NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
542408 |
2lsg   |
18431 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lsg
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 2159
_Distance_constraint_stats_list.Viol_count 1475
_Distance_constraint_stats_list.Viol_total 491.805
_Distance_constraint_stats_list.Viol_max 0.352
_Distance_constraint_stats_list.Viol_rms 0.0062
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0167
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 ALA 0.024 0.024 10 0 "[ . 1 . 2]"
1 9 ALA 0.002 0.002 2 0 "[ . 1 . 2]"
1 10 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 LEU 0.132 0.062 16 0 "[ . 1 . 2]"
1 13 ALA 0.599 0.352 16 0 "[ . 1 . 2]"
1 14 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ALA 0.490 0.352 16 0 "[ . 1 . 2]"
1 16 VAL 0.020 0.015 17 0 "[ . 1 . 2]"
1 17 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 18 PHE 0.106 0.041 17 0 "[ . 1 . 2]"
1 19 SER 0.043 0.041 17 0 "[ . 1 . 2]"
1 20 ASP 0.023 0.010 20 0 "[ . 1 . 2]"
1 21 VAL 0.034 0.024 17 0 "[ . 1 . 2]"
1 22 LYS 0.007 0.002 19 0 "[ . 1 . 2]"
1 23 THR 0.111 0.045 20 0 "[ . 1 . 2]"
1 24 LEU 0.028 0.007 19 0 "[ . 1 . 2]"
1 25 LEU 0.126 0.030 19 0 "[ . 1 . 2]"
1 26 LYS 0.762 0.112 19 0 "[ . 1 . 2]"
1 27 GLU 0.910 0.139 20 0 "[ . 1 . 2]"
1 28 TRP 0.240 0.025 19 0 "[ . 1 . 2]"
1 29 ILE 0.506 0.066 18 0 "[ . 1 . 2]"
1 30 THR 0.245 0.112 19 0 "[ . 1 . 2]"
1 31 THR 1.191 0.264 20 0 "[ . 1 . 2]"
1 32 ILE 0.448 0.159 20 0 "[ . 1 . 2]"
1 33 SER 0.033 0.012 19 0 "[ . 1 . 2]"
1 34 ASP 0.005 0.003 9 0 "[ . 1 . 2]"
1 35 PRO 0.046 0.025 19 0 "[ . 1 . 2]"
1 36 MET 0.117 0.037 11 0 "[ . 1 . 2]"
1 37 GLU 0.417 0.216 11 0 "[ . 1 . 2]"
1 38 GLU 0.145 0.101 11 0 "[ . 1 . 2]"
1 39 ASP 0.095 0.029 11 0 "[ . 1 . 2]"
1 40 ILE 0.471 0.216 11 0 "[ . 1 . 2]"
1 41 LEU 0.399 0.101 11 0 "[ . 1 . 2]"
1 42 GLN 0.076 0.015 19 0 "[ . 1 . 2]"
1 43 VAL 0.112 0.015 11 0 "[ . 1 . 2]"
1 44 VAL 0.262 0.017 16 0 "[ . 1 . 2]"
1 45 ARG 0.085 0.023 16 0 "[ . 1 . 2]"
1 46 TYR 0.296 0.099 16 0 "[ . 1 . 2]"
1 47 CYS 0.154 0.033 13 0 "[ . 1 . 2]"
1 48 THR 0.113 0.029 13 0 "[ . 1 . 2]"
1 49 ASP 0.097 0.032 16 0 "[ . 1 . 2]"
1 50 LEU 0.413 0.099 16 0 "[ . 1 . 2]"
1 51 ILE 0.262 0.015 17 0 "[ . 1 . 2]"
1 52 GLU 0.010 0.007 11 0 "[ . 1 . 2]"
1 53 GLU 0.621 0.026 3 0 "[ . 1 . 2]"
1 54 LYS 1.150 0.062 12 0 "[ . 1 . 2]"
1 55 ASP 0.438 0.038 12 0 "[ . 1 . 2]"
1 56 LEU 1.398 0.061 12 0 "[ . 1 . 2]"
1 57 GLU 0.653 0.157 12 0 "[ . 1 . 2]"
1 58 LYS 1.020 0.157 12 0 "[ . 1 . 2]"
1 59 LEU 1.853 0.098 18 0 "[ . 1 . 2]"
1 60 ASP 1.220 0.098 18 0 "[ . 1 . 2]"
1 61 LEU 0.190 0.048 13 0 "[ . 1 . 2]"
1 62 VAL 0.279 0.011 20 0 "[ . 1 . 2]"
1 63 ILE 0.370 0.025 17 0 "[ . 1 . 2]"
1 64 LYS 0.384 0.105 17 0 "[ . 1 . 2]"
1 65 TYR 0.525 0.059 13 0 "[ . 1 . 2]"
1 66 MET 0.188 0.020 19 0 "[ . 1 . 2]"
1 67 LYS 0.065 0.011 13 0 "[ . 1 . 2]"
1 68 ARG 0.188 0.047 13 0 "[ . 1 . 2]"
1 69 LEU 0.418 0.064 10 0 "[ . 1 . 2]"
1 70 MET 0.465 0.064 10 0 "[ . 1 . 2]"
1 71 GLN 0.592 0.047 10 0 "[ . 1 . 2]"
1 72 GLN 0.737 0.047 10 0 "[ . 1 . 2]"
1 73 SER 2.818 0.195 10 0 "[ . 1 . 2]"
1 74 VAL 3.026 0.195 10 0 "[ . 1 . 2]"
1 75 GLU 0.075 0.016 5 0 "[ . 1 . 2]"
1 76 SER 0.003 0.003 14 0 "[ . 1 . 2]"
1 77 VAL 0.093 0.011 5 0 "[ . 1 . 2]"
1 78 TRP 0.342 0.024 10 0 "[ . 1 . 2]"
1 79 ASN 0.271 0.016 10 0 "[ . 1 . 2]"
1 80 MET 0.060 0.016 10 0 "[ . 1 . 2]"
1 81 ALA 0.132 0.015 12 0 "[ . 1 . 2]"
1 82 PHE 0.162 0.014 17 0 "[ . 1 . 2]"
1 83 ASP 0.021 0.007 10 0 "[ . 1 . 2]"
1 84 PHE 0.100 0.015 12 0 "[ . 1 . 2]"
1 85 ILE 0.138 0.015 13 0 "[ . 1 . 2]"
1 86 LEU 0.698 0.058 14 0 "[ . 1 . 2]"
1 87 ASP 0.524 0.038 1 0 "[ . 1 . 2]"
1 88 ASN 0.535 0.058 14 0 "[ . 1 . 2]"
1 89 VAL 0.677 0.110 13 0 "[ . 1 . 2]"
1 90 GLN 1.041 0.110 13 0 "[ . 1 . 2]"
1 91 VAL 0.568 0.038 1 0 "[ . 1 . 2]"
1 92 VAL 0.093 0.029 13 0 "[ . 1 . 2]"
1 93 LEU 0.060 0.012 17 0 "[ . 1 . 2]"
1 94 GLN 1.110 0.043 17 0 "[ . 1 . 2]"
1 95 GLN 0.190 0.016 10 0 "[ . 1 . 2]"
1 96 THR 2.024 0.083 13 0 "[ . 1 . 2]"
1 97 TYR 2.666 0.083 13 0 "[ . 1 . 2]"
1 98 GLY 0.296 0.038 13 0 "[ . 1 . 2]"
1 99 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 THR 0.074 0.012 17 0 "[ . 1 . 2]"
1 101 LEU 0.566 0.107 13 0 "[ . 1 . 2]"
1 102 LYS 1.973 0.311 15 0 "[ . 1 . 2]"
1 103 VAL 0.640 0.152 18 0 "[ . 1 . 2]"
1 104 THR 1.705 0.311 15 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 ALA H 1 8 ALA MB . . 2.750 2.596 2.343 2.774 0.024 10 0 "[ . 1 . 2]" 1
2 1 8 ALA H 1 9 ALA H . . 4.150 3.823 2.918 4.113 . 0 0 "[ . 1 . 2]" 1
3 1 8 ALA HA 1 9 ALA H . . 2.750 2.256 2.141 2.663 . 0 0 "[ . 1 . 2]" 1
4 1 9 ALA H 1 9 ALA MB . . 3.050 2.099 2.026 2.290 . 0 0 "[ . 1 . 2]" 1
5 1 9 ALA HA 1 10 PRO QD . . 3.290 2.152 2.151 2.153 . 0 0 "[ . 1 . 2]" 1
6 1 9 ALA HA 1 10 PRO QG . . 5.120 4.069 4.067 4.070 . 0 0 "[ . 1 . 2]" 1
7 1 9 ALA MB 1 10 PRO HD2 . . 4.190 2.039 1.949 2.098 . 0 0 "[ . 1 . 2]" 1
8 1 9 ALA MB 1 10 PRO HD3 . . 4.190 3.144 3.100 3.167 . 0 0 "[ . 1 . 2]" 1
9 1 9 ALA MB 1 10 PRO QG . . 4.390 3.459 3.378 3.506 . 0 0 "[ . 1 . 2]" 1
10 1 9 ALA MB 1 42 GLN HE21 . . 5.500 4.885 2.728 5.498 . 0 0 "[ . 1 . 2]" 1
11 1 9 ALA MB 1 42 GLN HE22 . . 5.500 4.849 1.927 5.502 0.002 2 0 "[ . 1 . 2]" 1
12 1 10 PRO QG 1 11 ASN H . . 4.780 3.513 1.950 4.747 . 0 0 "[ . 1 . 2]" 1
