445 . 0 0 "[ . 1 . 2]" 1
1013 1 73 PRO HA 1 74 LYS H . . 2.820 2.326 2.172 2.469 . 0 0 "[ . 1 . 2]" 1
1014 1 73 PRO QB 1 74 LYS H . . 3.630 2.832 2.456 3.263 . 0 0 "[ . 1 . 2]" 1
1015 1 74 LYS H 1 74 LYS QB . . 2.840 2.457 2.300 2.843 0.003 18 0 "[ . 1 . 2]" 1
1016 1 74 LYS H 1 74 LYS HG2 . . 5.040 3.994 3.146 4.483 . 0 0 "[ . 1 . 2]" 1
1017 1 74 LYS H 1 74 LYS QG . . 4.350 3.231 2.153 3.837 . 0 0 "[ . 1 . 2]" 1
1018 1 74 LYS H 1 74 LYS HG3 . . 5.040 3.478 2.167 4.201 . 0 0 "[ . 1 . 2]" 1
1019 1 74 LYS H 1 75 PRO HD2 . . 5.010 4.942 4.789 5.016 0.006 18 0 "[ . 1 . 2]" 1
1020 1 74 LYS H 1 75 PRO HD3 . . 4.580 4.649 4.543 4.745 0.165 18 0 "[ . 1 . 2]" 1
1021 1 74 LYS HA 1 74 LYS QD . . 3.670 3.241 2.612 3.800 0.130 2 0 "[ . 1 . 2]" 1
1022 1 74 LYS HA 1 75 PRO HD2 . . 3.440 2.203 2.051 2.457 . 0 0 "[ . 1 . 2]" 1
1023 1 74 LYS HA 1 75 PRO HD3 . . 3.490 2.354 2.040 2.777 . 0 0 "[ . 1 . 2]" 1
1024 1 74 LYS QG 1 75 PRO HD2 . . 4.460 3.612 3.180 4.399 . 0 0 "[ . 1 . 2]" 1
1025 1 74 LYS HG2 1 75 PRO HD2 . . 5.150 4.501 3.670 5.106 . 0 0 "[ . 1 . 2]" 1
1026 1 74 LYS HG3 1 75 PRO HD2 . . 5.150 4.110 3.262 5.167 0.017 7 0 "[ . 1 . 2]" 1
1027 1 75 PRO HA 1 76 GLU H . . 2.990 2.480 2.373 2.642 . 0 0 "[ . 1 . 2]" 1
1028 1 75 PRO HB2 1 76 GLU H . . 3.250 2.689 2.375 3.023 . 0 0 "[ . 1 . 2]" 1
1029 1 75 PRO HB2 1 77 GLU H . . 3.120 2.634 2.381 3.005 . 0 0 "[ . 1 . 2]" 1
1030 1 75 PRO HB2 1 79 VAL MG2 . . 4.000 2.910 2.202 3.607 . 0 0 "[ . 1 . 2]" 1
1031 1 75 PRO HB3 1 77 GLU H . . 4.720 4.381 4.162 4.725 0.005 13 0 "[ . 1 . 2]" 1
1032 1 75 PRO HB3 1 79 VAL MG2 . . 4.030 3.235 2.177 4.051 0.021 19 0 "[ . 1 . 2]" 1
1033 1 75 PRO HG2 1 77 GLU H . . 4.060 3.709 3.278 4.063 0.003 13 0 "[ . 1 . 2]" 1
1034 1 75 PRO HG2 1 79 VAL H . . 5.430 4.452 3.951 5.047 . 0 0 "[ . 1 . 2]" 1
1035 1 75 PRO HG3 1 79 VAL MG2 . . 4.150 3.559 2.443 4.169 0.019 7 0 "[ . 1 . 2]" 1
1036 1 76 GLU H 1 76 GLU HB2 . . 3.690 2.664 2.374 3.633 . 0 0 "[ . 1 . 2]" 1
1037 1 76 GLU H 1 76 GLU QB . . 2.980 2.433 2.154 2.743 . 0 0 "[ . 1 . 2]" 1
1038 1 76 GLU H 1 76 GLU HB3 . . 3.690 3.258 2.411 3.684 . 0 0 "[ . 1 . 2]" 1
1039 1 76 GLU H 1 76 GLU QG . . 4.940 2.997 2.213 4.051 . 0 0 "[ . 1 . 2]" 1
1040 1 76 GLU H 1 77 GLU H . . 3.170 2.594 2.252 2.828 . 0 0 "[ . 1 . 2]" 1
1041 1 76 GLU H 1 79 VAL MG2 . . 4.940 4.624 3.922 4.990 0.050 13 0 "[ . 1 . 2]" 1
1042 1 76 GLU HA 1 76 GLU QG . . 3.690 2.705 2.281 3.547 . 0 0 "[ . 1 . 2]" 1
1043 1 76 GLU QB 1 77 GLU H . . 3.600 2.845 2.327 3.633 0.033 20 0 "[ . 1 . 2]" 1
1044 1 76 GLU HB2 1 77 GLU H . . 4.240 3.210 2.376 3.992 . 0 0 "[ . 1 . 2]" 1
1045 1 76 GLU HB3 1 77 GLU H . . 4.240 3.592 2.372 4.270 0.030 20 0 "[ . 1 . 2]" 1
1046 1 77 GLU H 1 77 GLU QG . . 4.330 3.169 2.393 4.259 . 0 0 "[ . 1 . 2]" 1
1047 1 77 GLU H 1 79 VAL H . . 5.500 5.154 4.147 5.547 0.047 10 0 "[ . 1 . 2]" 1
1048 1 77 GLU H 1 79 VAL MG1 . . 4.460 3.661 2.909 4.175 . 0 0 "[ . 1 . 2]" 1
1049 1 77 GLU H 1 79 VAL MG2 . . 4.810 4.021 3.467 4.340 . 0 0 "[ . 1 . 2]" 1
1050 1 77 GLU HA 1 77 GLU QG . . 3.710 2.918 2.190 3.521 . 0 0 "[ . 1 . 2]" 1
1051 1 77 GLU HA 1 78 THR H . . 2.760 2.450 2.237 2.685 . 0 0 "[ . 1 . 2]" 1
1052 1 77 GLU QB 1 78 THR H . . 3.260 2.604 2.161 3.149 . 0 0 "[ . 1 . 2]" 1
1053 1 77 GLU HG2 1 78 THR H . . 5.380 4.365 1.954 5.193 . 0 0 "[ . 1 . 2]" 1
1054 1 77 GLU HG3 1 78 THR H . . 5.380 4.447 2.794 5.287 . 0 0 "[ . 1 . 2]" 1
1055 1 78 THR H 1 78 THR HB . . 3.650 2.703 2.293 3.441 . 0 0 "[ . 1 . 2]" 1
1056 1 78 THR H 1 78 THR MG . . 3.570 3.624 3.009 3.698 0.128 6 0 "[ . 1 . 2]" 1
1057 1 78 THR H 1 79 VAL H . . 4.740 4.381 3.863 4.634 . 0 0 "[ . 1 . 2]" 1
1058 1 78 THR HA 1 78 THR MG . . 3.330 2.288 2.140 2.544 . 0 0 "[ . 1 . 2]" 1
1059 1 78 THR HA 1 79 VAL H . . 2.730 2.151 2.032 2.250 . 0 0 "[ . 1 . 2]" 1
1060 1 78 THR HB 1 79 VAL H . . 4.280 4.234 3.630 4.357 0.077 18 0 "[ . 1 . 2]" 1
1061 1 78 THR MG 1 79 VAL H . . 3.560 3.116 2.703 3.621 0.061 20 0 "[ . 1 . 2]" 1
1062 1 79 VAL H 1 79 VAL HB . . 3.910 3.808 3.578 3.936 0.026 15 0 "[ . 1 . 2]" 1