13 1 12 LEU H 1 12 LEU QD . . 4.900 3.284 1.946 3.964 . 0 0 "[ . 1 . 2]" 1
14 1 12 LEU H 1 12 LEU HG . . 4.760 3.876 2.231 4.694 . 0 0 "[ . 1 . 2]" 1
15 1 12 LEU H 1 13 ALA MB . . 5.790 4.787 3.819 5.792 0.002 2 0 "[ . 1 . 2]" 1
16 1 12 LEU HA 1 12 LEU MD1 . . 4.220 2.981 2.059 4.104 . 0 0 "[ . 1 . 2]" 1
17 1 12 LEU HA 1 12 LEU QD . . 3.330 2.653 1.981 3.349 0.019 9 0 "[ . 1 . 2]" 1
18 1 12 LEU HA 1 12 LEU MD2 . . 4.220 3.453 2.073 4.094 . 0 0 "[ . 1 . 2]" 1
19 1 12 LEU HA 1 12 LEU HG . . 4.120 3.362 2.440 3.704 . 0 0 "[ . 1 . 2]" 1
20 1 12 LEU QB 1 12 LEU MD1 . . 3.040 2.127 1.930 2.354 . 0 0 "[ . 1 . 2]" 1
21 1 12 LEU QB 1 12 LEU QD . . 2.650 1.878 1.757 1.974 . 0 0 "[ . 1 . 2]" 1
22 1 12 LEU QB 1 12 LEU MD2 . . 3.040 2.104 1.960 2.283 . 0 0 "[ . 1 . 2]" 1
23 1 12 LEU QB 1 13 ALA H . . 4.110 3.024 1.944 3.712 . 0 0 "[ . 1 . 2]" 1
24 1 12 LEU QB 1 13 ALA MB . . 4.410 3.933 3.284 4.423 0.013 17 0 "[ . 1 . 2]" 1
25 1 12 LEU QD 1 13 ALA HA . . 6.070 3.913 2.880 4.781 . 0 0 "[ . 1 . 2]" 1
26 1 12 LEU MD1 1 13 ALA H . . 4.330 3.304 1.854 4.316 . 0 0 "[ . 1 . 2]" 1
27 1 12 LEU MD1 1 13 ALA MB . . 4.210 3.298 1.855 4.217 0.007 17 0 "[ . 1 . 2]" 1
28 1 12 LEU MD2 1 13 ALA H . . 4.330 3.230 1.930 4.312 . 0 0 "[ . 1 . 2]" 1
29 1 12 LEU MD2 1 13 ALA MB . . 4.210 3.523 2.019 4.272 0.062 16 0 "[ . 1 . 2]" 1
30 1 12 LEU HG 1 13 ALA H . . 4.340 2.918 1.947 4.331 . 0 0 "[ . 1 . 2]" 1
31 1 13 ALA H 1 13 ALA MB . . 3.190 2.328 2.024 2.875 . 0 0 "[ . 1 . 2]" 1
32 1 13 ALA H 1 15 ALA H . . 5.110 4.516 3.907 5.224 0.114 16 0 "[ . 1 . 2]" 1
33 1 13 ALA HA 1 16 VAL QG . . 6.530 5.031 3.775 5.925 . 0 0 "[ . 1 . 2]" 1
34 1 13 ALA MB 1 14 GLY H . . 3.830 2.503 2.151 3.500 . 0 0 "[ . 1 . 2]" 1
35 1 13 ALA MB 1 14 GLY QA . . 4.500 3.752 3.617 4.185 . 0 0 "[ . 1 . 2]" 1
36 1 13 ALA MB 1 15 ALA H . . 3.030 2.258 2.116 2.894 . 0 0 "[ . 1 . 2]" 1
37 1 13 ALA MB 1 15 ALA HA . . 3.590 3.549 3.441 3.942 0.352 16 0 "[ . 1 . 2]" 1
38 1 13 ALA MB 1 16 VAL H . . 4.060 3.809 3.078 4.075 0.015 17 0 "[ . 1 . 2]" 1
39 1 13 ALA MB 1 16 VAL QG . . 4.180 3.584 2.445 4.045 . 0 0 "[ . 1 . 2]" 1
40 1 14 GLY H 1 15 ALA H . . 3.900 2.674 2.300 3.466 . 0 0 "[ . 1 . 2]" 1
41 1 14 GLY QA 1 16 VAL QG . . 5.250 3.461 3.099 5.141 . 0 0 "[ . 1 . 2]" 1
42 1 15 ALA H 1 16 VAL MG1 . . 4.870 3.961 3.637 4.222 . 0 0 "[ . 1 . 2]" 1
43 1 15 ALA H 1 16 VAL QG . . 4.010 3.635 3.505 3.762 . 0 0 "[ . 1 . 2]" 1
44 1 15 ALA H 1 16 VAL MG2 . . 4.870 4.270 3.944 4.852 . 0 0 "[ . 1 . 2]" 1
45 1 15 ALA HA 1 16 VAL H . . 3.530 2.647 2.141 2.790 . 0 0 "[ . 1 . 2]" 1
46 1 15 ALA HA 1 16 VAL QG . . 4.240 3.632 3.313 3.753 . 0 0 "[ . 1 . 2]" 1
47 1 15 ALA HA 1 20 ASP HB2 . . 4.610 3.571 2.388 4.610 0.000 16 0 "[ . 1 . 2]" 1
48 1 15 ALA HA 1 20 ASP QB . . 4.040 2.918 2.002 3.514 . 0 0 "[ . 1 . 2]" 1
49 1 15 ALA HA 1 20 ASP HB3 . . 4.610 3.235 2.126 4.396 . 0 0 "[ . 1 . 2]" 1
50 1 15 ALA MB 1 20 ASP HB2 . . 4.130 3.479 2.300 4.128 . 0 0 "[ . 1 . 2]" 1
51 1 15 ALA MB 1 20 ASP QB . . 3.420 2.564 1.896 3.228 . 0 0 "[ . 1 . 2]" 1
52 1 15 ALA MB 1 20 ASP HB3 . . 4.130 2.800 1.909 4.134 0.004 17 0 "[ . 1 . 2]" 1
53 1 15 ALA MB 1 21 VAL HA . . 4.020 3.136 2.162 3.661 . 0 0 "[ . 1 . 2]" 1
54 1 15 ALA MB 1 21 VAL HB . . 5.270 4.323 2.662 4.942 . 0 0 "[ . 1 . 2]" 1
55 1 15 ALA MB 1 21 VAL MG1 . . 4.100 3.795 3.349 4.006 . 0 0 "[ . 1 . 2]" 1
56 1 15 ALA MB 1 21 VAL QG . . 3.290 2.156 1.832 3.130 . 0 0 "[ . 1 . 2]" 1
57 1 15 ALA MB 1 21 VAL MG2 . . 4.100 2.174 1.841 3.272 . 0 0 "[ . 1 . 2]" 1
58 1 15 ALA MB 1 24 LEU QD . . 3.670 3.029 1.943 3.670 0.000 14 0 "[ . 1 . 2]" 1
59 1 16 VAL H 1 16 VAL HB . . 4.100 3.623 3.601 3.754 . 0 0 "[ . 1 . 2]" 1
60 1 16 VAL H 1 16 VAL MG1 . . 3.940 2.286 1.946 2.780 . 0 0 "[ . 1 . 2]" 1
61 1 16 VAL H 1 16 VAL MG2 . . 3.940 2.029 1.906 2.209 . 0 0 "[ . 1 . 2]" 1
62 1 16 VAL HA 1 16 VAL MG1 . . 3.670 2.309 2.188 2.421 . 0 0 "[ . 1 . 2]" 1
63 1 16 VAL HA 1 16 VAL MG2 . . 3.670 3.198 3.186 3.203 . 0 0 "[ . 1 . 2]" 1
64 1 16 VAL QG 1 17 GLU H . . 4.020 2.246 1.988 2.370 . 0 0 "[ . 1 . 2]" 1
65 1 16 VAL MG1 1 17 GLU H . . 4.670 4.020 3.920 4.132 . 0 0 "[ . 1 . 2]" 1
66 1 16 VAL MG2 1 17 GLU H . . 4.670 2.258 1.993 2.387 . 0 0 "[ . 1 . 2]" 1
67 1 17 GLU QB 1 19 SER H . . 4.200 2.915 2.405 3.809 . 0 0 "[ . 1 . 2]" 1
68 1 17 GLU QB 1 20 ASP H . . 4.760 2.706 2.343 3.494 . 0 0 "[ . 1 . 2]" 1
69 1 18 PHE HA 1 18 PHE QD . . 3.290 2.237 2.036 2.737 . 0 0 "[ . 1 . 2]" 1
70 1 18 PHE HA 1 18 PHE QE . . 4.650 4.438 4.300 4.631 . 0 0 "[ . 1 . 2]" 1
71 1 18 PHE HA 1 21 VAL HB . . 3.900 2.883 2.011 3.906 0.006 8 0 "[ . 1 . 2]" 1
72 1 18 PHE HA 1 21 VAL MG1 . . 4.580 3.868 1.856 4.520 . 0 0 "[ . 1 . 2]" 1
73 1 18 PHE HA 1 21 VAL QG . . 3.790 2.304 1.854 2.843 . 0 0 "[ . 1 . 2]" 1
74 1 18 PHE HA 1 21 VAL MG2 . . 4.580 2.569 1.973 4.514 . 0 0 "[ . 1 . 2]" 1
75 1 18 PHE HA 1 58 LYS QE . . 6.700 5.604 4.372 6.593 . 0 0 "[ . 1 . 2]" 1
76 1 18 PHE QB 1 19 SER H . . 3.840 2.769 2.716 2.804 . 0 0 "[ . 1 . 2]" 1
77 1 18 PHE QB 1 58 LYS QE . . 5.190 4.418 2.328 5.118 . 0 0 "[ . 1 . 2]" 1
78 1 18 PHE QD 1 19 SER H . . 4.320 4.138 3.757 4.361 0.041 17 0 "[ . 1 . 2]" 1
79 1 18 PHE QD 1 21 VAL HB . . 4.670 3.025 2.120 4.694 0.024 17 0 "[ . 1 . 2]" 1