1063 1 79 VAL H 1 79 VAL MG2 . . 2.940 2.247 1.904 2.502 . 0 0 "[ . 1 . 2]" 1
1064 1 79 VAL HA 1 79 VAL MG1 . . 3.460 2.318 2.258 2.389 . 0 0 "[ . 1 . 2]" 1
1065 1 79 VAL HA 1 80 HIS H . . 3.140 2.441 2.070 3.215 0.075 1 0 "[ . 1 . 2]" 1
1066 1 79 VAL MG1 1 80 HIS H . . 3.730 3.599 3.416 3.759 0.029 4 0 "[ . 1 . 2]" 1
1067 1 79 VAL MG2 1 80 HIS H . . 4.080 3.453 2.081 4.082 0.002 10 0 "[ . 1 . 2]" 1
1068 1 79 VAL MG2 1 81 LEU QD . . 2.870 3.084 2.276 3.789 0.919 11 5 "[ - . **1+ .* 2]" 1
1069 1 80 HIS H 1 80 HIS HB2 . . 3.840 3.044 2.367 3.870 0.030 7 0 "[ . 1 . 2]" 1
1070 1 80 HIS H 1 80 HIS QB . . 3.160 2.676 2.337 3.199 0.039 6 0 "[ . 1 . 2]" 1
1071 1 80 HIS H 1 80 HIS HB3 . . 3.840 3.408 2.720 3.862 0.022 1 0 "[ . 1 . 2]" 1
1072 1 80 HIS H 1 80 HIS HD2 . . 4.390 3.639 2.561 4.400 0.010 12 0 "[ . 1 . 2]" 1
1073 1 80 HIS HA 1 81 LEU H . . 2.900 2.219 2.141 2.349 . 0 0 "[ . 1 . 2]" 1
1074 1 80 HIS QB 1 81 LEU H . . 3.720 2.738 2.462 3.255 . 0 0 "[ . 1 . 2]" 1
1075 1 80 HIS HB2 1 81 LEU H . . 4.350 3.424 2.565 4.145 . 0 0 "[ . 1 . 2]" 1
1076 1 80 HIS HB3 1 81 LEU H . . 4.350 3.261 2.499 4.118 . 0 0 "[ . 1 . 2]" 1
1077 1 81 LEU H 1 81 LEU HB2 . . 4.100 2.750 2.573 2.926 . 0 0 "[ . 1 . 2]" 1
1078 1 81 LEU H 1 81 LEU QB . . 3.290 2.692 2.530 2.851 . 0 0 "[ . 1 . 2]" 1
1079 1 81 LEU H 1 81 LEU HB3 . . 4.100 3.838 3.733 3.941 . 0 0 "[ . 1 . 2]" 1
1080 1 81 LEU H 1 81 LEU HG . . 3.970 3.373 2.840 3.960 . 0 0 "[ . 1 . 2]" 1
1081 1 81 LEU H 1 82 LYS H . . 4.440 4.416 4.356 4.466 0.026 10 0 "[ . 1 . 2]" 1
1082 1 81 LEU HA 1 82 LYS H . . 2.920 2.320 2.147 2.438 . 0 0 "[ . 1 . 2]" 1
1083 1 81 LEU QB 1 82 LYS H . . 3.200 2.579 2.331 2.936 . 0 0 "[ . 1 . 2]" 1
1084 1 81 LEU HB2 1 82 LYS H . . 4.030 3.770 3.500 4.036 0.006 6 0 "[ . 1 . 2]" 1
1085 1 81 LEU HB3 1 82 LYS H . . 4.030 2.627 2.362 3.016 . 0 0 "[ . 1 . 2]" 1
1086 1 81 LEU QD 1 82 LYS QB . . 5.280 5.095 4.608 5.600 0.320 14 0 "[ . 1 . 2]" 1
1087 1 82 LYS H 1 82 LYS QB . . 3.390 2.744 2.444 3.333 . 0 0 "[ . 1 . 2]" 1
1088 1 82 LYS H 1 83 ILE H . . 4.760 3.915 3.453 4.438 . 0 0 "[ . 1 . 2]" 1