80 1 18 PHE QD 1 21 VAL MG1 . . 4.660 3.411 2.200 4.497 . 0 0 "[ . 1 . 2]" 1
81 1 18 PHE QD 1 21 VAL QG . . 3.870 2.935 2.193 3.743 . 0 0 "[ . 1 . 2]" 1
82 1 18 PHE QD 1 21 VAL MG2 . . 4.660 3.385 2.872 4.311 . 0 0 "[ . 1 . 2]" 1
83 1 18 PHE QD 1 22 LYS QD . . 5.090 4.224 3.171 5.029 . 0 0 "[ . 1 . 2]" 1
84 1 18 PHE QD 1 58 LYS QE . . 6.040 5.627 3.896 6.040 . 0 0 "[ . 1 . 2]" 1
85 1 18 PHE QD 1 61 LEU MD1 . . 5.310 3.292 2.964 3.513 . 0 0 "[ . 1 . 2]" 1
86 1 18 PHE QD 1 61 LEU QD . . 3.960 3.260 2.949 3.466 . 0 0 "[ . 1 . 2]" 1
87 1 18 PHE QD 1 61 LEU MD2 . . 5.310 5.297 5.100 5.316 0.006 20 0 "[ . 1 . 2]" 1
88 1 18 PHE QD 1 62 VAL HA . . 5.030 4.672 4.105 5.017 . 0 0 "[ . 1 . 2]" 1
89 1 18 PHE QD 1 62 VAL QG . . 3.500 2.699 2.147 3.098 . 0 0 "[ . 1 . 2]" 1
90 1 18 PHE QE 1 21 VAL MG1 . . 5.380 3.595 3.029 4.364 . 0 0 "[ . 1 . 2]" 1
91 1 18 PHE QE 1 21 VAL QG . . 4.280 3.480 2.987 4.109 . 0 0 "[ . 1 . 2]" 1
92 1 18 PHE QE 1 21 VAL MG2 . . 5.380 4.743 4.296 5.099 . 0 0 "[ . 1 . 2]" 1
93 1 18 PHE QE 1 22 LYS QD . . 5.120 3.602 2.579 4.193 . 0 0 "[ . 1 . 2]" 1
94 1 18 PHE QE 1 59 LEU HA . . 5.700 5.182 4.466 5.611 . 0 0 "[ . 1 . 2]" 1
95 1 18 PHE QE 1 61 LEU HA . . 5.960 4.933 4.453 5.223 . 0 0 "[ . 1 . 2]" 1
96 1 18 PHE QE 1 61 LEU QB . . 4.170 2.798 2.055 3.140 . 0 0 "[ . 1 . 2]" 1
97 1 18 PHE QE 1 61 LEU MD1 . . 4.750 3.373 2.571 3.697 . 0 0 "[ . 1 . 2]" 1
98 1 18 PHE QE 1 61 LEU QD . . 3.980 3.290 2.553 3.571 . 0 0 "[ . 1 . 2]" 1
99 1 18 PHE QE 1 61 LEU MD2 . . 4.750 4.608 4.344 4.731 . 0 0 "[ . 1 . 2]" 1
100 1 18 PHE QE 1 62 VAL H . . 4.780 3.484 2.790 4.130 . 0 0 "[ . 1 . 2]" 1
101 1 18 PHE QE 1 62 VAL HA . . 3.980 2.518 2.046 2.883 . 0 0 "[ . 1 . 2]" 1
102 1 18 PHE QE 1 62 VAL HB . . 4.670 4.369 4.070 4.657 . 0 0 "[ . 1 . 2]" 1
103 1 18 PHE QE 1 62 VAL QG . . 3.730 2.021 1.893 2.396 . 0 0 "[ . 1 . 2]" 1
104 1 18 PHE QE 1 65 TYR H . . 5.360 5.105 4.711 5.348 . 0 0 "[ . 1 . 2]" 1
105 1 18 PHE HZ 1 61 LEU QB . . 4.340 2.883 2.326 3.508 . 0 0 "[ . 1 . 2]" 1
106 1 18 PHE HZ 1 62 VAL HA . . 4.420 3.409 2.947 3.915 . 0 0 "[ . 1 . 2]" 1
107 1 18 PHE HZ 1 62 VAL QG . . 4.110 3.790 3.401 4.111 0.001 17 0 "[ . 1 . 2]" 1
108 1 18 PHE HZ 1 65 TYR H . . 5.260 4.694 4.061 5.131 . 0 0 "[ . 1 . 2]" 1
109 1 18 PHE HZ 1 65 TYR QB . . 4.440 3.139 2.394 3.574 . 0 0 "[ . 1 . 2]" 1
110 1 19 SER H 1 19 SER QB . . 3.400 2.512 2.230 2.765 . 0 0 "[ . 1 . 2]" 1
111 1 19 SER H 1 20 ASP H . . 4.190 2.686 2.553 2.877 . 0 0 "[ . 1 . 2]" 1
112 1 19 SER HA 1 22 LYS QB . . 5.010 3.434 2.440 4.562 . 0 0 "[ . 1 . 2]" 1
113 1 19 SER HA 1 22 LYS HE2 . . 4.430 2.839 2.004 4.092 . 0 0 "[ . 1 . 2]" 1
114 1 19 SER HA 1 22 LYS QE . . 3.780 2.428 1.978 3.583 . 0 0 "[ . 1 . 2]" 1
115 1 19 SER HA 1 22 LYS HE3 . . 4.430 3.211 2.005 4.431 0.001 4 0 "[ . 1 . 2]" 1
116 1 19 SER HA 1 22 LYS QG . . 5.330 3.028 2.040 4.632 . 0 0 "[ . 1 . 2]" 1
117 1 19 SER QB 1 20 ASP H . . 4.450 2.851 2.381 3.439 . 0 0 "[ . 1 . 2]" 1
118 1 19 SER QB 1 20 ASP HA . . 4.630 4.051 3.840 4.572 . 0 0 "[ . 1 . 2]" 1
119 1 19 SER QB 1 22 LYS QB . . 6.240 4.876 3.914 5.968 . 0 0 "[ . 1 . 2]" 1
120 1 19 SER QB 1 22 LYS HE2 . . 5.010 3.809 2.391 4.918 . 0 0 "[ . 1 . 2]" 1
121 1 19 SER QB 1 22 LYS QE . . 4.310 3.364 2.299 4.312 0.002 19 0 "[ . 1 . 2]" 1
122 1 19 SER QB 1 22 LYS HE3 . . 5.010 4.165 2.352 5.002 . 0 0 "[ . 1 . 2]" 1
123 1 19 SER QB 1 22 LYS QG . . 6.630 4.540 3.595 5.827 . 0 0 "[ . 1 . 2]" 1
124 1 20 ASP H 1 20 ASP QB . . 3.680 2.282 2.160 2.738 . 0 0 "[ . 1 . 2]" 1
125 1 20 ASP HA 1 23 THR HB . . 3.480 3.221 2.662 3.476 . 0 0 "[ . 1 . 2]" 1
126 1 20 ASP HA 1 23 THR MG . . 4.640 4.487 3.927 4.650 0.010 20 0 "[ . 1 . 2]" 1
127 1 21 VAL HA 1 21 VAL MG1 . . 3.690 2.403 2.228 3.201 . 0 0 "[ . 1 . 2]" 1
128 1 21 VAL HA 1 21 VAL MG2 . . 3.690 2.372 2.200 2.435 . 0 0 "[ . 1 . 2]" 1
129 1 21 VAL HA 1 24 LEU QB . . 4.230 2.964 2.414 3.967 . 0 0 "[ . 1 . 2]" 1
130 1 21 VAL HA 1 24 LEU MD1 . . 4.900 4.097 3.394 4.870 . 0 0 "[ . 1 . 2]" 1
131 1 21 VAL HA 1 24 LEU QD . . 3.850 2.904 1.907 3.850 . 0 0 "[ . 1 . 2]" 1
132 1 21 VAL HA 1 24 LEU MD2 . . 4.900 3.190 1.911 4.898 . 0 0 "[ . 1 . 2]" 1
133 1 21 VAL HA 1 25 LEU QD . . 5.950 4.150 3.603 4.669 . 0 0 "[ . 1 . 2]" 1
134 1 21 VAL HA 1 46 TYR QE . . 5.490 4.936 4.456 5.314 . 0 0 "[ . 1 . 2]" 1
135 1 21 VAL QG 1 25 LEU H . . 4.320 3.904 3.667 4.323 0.003 13 0 "[ . 1 . 2]" 1
136 1 21 VAL QG 1 25 LEU QD . . 3.700 2.074 1.777 2.552 . 0 0 "[ . 1 . 2]" 1
137 1 21 VAL QG 1 46 TYR QD . . 4.350 3.348 2.713 3.609 . 0 0 "[ . 1 . 2]" 1
138 1 21 VAL QG 1 46 TYR QE . . 3.680 2.038 1.884 2.272 . 0 0 "[ . 1 . 2]" 1
139 1 21 VAL QG 1 50 LEU QD . . 4.530 3.645 3.192 3.895 . 0 0 "[ . 1 . 2]" 1
140 1 21 VAL QG 1 62 VAL QG . . 3.090 2.034 1.819 2.483 . 0 0 "[ . 1 . 2]" 1
141 1 21 VAL MG1 1 46 TYR QE . . 4.430 2.263 1.923 3.275 . 0 0 "[ . 1 . 2]" 1
142 1 21 VAL MG2 1 46 TYR QE . . 4.430 2.629 1.991 3.086 . 0 0 "[ . 1 . 2]" 1
143 1 22 LYS HA 1 22 LYS HD2 . . 5.030 4.484 4.031 4.839 . 0 0 "[ . 1 . 2]" 1
144 1 22 LYS HA 1 22 LYS QD . . 4.380 4.017 3.364 4.270 . 0 0 "[ . 1 . 2]" 1
145 1 22 LYS HA 1 22 LYS HD3 . . 5.030 4.624 3.474 5.031 0.001 12 0 "[ . 1 . 2]" 1
146 1 22 LYS HA 1 22 LYS QE . . 5.810 4.969 4.345 5.574 . 0 0 "[ . 1 . 2]" 1