1089 1 82 LYS HA 1 83 ILE H . . 3.010 2.214 2.007 2.409 . 0 0 "[ . 1 . 2]" 1
1090 1 82 LYS QB 1 83 ILE MD . . 4.730 4.454 4.068 4.744 0.014 16 0 "[ . 1 . 2]" 1
1091 1 82 LYS HB2 1 83 ILE MD . . 5.500 4.912 4.281 5.422 . 0 0 "[ . 1 . 2]" 1
1092 1 82 LYS HB3 1 83 ILE MD . . 5.500 5.198 4.320 5.511 0.011 5 0 "[ . 1 . 2]" 1
1093 1 83 ILE H 1 83 ILE HB . . 3.750 2.553 2.431 2.856 . 0 0 "[ . 1 . 2]" 1
1094 1 83 ILE H 1 83 ILE MD . . 3.920 3.520 3.344 3.929 0.009 6 0 "[ . 1 . 2]" 1
1095 1 83 ILE H 1 83 ILE QG . . 3.830 2.563 2.328 2.931 . 0 0 "[ . 1 . 2]" 1
1096 1 83 ILE H 1 83 ILE MG . . 4.020 3.864 3.801 3.985 . 0 0 "[ . 1 . 2]" 1
1097 1 83 ILE HA 1 83 ILE MD . . 4.280 2.203 2.103 2.441 . 0 0 "[ . 1 . 2]" 1
1098 1 83 ILE HA 1 84 PRO HD2 . . 3.600 2.395 2.212 2.776 . 0 0 "[ . 1 . 2]" 1
1099 1 83 ILE HA 1 84 PRO HD3 . . 3.500 2.289 2.050 2.456 . 0 0 "[ . 1 . 2]" 1
1100 1 83 ILE HB 1 84 PRO HD2 . . 4.970 4.576 4.351 4.982 0.012 6 0 "[ . 1 . 2]" 1
1101 1 83 ILE MD 1 84 PRO QG . . 5.350 4.849 4.607 5.342 . 0 0 "[ . 1 . 2]" 1
1102 1 83 ILE MG 1 84 PRO HD2 . . 3.980 2.457 2.243 2.846 . 0 0 "[ . 1 . 2]" 1
1103 1 84 PRO HA 1 85 ILE H . . 3.060 2.166 2.101 2.331 . 0 0 "[ . 1 . 2]" 1
1104 1 84 PRO HA 1 85 ILE HB . . 4.940 4.535 4.154 4.710 . 0 0 "[ . 1 . 2]" 1
1105 1 84 PRO QB 1 85 ILE H . . 3.710 3.213 2.611 3.661 . 0 0 "[ . 1 . 2]" 1
1106 1 85 ILE H 1 85 ILE HB . . 3.320 2.547 2.387 2.690 . 0 0 "[ . 1 . 2]" 1
1107 1 85 ILE H 1 85 ILE MD . . 3.990 3.467 2.269 4.013 0.023 13 0 "[ . 1 . 2]" 1
1108 1 85 ILE H 1 85 ILE MG . . 4.400 3.840 3.650 3.915 . 0 0 "[ . 1 . 2]" 1
1109 1 85 ILE H 1 86 ALA H . . 4.890 4.481 4.259 4.648 . 0 0 "[ . 1 . 2]" 1
1110 1 85 ILE HA 1 85 ILE MD . . 4.420 2.696 2.069 3.875 . 0 0 "[ . 1 . 2]" 1
1111 1 85 ILE HA 1 85 ILE MG . . 3.690 2.474 2.386 2.793 . 0 0 "[ . 1 . 2]" 1
1112 1 85 ILE HA 1 86 ALA H . . 3.060 2.254 2.103 2.363 . 0 0 "[ . 1 . 2]" 1
1113 1 85 ILE HB 1 85 ILE MD . . 3.480 2.936 2.245 3.292 . 0 0 "[ . 1 . 2]" 1