147 1 22 LYS HA 1 22 LYS QG . . 3.570 2.811 2.173 3.343 . 0 0 "[ . 1 . 2]" 1
148 1 22 LYS HA 1 25 LEU H . . 4.580 3.726 3.566 3.944 . 0 0 "[ . 1 . 2]" 1
149 1 22 LYS HA 1 25 LEU HB2 . . 4.880 2.853 2.418 3.206 . 0 0 "[ . 1 . 2]" 1
150 1 22 LYS HA 1 25 LEU QB . . 4.100 2.815 2.393 3.163 . 0 0 "[ . 1 . 2]" 1
151 1 22 LYS HA 1 25 LEU HB3 . . 4.880 4.333 3.829 4.845 . 0 0 "[ . 1 . 2]" 1
152 1 22 LYS HA 1 25 LEU MD1 . . 5.460 2.899 2.268 3.404 . 0 0 "[ . 1 . 2]" 1
153 1 22 LYS HA 1 25 LEU QD . . 4.140 2.883 2.263 3.370 . 0 0 "[ . 1 . 2]" 1
154 1 22 LYS HA 1 25 LEU MD2 . . 5.460 5.211 4.770 5.461 0.001 1 0 "[ . 1 . 2]" 1
155 1 22 LYS HA 1 65 TYR QD . . 3.850 2.804 2.381 3.325 . 0 0 "[ . 1 . 2]" 1
156 1 22 LYS HA 1 65 TYR QE . . 3.660 3.056 2.275 3.661 0.001 8 0 "[ . 1 . 2]" 1
157 1 22 LYS QB 1 22 LYS QE . . 3.890 2.907 2.042 3.628 . 0 0 "[ . 1 . 2]" 1
158 1 22 LYS QB 1 23 THR H . . 3.690 2.995 2.374 3.486 . 0 0 "[ . 1 . 2]" 1
159 1 22 LYS QD 1 23 THR H . . 5.330 4.750 4.092 5.312 . 0 0 "[ . 1 . 2]" 1
160 1 22 LYS QD 1 65 TYR QD . . 5.070 4.179 3.284 5.018 . 0 0 "[ . 1 . 2]" 1
161 1 22 LYS QD 1 65 TYR QE . . 4.960 3.493 2.815 4.227 . 0 0 "[ . 1 . 2]" 1
162 1 22 LYS QE 1 22 LYS QG . . 3.250 2.165 2.035 2.385 . 0 0 "[ . 1 . 2]" 1
163 1 22 LYS HE2 1 22 LYS HG2 . . 4.230 3.217 2.328 4.150 . 0 0 "[ . 1 . 2]" 1
164 1 22 LYS HE2 1 22 LYS HG3 . . 4.230 2.956 2.217 4.224 . 0 0 "[ . 1 . 2]" 1
165 1 22 LYS HE3 1 22 LYS HG2 . . 4.230 3.330 2.300 3.910 . 0 0 "[ . 1 . 2]" 1
166 1 22 LYS HE3 1 22 LYS HG3 . . 4.230 2.813 2.123 4.184 . 0 0 "[ . 1 . 2]" 1
167 1 22 LYS QG 1 23 THR H . . 4.430 3.148 1.958 4.364 . 0 0 "[ . 1 . 2]" 1
168 1 23 THR H 1 23 THR HB . . 3.740 2.576 2.487 2.784 . 0 0 "[ . 1 . 2]" 1
169 1 23 THR H 1 24 LEU H . . 4.300 2.654 2.383 2.816 . 0 0 "[ . 1 . 2]" 1
170 1 23 THR H 1 25 LEU H . . 4.670 3.954 3.742 4.297 . 0 0 "[ . 1 . 2]" 1
171 1 23 THR HA 1 23 THR MG . . 3.170 2.317 2.198 2.415 . 0 0 "[ . 1 . 2]" 1
172 1 23 THR HA 1 25 LEU H . . 4.430 4.206 4.017 4.429 . 0 0 "[ . 1 . 2]" 1
173 1 23 THR HA 1 26 LYS H . . 4.080 3.446 3.149 3.637 . 0 0 "[ . 1 . 2]" 1
174 1 23 THR HA 1 26 LYS HB2 . . 4.400 3.234 2.483 3.980 . 0 0 "[ . 1 . 2]" 1
175 1 23 THR HA 1 26 LYS QB . . 3.770 2.656 2.355 3.205 . 0 0 "[ . 1 . 2]" 1
176 1 23 THR HA 1 26 LYS HB3 . . 4.400 3.211 2.401 4.406 0.006 4 0 "[ . 1 . 2]" 1
177 1 23 THR HA 1 27 GLU H . . 4.120 3.913 3.562 4.115 . 0 0 "[ . 1 . 2]" 1
178 1 23 THR HB 1 25 LEU H . . 5.400 4.827 4.580 5.129 . 0 0 "[ . 1 . 2]" 1
179 1 23 THR MG 1 26 LYS H . . 4.880 4.675 4.291 4.883 0.003 1 0 "[ . 1 . 2]" 1
180 1 23 THR MG 1 27 GLU QB . . 4.470 3.495 2.762 4.047 . 0 0 "[ . 1 . 2]" 1
181 1 23 THR MG 1 27 GLU HG2 . . 4.530 3.507 2.786 4.267 . 0 0 "[ . 1 . 2]" 1
182 1 23 THR MG 1 27 GLU QG . . 3.950 2.829 2.022 3.524 . 0 0 "[ . 1 . 2]" 1
183 1 23 THR MG 1 27 GLU HG3 . . 4.530 3.291 2.033 4.575 0.045 20 0 "[ . 1 . 2]" 1
184 1 24 LEU H 1 25 LEU H . . 3.930 2.708 2.499 2.796 . 0 0 "[ . 1 . 2]" 1
185 1 24 LEU HA 1 24 LEU MD1 . . 4.260 3.280 2.501 3.649 . 0 0 "[ . 1 . 2]" 1
186 1 24 LEU HA 1 24 LEU QD . . 3.440 2.948 2.004 3.340 . 0 0 "[ . 1 . 2]" 1
187 1 24 LEU HA 1 24 LEU MD2 . . 4.260 3.656 2.025 4.112 . 0 0 "[ . 1 . 2]" 1
188 1 24 LEU HA 1 26 LYS H . . 5.000 4.689 4.375 4.887 . 0 0 "[ . 1 . 2]" 1
189 1 24 LEU QB 1 24 LEU QD . . 2.840 1.813 1.762 1.943 . 0 0 "[ . 1 . 2]" 1
190 1 24 LEU QB 1 25 LEU H . . 4.150 2.912 2.471 3.504 . 0 0 "[ . 1 . 2]" 1
191 1 24 LEU QD 1 25 LEU H . . 4.940 3.252 2.793 3.895 . 0 0 "[ . 1 . 2]" 1
192 1 24 LEU QD 1 25 LEU QD . . 3.690 3.076 2.472 3.691 0.001 8 0 "[ . 1 . 2]" 1
193 1 24 LEU QD 1 28 TRP HB3 . . 5.040 3.782 3.217 4.563 . 0 0 "[ . 1 . 2]" 1
194 1 24 LEU QD 1 43 VAL HA . . 4.520 4.508 4.435 4.527 0.007 19 0 "[ . 1 . 2]" 1
195 1 24 LEU QD 1 43 VAL MG1 . . 4.020 3.444 2.972 3.832 . 0 0 "[ . 1 . 2]" 1
196 1 25 LEU H 1 25 LEU QB . . 3.050 2.188 2.117 2.291 . 0 0 "[ . 1 . 2]" 1
197 1 25 LEU H 1 25 LEU MD1 . . 4.130 3.580 3.273 3.901 . 0 0 "[ . 1 . 2]" 1
198 1 25 LEU H 1 25 LEU QD . . 3.570 3.344 3.153 3.527 . 0 0 "[ . 1 . 2]" 1
199 1 25 LEU H 1 25 LEU MD2 . . 4.130 4.035 3.829 4.129 . 0 0 "[ . 1 . 2]" 1
200 1 25 LEU H 1 25 LEU HG . . 3.240 2.968 2.712 3.188 . 0 0 "[ . 1 . 2]" 1
201 1 25 LEU H 1 26 LYS H . . 3.570 2.549 2.402 2.678 . 0 0 "[ . 1 . 2]" 1
202 1 25 LEU H 1 26 LYS QB . . 4.900 4.268 4.181 4.379 . 0 0 "[ . 1 . 2]" 1
203 1 25 LEU H 1 65 TYR QD . . 5.180 5.086 4.712 5.210 0.030 19 0 "[ . 1 . 2]" 1
204 1 25 LEU HA 1 25 LEU MD1 . . 4.390 3.832 3.803 3.873 . 0 0 "[ . 1 . 2]" 1
205 1 25 LEU HA 1 25 LEU QD . . 3.320 2.293 2.161 2.482 . 0 0 "[ . 1 . 2]" 1
206 1 25 LEU HA 1 25 LEU MD2 . . 4.390 2.311 2.174 2.515 . 0 0 "[ . 1 . 2]" 1
207 1 25 LEU HA 1 25 LEU HG . . 4.080 2.685 2.536 2.871 . 0 0 "[ . 1 . 2]" 1
208 1 25 LEU HA 1 28 TRP HB2 . . 4.800 3.699 3.396 4.038 . 0 0 "[ . 1 . 2]" 1
209 1 25 LEU HA 1 28 TRP HB3 . . 4.810 2.590 2.241 2.984 . 0 0 "[ . 1 . 2]" 1
210 1 25 LEU HA 1 29 ILE MD . . 4.660 3.714 3.303 4.061 . 0 0 "[ . 1 . 2]" 1
211 1 25 LEU QB 1 26 LYS H . . 3.440 2.549 2.442 2.741 . 0 0 "[ . 1 . 2]" 1
212 1 25 LEU QB 1 29 ILE MD . . 4.940 2.658 2.134 3.270 . 0 0 "[ . 1 . 2]" 1
213 1 25 LEU QB 1 65 TYR QD . . 4.510 2.943 2.566 3.177 . 0 0 "[ . 1 . 2]" 1
214 1 25 LEU QB 1 65 TYR QE . . 3.890 3.626 2.957 3.891 0.001 9 0 "[ . 1 . 2]" 1
215 1 25 LEU QB 1 69 LEU MD1 . . 5.470 2.692 2.228 3.217 . 0 0 "[ . 1 . 2]" 1
216 1 25 LEU HB2 1 65 TYR QD . . 5.220 3.188 3.022 3.384 . 0 0 "[ . 1 . 2]" 1
217 1 25 LEU HB2 1 65 TYR QE . . 4.590 3.843 3.179 4.214 . 0 0 "[ . 1 . 2]" 1
218 1 25 LEU HB3 1 65 TYR QD . . 5.220 3.498 2.769 3.849 . 0 0 "[ . 1 . 2]" 1
219 1 25 LEU HB3 1 65 TYR QE . . 4.590 4.459 3.519 4.597 0.007 20 0 "[ . 1 . 2]" 1
220 1 25 LEU QD 1 26 LYS H . . 4.180 4.036 3.951 4.175 . 0 0 "[ . 1 . 2]" 1
221 1 25 LEU QD 1 28 TRP HB2 . . 5.250 4.635 4.354 4.964 . 0 0 "[ . 1 . 2]" 1
222 1 25 LEU QD 1 28 TRP HB3 . . 4.480 3.647 3.292 4.042 . 0 0 "[ . 1 . 2]" 1
223 1 25 LEU QD 1 28 TRP HE3 . . 4.170 2.443 1.902 3.034 . 0 0 "[ . 1 . 2]" 1
224 1 25 LEU QD 1 28 TRP HH2 . . 5.580 4.868 4.343 5.580 0.000 2 0 "[ . 1 . 2]" 1
225 1 25 LEU QD 1 28 TRP HZ3 . . 4.120 3.045 2.432 3.806 . 0 0 "[ . 1 . 2]" 1
226 1 25 LEU QD 1 29 ILE MD . . 3.720 2.889 2.171 3.481 . 0 0 "[ . 1 . 2]" 1
227 1 25 LEU QD 1 62 VAL HA . . 4.560 3.661 3.086 4.116 . 0 0 "[ . 1 . 2]" 1
228 1 25 LEU QD 1 65 TYR QD . . 3.480 2.879 2.061 3.249 . 0 0 "[ . 1 . 2]" 1
229 1 25 LEU QD 1 65 TYR QE . . 4.530 4.330 3.487 4.534 0.004 18 0 "[ . 1 . 2]" 1
230 1 25 LEU QD 1 66 MET H . . 4.560 3.978 3.494 4.427 . 0 0 "[ . 1 . 2]" 1
231 1 25 LEU QD 1 66 MET QG . . 4.970 2.074 1.724 2.999 . 0 0 "[ . 1 . 2]" 1
232 1 25 LEU QD 1 69 LEU MD1 . . 5.050 3.275 2.624 3.763 . 0 0 "[ . 1 . 2]" 1
233 1 25 LEU MD1 1 26 LYS H . . 4.910 4.426 4.262 4.571 . 0 0 "[ . 1 . 2]" 1
234 1 25 LEU MD1 1 29 ILE MD . . 4.890 4.191 3.440 4.752 . 0 0 "[ . 1 . 2]" 1
235 1 25 LEU MD2 1 26 LYS H . . 4.910 4.659 4.512 4.843 . 0 0 "[ . 1 . 2]" 1
236 1 25 LEU MD2 1 29 ILE MD . . 4.890 2.949 2.195 3.579 . 0 0 "[ . 1 . 2]" 1
237 1 25 LEU HG 1 26 LYS H . . 4.840 4.700 4.535 4.782 . 0 0 "[ . 1 . 2]" 1
238 1 26 LYS H 1 26 LYS HB2 . . 4.200 2.367 2.091 2.740 . 0 0 "[ . 1 . 2]" 1
239 1 26 LYS H 1 26 LYS QB . . 3.380 2.195 2.061 2.260 . 0 0 "[ . 1 . 2]" 1
240 1 26 LYS H 1 26 LYS HB3 . . 4.200 2.896 2.354 3.522 . 0 0 "[ . 1 . 2]" 1
241 1 26 LYS H 1 26 LYS QD . . 4.870 4.348 4.160 4.644 . 0 0 "[ . 1 . 2]" 1
242 1 26 LYS H 1 26 LYS QG . . 4.260 3.614 2.750 4.024 . 0 0 "[ . 1 . 2]" 1
243 1 26 LYS H 1 27 GLU H . . 3.860 2.684 2.502 2.830 . 0 0 "[ . 1 . 2]" 1
244 1 26 LYS H 1 27 GLU QB . . 4.820 4.670 4.443 4.881 0.061 20 0 "[ . 1 . 2]" 1
245 1 26 LYS H 1 65 TYR QD . . 5.030 4.421 3.994 4.783 . 0 0 "[ . 1 . 2]" 1
246 1 26 LYS H 1 65 TYR QE . . 4.260 3.478 3.003 3.889 . 0 0 "[ . 1 . 2]" 1
247 1 26 LYS H 1 69 LEU MD1 . . 4.140 3.469 3.228 3.980 . 0 0 "[ . 1 . 2]" 1
248 1 26 LYS H 1 69 LEU MD2 . . 5.240 4.827 4.092 5.244 0.004 18 0 "[ . 1 . 2]" 1
249 1 26 LYS HA 1 26 LYS HD2 . . 4.060 2.872 2.492 4.017 . 0 0 "[ . 1 . 2]" 1
250 1 26 LYS HA 1 26 LYS QD . . 3.570 2.646 2.300 3.435 . 0 0 "[ . 1 . 2]" 1
251 1 26 LYS HA 1 26 LYS HD3 . . 4.060 3.422 2.604 4.098 0.038 20 0 "[ . 1 . 2]" 1
252 1 26 LYS HA 1 26 LYS QE . . 4.360 3.957 1.971 4.377 0.017 19 0 "[ . 1 . 2]" 1
253 1 26 LYS HA 1 26 LYS QG . . 3.480 2.521 2.177 3.083 . 0 0 "[ . 1 . 2]" 1
254 1 26 LYS HA 1 29 ILE H . . 4.210 3.693 3.566 3.832 . 0 0 "[ . 1 . 2]" 1
255 1 26 LYS HA 1 29 ILE HB . . 4.500 3.052 2.778 3.305 . 0 0 "[ . 1 . 2]" 1
256 1 26 LYS HA 1 29 ILE MD . . 4.120 2.734 2.442 2.908 . 0 0 "[ . 1 . 2]" 1
257 1 26 LYS HA 1 29 ILE MG . . 5.290 4.371 4.139 4.580 . 0 0 "[ . 1 . 2]" 1
258 1 26 LYS HA 1 30 THR H . . 4.470 4.367 4.140 4.582 0.112 19 0 "[ . 1 . 2]" 1
259 1 26 LYS HA 1 65 TYR QE . . 5.210 4.225 3.743 4.845 . 0 0 "[ . 1 . 2]" 1
260 1 26 LYS HA 1 69 LEU MD1 . . 3.560 2.271 1.965 3.123 . 0 0 "[ . 1 . 2]" 1
261 1 26 LYS HA 1 69 LEU MD2 . . 4.130 2.850 2.297 3.293 . 0 0 "[ . 1 . 2]" 1
262 1 26 LYS QB 1 26 LYS QD . . 3.090 2.218 2.065 2.643 . 0 0 "[ . 1 . 2]" 1
263 1 26 LYS QB 1 26 LYS QE . . 3.470 3.006 1.966 3.554 0.084 20 0 "[ . 1 . 2]" 1
264 1 26 LYS QB 1 27 GLU H . . 3.220 2.640 2.253 2.862 . 0 0 "[ . 1 . 2]" 1
265 1 26 LYS QB 1 29 ILE HB . . 5.880 4.954 4.662 5.179 . 0 0 "[ . 1 . 2]" 1
266 1 26 LYS QB 1 69 LEU MD1 . . 4.130 3.200 2.664 3.911 . 0 0 "[ . 1 . 2]" 1
267 1 26 LYS QB 1 69 LEU MD2 . . 4.250 3.619 3.370 3.947 . 0 0 "[ . 1 . 2]" 1
268 1 26 LYS HB2 1 26 LYS QE . . 4.240 3.647 3.188 4.126 . 0 0 "[ . 1 . 2]" 1
269 1 26 LYS HB2 1 27 GLU H . . 3.980 3.533 2.838 3.987 0.007 2 0 "[ . 1 . 2]" 1
270 1 26 LYS HB2 1 69 LEU MD1 . . 4.920 3.336 2.706 4.282 . 0 0 "[ . 1 . 2]" 1
271 1 26 LYS HB3 1 26 LYS QE . . 4.240 3.385 1.985 4.276 0.036 20 0 "[ . 1 . 2]" 1
272 1 26 LYS HB3 1 27 GLU H . . 3.980 2.856 2.274 3.452 . 0 0 "[ . 1 . 2]" 1
273 1 26 LYS HB3 1 69 LEU MD1 . . 4.920 4.284 3.983 4.696 . 0 0 "[ . 1 . 2]" 1
274 1 26 LYS QD 1 65 TYR QE . . 4.740 3.783 2.781 4.745 0.005 16 0 "[ . 1 . 2]" 1
275 1 26 LYS QD 1 69 LEU MD2 . . 3.940 2.063 1.777 3.065 . 0 0 "[ . 1 . 2]" 1
276 1 26 LYS HD2 1 65 TYR QE . . 5.480 4.708 3.475 5.369 . 0 0 "[ . 1 . 2]" 1
277 1 26 LYS HD3 1 65 TYR QE . . 5.480 4.153 2.926 5.463 . 0 0 "[ . 1 . 2]" 1
278 1 26 LYS QE 1 26 LYS QG . . 3.310 2.148 1.956 2.732 . 0 0 "[ . 1 . 2]" 1
279 1 26 LYS QE 1 30 THR HB . . 5.980 5.536 4.487 5.983 0.003 15 0 "[ . 1 . 2]" 1
280 1 26 LYS QE 1 30 THR MG . . 3.640 2.976 1.886 3.419 . 0 0 "[ . 1 . 2]" 1