1114 1 85 ILE HB 1 86 ALA H . . 4.670 4.115 3.967 4.339 . 0 0 "[ . 1 . 2]" 1
1115 1 85 ILE MD 1 85 ILE MG . . 3.070 2.375 2.106 3.069 . 0 0 "[ . 1 . 2]" 1
1116 1 85 ILE HG12 1 86 ALA H . . 5.500 5.026 3.579 5.262 . 0 0 "[ . 1 . 2]" 1
1117 1 85 ILE HG13 1 86 ALA H . . 5.500 5.059 4.340 5.542 0.042 11 0 "[ . 1 . 2]" 1
1118 1 85 ILE MG 1 86 ALA H . . 3.880 2.512 2.254 2.920 . 0 0 "[ . 1 . 2]" 1
1119 1 85 ILE MG 1 87 TYR QD . . 4.710 4.158 3.697 4.638 . 0 0 "[ . 1 . 2]" 1
1120 1 85 ILE MG 1 87 TYR QE . . 5.040 3.691 3.230 4.494 . 0 0 "[ . 1 . 2]" 1
1121 1 86 ALA H 1 86 ALA MB . . 3.400 2.506 2.314 2.666 . 0 0 "[ . 1 . 2]" 1
1122 1 86 ALA H 1 87 TYR H . . 5.210 4.406 4.105 4.543 . 0 0 "[ . 1 . 2]" 1
1123 1 86 ALA HA 1 87 TYR H . . 3.270 2.143 2.064 2.242 . 0 0 "[ . 1 . 2]" 1
1124 1 86 ALA MB 1 87 TYR H . . 3.930 2.973 2.611 3.381 . 0 0 "[ . 1 . 2]" 1
1125 1 87 TYR H 1 87 TYR QB . . 3.630 2.417 2.266 2.610 . 0 0 "[ . 1 . 2]" 1
1126 1 87 TYR H 1 87 TYR QD . . 3.990 3.187 2.907 3.493 . 0 0 "[ . 1 . 2]" 1
1127 1 87 TYR HA 1 87 TYR QD . . 4.550 2.489 2.311 2.740 . 0 0 "[ . 1 . 2]" 1
1128 1 87 TYR HA 1 88 SER H . . 3.260 2.264 2.050 2.552 . 0 0 "[ . 1 . 2]" 1
1129 1 87 TYR HA 1 88 SER HB2 . . 5.500 4.652 4.195 5.597 0.097 1 0 "[ . 1 . 2]" 1
1130 1 87 TYR HA 1 88 SER HB3 . . 5.500 4.543 4.088 5.585 0.085 15 0 "[ . 1 . 2]" 1
1131 1 87 TYR QB 1 88 SER H . . 4.230 2.679 2.162 3.213 . 0 0 "[ . 1 . 2]" 1
1132 1 87 TYR HB2 1 88 SER H . . 5.040 3.972 3.617 4.397 . 0 0 "[ . 1 . 2]" 1
1133 1 87 TYR HB3 1 88 SER H . . 5.040 2.727 2.179 3.303 . 0 0 "[ . 1 . 2]" 1
1134 1 87 TYR QD 1 88 SER H . . 4.890 3.164 2.801 3.825 . 0 0 "[ . 1 . 2]" 1
1135 1 88 SER H 1 88 SER QB . . 3.620 2.728 2.230 3.278 . 0 0 "[ . 1 . 2]" 1
1136 1 88 SER H 1 89 LEU H . . 5.320 4.383 4.187 4.665 . 0 0 "[ . 1 . 2]" 1
1137 1 88 SER HA 1 89 LEU H . . 3.440 2.237 2.071 2.532 . 0 0 "[ . 1 . 2]" 1
1138 1 88 SER HA 1 90 LYS H . . 4.290 3.799 3.124 4.316 0.026 18 0 "[ . 1 . 2]" 1
1139 1 88 SER HB2 1 89 LEU H . . 5.310 3.816 2.484 4.511 . 0 0 "[ . 1 . 2]" 1