281 1 26 LYS QE 1 65 TYR QE . . 5.360 4.821 4.229 5.362 0.002 4 0 "[ . 1 . 2]" 1
282 1 26 LYS QE 1 69 LEU MD1 . . 5.000 4.237 2.220 4.993 . 0 0 "[ . 1 . 2]" 1
283 1 26 LYS QE 1 69 LEU MD2 . . 4.070 3.036 1.874 3.994 . 0 0 "[ . 1 . 2]" 1
284 1 26 LYS QG 1 27 GLU H . . 4.560 4.025 3.366 4.541 . 0 0 "[ . 1 . 2]" 1
285 1 26 LYS QG 1 27 GLU QG . . 5.320 4.914 3.576 5.340 0.020 4 0 "[ . 1 . 2]" 1
286 1 26 LYS QG 1 65 TYR QE . . 4.470 3.497 2.049 4.473 0.003 10 0 "[ . 1 . 2]" 1
287 1 26 LYS QG 1 69 LEU MD1 . . 3.850 3.048 1.963 3.877 0.027 20 0 "[ . 1 . 2]" 1
288 1 26 LYS QG 1 69 LEU MD2 . . 3.910 2.801 1.875 3.818 . 0 0 "[ . 1 . 2]" 1
289 1 27 GLU H 1 27 GLU QB . . 3.090 2.331 2.166 2.592 . 0 0 "[ . 1 . 2]" 1
290 1 27 GLU H 1 27 GLU QG . . 3.050 2.512 1.937 2.925 . 0 0 "[ . 1 . 2]" 1
291 1 27 GLU H 1 28 TRP H . . 4.660 2.534 2.470 2.774 . 0 0 "[ . 1 . 2]" 1
292 1 27 GLU HA 1 27 GLU HG2 . . 3.970 2.866 2.206 3.739 . 0 0 "[ . 1 . 2]" 1
293 1 27 GLU HA 1 27 GLU QG . . 3.420 2.692 2.168 3.339 . 0 0 "[ . 1 . 2]" 1
294 1 27 GLU HA 1 27 GLU HG3 . . 3.970 3.419 2.622 3.863 . 0 0 "[ . 1 . 2]" 1
295 1 27 GLU HA 1 30 THR H . . 4.610 3.136 3.035 3.232 . 0 0 "[ . 1 . 2]" 1
296 1 27 GLU HA 1 30 THR HB . . 4.360 4.337 4.282 4.360 . 0 0 "[ . 1 . 2]" 1
297 1 27 GLU HA 1 31 THR MG . . 3.810 2.873 2.636 3.949 0.139 20 0 "[ . 1 . 2]" 1
298 1 27 GLU QB 1 28 TRP H . . 4.480 2.863 2.524 3.418 . 0 0 "[ . 1 . 2]" 1
299 1 27 GLU QB 1 29 ILE H . . 4.600 4.474 4.332 4.666 0.066 18 0 "[ . 1 . 2]" 1
300 1 27 GLU QG 1 31 THR MG . . 3.780 3.343 2.733 3.781 0.001 7 0 "[ . 1 . 2]" 1
301 1 27 GLU HG2 1 31 THR MG . . 4.520 3.860 2.777 4.568 0.048 20 0 "[ . 1 . 2]" 1
302 1 27 GLU HG3 1 31 THR MG . . 4.520 4.015 3.139 4.511 . 0 0 "[ . 1 . 2]" 1
303 1 28 TRP H 1 29 ILE H . . 4.170 2.602 2.551 2.651 . 0 0 "[ . 1 . 2]" 1
304 1 28 TRP HA 1 28 TRP HD1 . . 3.560 2.606 2.451 2.746 . 0 0 "[ . 1 . 2]" 1
305 1 28 TRP HA 1 28 TRP HE1 . . 5.090 4.942 4.848 5.002 . 0 0 "[ . 1 . 2]" 1
306 1 28 TRP HA 1 32 ILE MD . . 4.250 4.199 3.534 4.256 0.006 2 0 "[ . 1 . 2]" 1
307 1 28 TRP HA 1 32 ILE QG . . 4.710 2.644 2.295 2.721 . 0 0 "[ . 1 . 2]" 1
308 1 28 TRP HA 1 32 ILE MG . . 4.980 4.861 4.697 4.987 0.007 6 0 "[ . 1 . 2]" 1
309 1 28 TRP HB2 1 29 ILE H . . 4.400 4.220 4.163 4.272 . 0 0 "[ . 1 . 2]" 1
310 1 28 TRP HB3 1 29 ILE H . . 3.960 3.154 3.098 3.212 . 0 0 "[ . 1 . 2]" 1
311 1 28 TRP HB3 1 29 ILE MD . . 5.120 4.250 4.136 4.385 . 0 0 "[ . 1 . 2]" 1
312 1 28 TRP HB3 1 30 THR H . . 5.600 5.222 5.153 5.328 . 0 0 "[ . 1 . 2]" 1
313 1 28 TRP HD1 1 32 ILE HA . . 6.120 5.842 5.460 6.125 0.005 13 0 "[ . 1 . 2]" 1
314 1 28 TRP HD1 1 32 ILE MD . . 3.900 3.835 3.183 3.905 0.005 1 0 "[ . 1 . 2]" 1
315 1 28 TRP HD1 1 32 ILE QG . . 3.760 2.298 2.154 2.455 . 0 0 "[ . 1 . 2]" 1
316 1 28 TRP HD1 1 32 ILE MG . . 4.240 3.833 3.461 4.117 . 0 0 "[ . 1 . 2]" 1
317 1 28 TRP HE1 1 32 ILE MG . . 3.750 3.497 3.282 3.684 . 0 0 "[ . 1 . 2]" 1
318 1 28 TRP HE1 1 35 PRO HA . . 5.120 4.685 3.642 5.145 0.025 19 0 "[ . 1 . 2]" 1
319 1 28 TRP HE1 1 36 MET H . . 5.290 4.995 4.406 5.303 0.013 19 0 "[ . 1 . 2]" 1
320 1 28 TRP HE1 1 39 ASP HA . . 4.650 4.219 3.673 4.659 0.009 10 0 "[ . 1 . 2]" 1
321 1 28 TRP HE1 1 39 ASP HB2 . . 4.560 3.406 2.099 4.242 . 0 0 "[ . 1 . 2]" 1
322 1 28 TRP HE1 1 39 ASP HB3 . . 4.560 2.234 1.949 3.361 . 0 0 "[ . 1 . 2]" 1
323 1 28 TRP HE1 1 40 ILE MD . . 5.490 5.322 4.890 5.502 0.012 10 0 "[ . 1 . 2]" 1
324 1 28 TRP HE3 1 29 ILE MD . . 4.410 3.621 3.361 3.965 . 0 0 "[ . 1 . 2]" 1
325 1 28 TRP HE3 1 43 VAL MG1 . . 4.480 3.092 2.881 3.290 . 0 0 "[ . 1 . 2]" 1
326 1 28 TRP HE3 1 78 TRP HH2 . . 6.470 3.828 3.306 4.400 . 0 0 "[ . 1 . 2]" 1
327 1 28 TRP HH2 1 40 ILE HA . . 4.190 2.903 2.508 3.556 . 0 0 "[ . 1 . 2]" 1
328 1 28 TRP HH2 1 40 ILE MD . . 4.420 4.305 2.676 4.435 0.015 10 0 "[ . 1 . 2]" 1
329 1 28 TRP HH2 1 43 VAL H . . 5.230 5.041 4.832 5.238 0.008 10 0 "[ . 1 . 2]" 1
330 1 28 TRP HH2 1 43 VAL HB . . 5.600 4.674 4.336 5.117 . 0 0 "[ . 1 . 2]" 1
331 1 28 TRP HH2 1 43 VAL MG1 . . 4.030 2.948 2.669 3.553 . 0 0 "[ . 1 . 2]" 1
332 1 28 TRP HH2 1 43 VAL MG2 . . 4.510 2.603 2.374 2.872 . 0 0 "[ . 1 . 2]" 1
333 1 28 TRP HH2 1 70 MET ME . . 4.090 3.534 3.201 3.997 . 0 0 "[ . 1 . 2]" 1
334 1 28 TRP HH2 1 85 ILE MD . . 4.770 2.684 2.125 3.023 . 0 0 "[ . 1 . 2]" 1
335 1 28 TRP HZ2 1 39 ASP HA . . 5.010 4.199 3.799 4.958 . 0 0 "[ . 1 . 2]" 1
336 1 28 TRP HZ2 1 39 ASP HB2 . . 4.530 2.902 2.055 4.469 . 0 0 "[ . 1 . 2]" 1
337 1 28 TRP HZ2 1 39 ASP QB . . 3.910 2.098 1.909 2.849 . 0 0 "[ . 1 . 2]" 1
338 1 28 TRP HZ2 1 39 ASP HB3 . . 4.530 2.242 1.998 4.432 . 0 0 "[ . 1 . 2]" 1
339 1 28 TRP HZ2 1 40 ILE HA . . 4.390 3.373 2.622 4.164 . 0 0 "[ . 1 . 2]" 1
340 1 28 TRP HZ2 1 40 ILE MD . . 4.190 3.579 2.804 3.858 . 0 0 "[ . 1 . 2]" 1
341 1 28 TRP HZ2 1 40 ILE QG . . 4.630 3.137 2.242 4.362 . 0 0 "[ . 1 . 2]" 1
342 1 28 TRP HZ2 1 43 VAL MG1 . . 4.280 3.511 3.015 4.272 . 0 0 "[ . 1 . 2]" 1
343 1 28 TRP HZ2 1 43 VAL MG2 . . 4.170 3.940 3.625 4.175 0.005 11 0 "[ . 1 . 2]" 1
344 1 28 TRP HZ3 1 29 ILE MD . . 5.190 4.353 3.893 4.883 . 0 0 "[ . 1 . 2]" 1
345 1 28 TRP HZ3 1 43 VAL MG1 . . 4.510 2.644 2.473 2.883 . 0 0 "[ . 1 . 2]" 1
346 1 28 TRP HZ3 1 70 MET ME . . 3.890 2.585 2.236 2.903 . 0 0 "[ . 1 . 2]" 1