1140 1 88 SER HB2 1 90 LYS H . . 5.500 4.190 2.577 5.507 0.007 17 0 "[ . 1 . 2]" 1
1141 1 88 SER HB3 1 89 LEU H . . 5.310 3.929 3.555 4.394 . 0 0 "[ . 1 . 2]" 1
1142 1 88 SER HB3 1 90 LYS H . . 5.500 3.884 2.775 5.027 . 0 0 "[ . 1 . 2]" 1
1143 1 89 LEU H 1 89 LEU QB . . 3.570 2.472 2.183 3.408 . 0 0 "[ . 1 . 2]" 1
1144 1 89 LEU H 1 89 LEU QD . . 5.070 3.027 2.090 3.753 . 0 0 "[ . 1 . 2]" 1
1145 1 89 LEU H 1 89 LEU HG . . 4.570 3.057 2.217 4.558 . 0 0 "[ . 1 . 2]" 1
1146 1 89 LEU H 1 90 LYS H . . 3.720 2.596 1.954 3.308 . 0 0 "[ . 1 . 2]" 1
1147 1 89 LEU HA 1 89 LEU QD . . 3.340 2.509 2.128 3.457 0.117 10 0 "[ . 1 . 2]" 1
1148 1 89 LEU QB 1 89 LEU QD . . 2.860 1.949 1.907 1.990 . 0 0 "[ . 1 . 2]" 1
1149 1 89 LEU QB 1 90 LYS H . . 3.690 3.184 2.594 3.727 0.037 5 0 "[ . 1 . 2]" 1
1150 1 89 LEU HB2 1 90 LYS H . . 4.250 3.512 2.640 4.275 0.025 8 0 "[ . 1 . 2]" 1
1151 1 89 LEU HB3 1 90 LYS H . . 4.250 3.909 2.979 4.312 0.062 14 0 "[ . 1 . 2]" 1
1152 1 89 LEU QD 1 90 LYS H . . 4.590 4.003 2.213 4.516 . 0 0 "[ . 1 . 2]" 1
1153 1 90 LYS H 1 90 LYS QB . . 3.100 2.590 2.139 3.142 0.042 10 0 "[ . 1 . 2]" 1
1154 1 90 LYS H 1 90 LYS HG2 . . 5.250 3.935 2.190 5.236 . 0 0 "[ . 1 . 2]" 1
1155 1 90 LYS H 1 90 LYS QG . . 4.420 3.464 2.164 4.322 . 0 0 "[ . 1 . 2]" 1
1156 1 90 LYS H 1 90 LYS HG3 . . 5.250 4.102 2.989 4.783 . 0 0 "[ . 1 . 2]" 1
1157 1 90 LYS HA 1 91 GLU H . . 2.950 2.298 2.098 2.973 0.023 4 0 "[ . 1 . 2]" 1
1158 1 90 LYS QG 1 91 GLU H . . 4.630 3.617 2.479 4.642 0.012 1 0 "[ . 1 . 2]" 1
1159 1 90 LYS HG2 1 91 GLU H . . 5.390 4.314 2.997 5.173 . 0 0 "[ . 1 . 2]" 1
1160 1 90 LYS HG3 1 91 GLU H . . 5.390 4.110 2.644 5.249 . 0 0 "[ . 1 . 2]" 1
1161 1 91 GLU H 1 91 GLU QB . . 3.410 2.475 2.179 3.066 . 0 0 "[ . 1 . 2]" 1
1162 1 91 GLU HA 1 92 ASP H . . 3.380 2.364 2.130 3.464 0.084 12 0 "[ . 1 . 2]" 1
1163 1 91 GLU QB 1 92 ASP H . . 4.360 3.298 2.382 3.988 . 0 0 "[ . 1 . 2]" 1
1164 1 92 ASP H 1 92 ASP QB . . 3.550 2.512 2.156 2.965 . 0 0 "[ . 1 . 2]" 1
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