347 1 29 ILE H 1 29 ILE HB . . 3.330 2.504 2.455 2.521 . 0 0 "[ . 1 . 2]" 1
348 1 29 ILE H 1 29 ILE MD . . 4.000 3.544 3.331 3.676 . 0 0 "[ . 1 . 2]" 1
349 1 29 ILE H 1 29 ILE HG12 . . 4.300 3.915 3.839 4.031 . 0 0 "[ . 1 . 2]" 1
350 1 29 ILE H 1 29 ILE QG . . 3.700 2.519 2.466 2.655 . 0 0 "[ . 1 . 2]" 1
351 1 29 ILE H 1 29 ILE HG13 . . 4.300 2.550 2.496 2.693 . 0 0 "[ . 1 . 2]" 1
352 1 29 ILE H 1 29 ILE MG . . 3.870 3.790 3.766 3.796 . 0 0 "[ . 1 . 2]" 1
353 1 29 ILE H 1 30 THR H . . 4.100 2.181 2.137 2.212 . 0 0 "[ . 1 . 2]" 1
354 1 29 ILE H 1 30 THR HA . . 4.970 4.892 4.863 4.915 . 0 0 "[ . 1 . 2]" 1
355 1 29 ILE H 1 30 THR MG . . 4.250 3.992 3.750 4.198 . 0 0 "[ . 1 . 2]" 1
356 1 29 ILE H 1 31 THR H . . 4.220 4.167 4.053 4.221 0.001 3 0 "[ . 1 . 2]" 1
357 1 29 ILE H 1 31 THR MG . . 5.040 4.809 4.189 4.970 . 0 0 "[ . 1 . 2]" 1
358 1 29 ILE HA 1 29 ILE MD . . 4.170 3.874 3.852 3.883 . 0 0 "[ . 1 . 2]" 1
359 1 29 ILE HA 1 78 TRP HE1 . . 4.520 4.424 3.848 4.524 0.004 15 0 "[ . 1 . 2]" 1
360 1 29 ILE HA 1 78 TRP HZ2 . . 4.420 2.534 2.340 2.837 . 0 0 "[ . 1 . 2]" 1
361 1 29 ILE HB 1 29 ILE MD . . 3.540 2.205 2.122 2.302 . 0 0 "[ . 1 . 2]" 1
362 1 29 ILE HB 1 30 THR H . . 3.940 2.871 2.691 2.952 . 0 0 "[ . 1 . 2]" 1
363 1 29 ILE HB 1 69 LEU MD2 . . 3.980 3.618 3.223 3.992 0.012 10 0 "[ . 1 . 2]" 1
364 1 29 ILE HB 1 70 MET ME . . 6.420 5.372 4.929 5.709 . 0 0 "[ . 1 . 2]" 1
365 1 29 ILE MD 1 29 ILE MG . . 3.530 2.259 2.161 2.379 . 0 0 "[ . 1 . 2]" 1
366 1 29 ILE MD 1 30 THR H . . 4.820 4.575 4.413 4.709 . 0 0 "[ . 1 . 2]" 1
367 1 29 ILE MD 1 65 TYR QD . . 4.820 4.613 4.414 4.747 . 0 0 "[ . 1 . 2]" 1
368 1 29 ILE MD 1 66 MET HA . . 4.410 3.299 3.162 3.495 . 0 0 "[ . 1 . 2]" 1
369 1 29 ILE MD 1 66 MET QG . . 4.380 3.129 2.836 3.372 . 0 0 "[ . 1 . 2]" 1
370 1 29 ILE MD 1 69 LEU HB2 . . 4.290 2.685 2.515 2.803 . 0 0 "[ . 1 . 2]" 1
371 1 29 ILE MD 1 69 LEU HB3 . . 3.890 1.968 1.887 2.074 . 0 0 "[ . 1 . 2]" 1
372 1 29 ILE MD 1 69 LEU MD1 . . 3.880 1.860 1.786 2.002 . 0 0 "[ . 1 . 2]" 1
373 1 29 ILE MD 1 69 LEU MD2 . . 4.240 2.695 2.305 3.247 . 0 0 "[ . 1 . 2]" 1
374 1 29 ILE MD 1 69 LEU HG . . 4.460 3.812 3.690 4.003 . 0 0 "[ . 1 . 2]" 1
375 1 29 ILE MD 1 70 MET H . . 4.260 3.565 3.280 3.924 . 0 0 "[ . 1 . 2]" 1
376 1 29 ILE MD 1 70 MET HA . . 4.450 3.989 3.588 4.287 . 0 0 "[ . 1 . 2]" 1
377 1 29 ILE MD 1 70 MET ME . . 3.220 2.853 2.371 3.210 . 0 0 "[ . 1 . 2]" 1
378 1 29 ILE MD 1 70 MET HG2 . . 4.800 4.679 3.091 4.822 0.022 19 0 "[ . 1 . 2]" 1
379 1 29 ILE MD 1 70 MET HG3 . . 4.800 3.630 2.812 4.239 . 0 0 "[ . 1 . 2]" 1
380 1 29 ILE QG 1 70 MET ME . . 3.190 2.776 2.362 3.100 . 0 0 "[ . 1 . 2]" 1
381 1 29 ILE HG12 1 70 MET ME . . 4.050 2.852 2.394 3.219 . 0 0 "[ . 1 . 2]" 1
382 1 29 ILE HG13 1 70 MET ME . . 4.050 3.847 3.534 4.052 0.002 2 0 "[ . 1 . 2]" 1
383 1 29 ILE MG 1 30 THR H . . 4.150 3.624 3.460 3.708 . 0 0 "[ . 1 . 2]" 1
384 1 29 ILE MG 1 30 THR HA . . 4.910 3.577 3.447 3.697 . 0 0 "[ . 1 . 2]" 1
385 1 29 ILE MG 1 30 THR MG . . 4.050 3.237 3.032 3.374 . 0 0 "[ . 1 . 2]" 1
386 1 29 ILE MG 1 69 LEU HB2 . . 4.380 4.325 4.017 4.388 0.008 17 0 "[ . 1 . 2]" 1
387 1 29 ILE MG 1 69 LEU HB3 . . 4.410 2.918 2.675 3.071 . 0 0 "[ . 1 . 2]" 1
388 1 29 ILE MG 1 69 LEU MD1 . . 4.380 3.869 3.609 4.173 . 0 0 "[ . 1 . 2]" 1
389 1 29 ILE MG 1 69 LEU MD2 . . 4.410 3.456 2.963 3.726 . 0 0 "[ . 1 . 2]" 1
390 1 29 ILE MG 1 70 MET H . . 4.460 4.367 4.135 4.482 0.022 19 0 "[ . 1 . 2]" 1
391 1 29 ILE MG 1 70 MET HA . . 4.430 3.291 2.919 3.665 . 0 0 "[ . 1 . 2]" 1
392 1 29 ILE MG 1 70 MET ME . . 4.330 3.920 3.399 4.281 . 0 0 "[ . 1 . 2]" 1
393 1 29 ILE MG 1 70 MET QG . . 4.240 3.484 3.047 3.966 . 0 0 "[ . 1 . 2]" 1
394 1 29 ILE MG 1 71 GLN H . . 6.020 5.707 5.394 5.960 . 0 0 "[ . 1 . 2]" 1
395 1 29 ILE MG 1 73 SER QB . . 4.650 3.830 3.370 4.112 . 0 0 "[ . 1 . 2]" 1
396 1 29 ILE MG 1 78 TRP QB . . 5.180 4.189 3.662 4.477 . 0 0 "[ . 1 . 2]" 1
397 1 29 ILE MG 1 78 TRP HD1 . . 5.270 4.632 4.116 4.810 . 0 0 "[ . 1 . 2]" 1
398 1 29 ILE MG 1 78 TRP HE1 . . 4.210 3.874 3.645 4.072 . 0 0 "[ . 1 . 2]" 1
399 1 29 ILE MG 1 78 TRP HE3 . . 5.010 4.262 3.896 4.551 . 0 0 "[ . 1 . 2]" 1
400 1 29 ILE MG 1 78 TRP HZ2 . . 5.230 3.594 3.261 3.935 . 0 0 "[ . 1 . 2]" 1
401 1 30 THR H 1 30 THR HB . . 3.750 3.639 3.606 3.659 . 0 0 "[ . 1 . 2]" 1
402 1 30 THR H 1 30 THR MG . . 3.470 2.554 2.368 2.759 . 0 0 "[ . 1 . 2]" 1
403 1 30 THR H 1 31 THR HA . . 5.300 5.176 5.123 5.260 . 0 0 "[ . 1 . 2]" 1
404 1 30 THR H 1 31 THR MG . . 4.080 3.995 3.826 4.093 0.013 15 0 "[ . 1 . 2]" 1
405 1 30 THR HA 1 30 THR MG . . 2.990 2.340 2.212 2.431 . 0 0 "[ . 1 . 2]" 1
406 1 30 THR HA 1 32 ILE H . . 4.910 4.602 4.026 4.762 . 0 0 "[ . 1 . 2]" 1
407 1 30 THR HB 1 31 THR H . . 3.610 3.169 2.985 3.420 . 0 0 "[ . 1 . 2]" 1
408 1 30 THR MG 1 31 THR H . . 3.860 3.768 3.746 3.840 . 0 0 "[ . 1 . 2]" 1
409 1 31 THR H 1 31 THR HB . . 3.810 3.476 2.300 3.613 . 0 0 "[ . 1 . 2]" 1
410 1 31 THR H 1 31 THR MG . . 3.380 2.125 1.921 2.618 . 0 0 "[ . 1 . 2]" 1
411 1 31 THR H 1 32 ILE H . . 3.250 2.841 2.750 2.881 . 0 0 "[ . 1 . 2]" 1
412 1 31 THR H 1 32 ILE MD . . 5.080 5.019 4.794 5.082 0.002 17 0 "[ . 1 . 2]" 1
413 1 31 THR H 1 32 ILE QG . . 4.560 4.391 4.199 4.452 . 0 0 "[ . 1 . 2]" 1
414 1 31 THR HA 1 31 THR MG . . 2.920 2.470 2.367 3.184 0.264 20 0 "[ . 1 . 2]" 1
415 1 31 THR HB 1 32 ILE H . . 3.760 3.694 3.643 3.919 0.159 20 0 "[ . 1 . 2]" 1
416 1 31 THR HB 1 32 ILE MD . . 4.520 3.353 3.124 4.455 . 0 0 "[ . 1 . 2]" 1
417 1 31 THR MG 1 32 ILE H . . 3.760 3.515 2.036 3.688 . 0 0 "[ . 1 . 2]" 1
418 1 31 THR MG 1 32 ILE MD . . 4.340 3.982 1.929 4.309 . 0 0 "[ . 1 . 2]" 1
419 1 32 ILE H 1 32 ILE HB . . 3.670 2.641 2.583 2.662 . 0 0 "[ . 1 . 2]" 1
420 1 32 ILE H 1 32 ILE MD . . 3.310 3.177 3.090 3.267 . 0 0 "[ . 1 . 2]" 1
421 1 32 ILE H 1 32 ILE QG . . 3.630 2.232 2.176 2.564 . 0 0 "[ . 1 . 2]" 1
422 1 32 ILE H 1 32 ILE MG . . 4.040 3.818 3.810 3.826 . 0 0 "[ . 1 . 2]" 1
423 1 32 ILE H 1 33 SER H . . 4.700 4.560 4.502 4.583 . 0 0 "[ . 1 . 2]" 1
424 1 32 ILE H 1 78 TRP HZ2 . . 4.780 4.608 4.309 4.782 0.002 8 0 "[ . 1 . 2]" 1
425 1 32 ILE HA 1 32 ILE MD . . 3.130 2.096 1.972 2.195 . 0 0 "[ . 1 . 2]" 1
426 1 32 ILE HA 1 32 ILE QG . . 3.900 3.054 3.030 3.076 . 0 0 "[ . 1 . 2]" 1
427 1 32 ILE HA 1 32 ILE MG . . 3.400 2.245 2.181 2.325 . 0 0 "[ . 1 . 2]" 1
428 1 32 ILE HA 1 33 SER H . . 3.470 2.238 2.157 2.286 . 0 0 "[ . 1 . 2]" 1
429 1 32 ILE HB 1 78 TRP HZ2 . . 4.510 2.983 2.157 3.312 . 0 0 "[ . 1 . 2]" 1
430 1 32 ILE MD 1 32 ILE MG . . 3.160 2.040 1.940 2.160 . 0 0 "[ . 1 . 2]" 1
431 1 32 ILE MD 1 33 SER H . . 4.130 3.682 3.576 3.830 . 0 0 "[ . 1 . 2]" 1
432 1 32 ILE MD 1 35 PRO HA . . 5.210 4.691 4.437 5.210 0.000 16 0 "[ . 1 . 2]" 1
433 1 32 ILE QG 1 78 TRP HZ2 . . 5.010 4.688 3.721 5.009 . 0 0 "[ . 1 . 2]" 1
434 1 32 ILE MG 1 33 SER H . . 3.690 2.129 1.929 2.593 . 0 0 "[ . 1 . 2]" 1
435 1 32 ILE MG 1 35 PRO HA . . 3.540 2.667 2.518 2.940 . 0 0 "[ . 1 . 2]" 1
436 1 32 ILE MG 1 35 PRO QB . . 4.070 2.099 1.916 2.953 . 0 0 "[ . 1 . 2]" 1
437 1 32 ILE MG 1 35 PRO HD2 . . 4.600 3.581 3.423 4.077 . 0 0 "[ . 1 . 2]" 1
438 1 32 ILE MG 1 35 PRO QD . . 3.860 2.065 1.945 2.706 . 0 0 "[ . 1 . 2]" 1
439 1 32 ILE MG 1 35 PRO HD3 . . 4.600 2.079 1.956 2.747 . 0 0 "[ . 1 . 2]" 1
440 1 32 ILE MG 1 36 MET H . . 4.460 4.363 4.115 4.494 0.034 19 0 "[ . 1 . 2]" 1
441 1 32 ILE MG 1 78 TRP HZ2 . . 3.930 3.352 2.693 3.641 . 0 0 "[ . 1 . 2]" 1
442 1 33 SER H 1 33 SER QB . . 3.510 2.712 2.471 3.041 . 0 0 "[ . 1 . 2]" 1
443 1 33 SER H 1 34 ASP H . . 4.230 2.160 1.896 4.027 . 0 0 "[ . 1 . 2]" 1
444 1 33 SER HA 1 78 TRP HD1 . . 4.730 4.604 3.892 4.742 0.012 19 0 "[ . 1 . 2]" 1
445 1 33 SER HA 1 78 TRP HE1 . . 3.740 2.451 2.126 2.996 . 0 0 "[ . 1 . 2]" 1
446 1 33 SER QB 1 78 TRP HE1 . . 5.520 4.116 3.564 4.984 . 0 0 "[ . 1 . 2]" 1
447 1 34 ASP HA 1 35 PRO HD2 . . 3.830 2.078 2.050 2.136 . 0 0 "[ . 1 . 2]" 1
448 1 34 ASP HA 1 35 PRO HD3 . . 3.830 2.912 2.869 2.992 . 0 0 "[ . 1 . 2]" 1
449 1 34 ASP HA 1 35 PRO HG2 . . 4.930 4.211 4.192 4.248 . 0 0 "[ . 1 . 2]" 1
450 1 34 ASP HA 1 35 PRO HG3 . . 4.930 4.661 4.628 4.727 . 0 0 "[ . 1 . 2]" 1
451 1 34 ASP HA 1 77 VAL MG1 . . 3.770 3.140 1.991 3.553 . 0 0 "[ . 1 . 2]" 1
452 1 34 ASP HA 1 77 VAL MG2 . . 3.680 3.376 2.497 3.683 0.003 9 0 "[ . 1 . 2]" 1
453 1 35 PRO HA 1 36 MET H . . 3.410 2.395 2.152 2.641 . 0 0 "[ . 1 . 2]" 1
454 1 35 PRO QB 1 36 MET H . . 4.320 2.583 2.048 3.409 . 0 0 "[ . 1 . 2]" 1
455 1 35 PRO QB 1 40 ILE MD . . 4.050 3.170 2.562 4.070 0.020 11 0 "[ . 1 . 2]" 1
456 1 35 PRO QD 1 77 VAL MG1 . . 3.700 3.206 2.477 3.542 . 0 0 "[ . 1 . 2]" 1
457 1 35 PRO QD 1 77 VAL MG2 . . 3.700 2.854 2.004 3.212 . 0 0 "[ . 1 . 2]" 1
458 1 35 PRO QD 1 78 TRP HE1 . . 4.060 3.502 2.562 3.920 . 0 0 "[ . 1 . 2]" 1
459 1 35 PRO QG 1 77 VAL MG1 . . 5.080 4.240 3.078 5.040 . 0 0 "[ . 1 . 2]" 1
460 1 35 PRO QG 1 77 VAL MG2 . . 4.240 3.259 1.913 4.179 . 0 0 "[ . 1 . 2]" 1
461 1 36 MET H 1 36 MET QB . . 3.700 2.314 2.187 2.534 . 0 0 "[ . 1 . 2]" 1
462 1 36 MET H 1 36 MET QG . . 4.550 3.261 2.455 4.104 . 0 0 "[ . 1 . 2]" 1
463 1 36 MET H 1 37 GLU H . . 4.590 4.529 4.461 4.627 0.037 11 0 "[ . 1 . 2]" 1
464 1 36 MET H 1 38 GLU QG . . 4.240 3.543 3.238 3.990 . 0 0 "[ . 1 . 2]" 1
465 1 36 MET H 1 39 ASP H . . 4.320 3.526 3.291 4.322 0.002 11 0 "[ . 1 . 2]" 1
466 1 36 MET HA 1 36 MET HG2 . . 3.670 2.824 2.239 3.622 . 0 0 "[ . 1 . 2]" 1
467 1 36 MET HA 1 36 MET HG3 . . 3.670 3.013 2.169 3.672 0.002 7 0 "[ . 1 . 2]" 1
468 1 36 MET HA 1 37 GLU H . . 3.160 2.496 2.393 2.604 . 0 0 "[ . 1 . 2]" 1
469 1 36 MET HA 1 38 GLU H . . 4.600 4.314 4.041 4.530 . 0 0 "[ . 1 . 2]" 1
470 1 36 MET QB 1 38 GLU QG . . 4.410 2.053 1.968 2.361 . 0 0 "[ . 1 . 2]" 1
471 1 36 MET QB 1 39 ASP H . . 4.430 3.196 2.892 3.565 . 0 0 "[ . 1 . 2]" 1
472 1 36 MET HB2 1 37 GLU H . . 4.680 3.679 3.358 3.985 . 0 0 "[ . 1 . 2]" 1
473 1 36 MET HB3 1 37 GLU H . . 4.680 2.423 2.020 3.087 . 0 0 "[ . 1 . 2]" 1
474 1 36 MET QG 1 37 GLU H . . 4.390 3.265 1.942 3.990 . 0 0 "[ . 1 . 2]" 1
475 1 37 GLU H 1 37 GLU HB2 . . 3.650 3.590 3.579 3.593 . 0 0 "[ . 1 . 2]" 1
476 1 37 GLU H 1 37 GLU HB3 . . 3.310 2.574 2.473 2.701 . 0 0 "[ . 1 . 2]" 1
477 1 37 GLU H 1 37 GLU HG2 . . 3.790 2.057 1.927 2.230 . 0 0 "[ . 1 . 2]" 1
478 1 37 GLU H 1 37 GLU HG3 . . 3.990 3.293 2.921 3.472 . 0 0 "[ . 1 . 2]" 1
479 1 37 GLU H 1 38 GLU H . . 3.950 2.731 2.604 2.836 . 0 0 "[ . 1 . 2]" 1
480 1 37 GLU H 1 39 ASP H . . 4.720 4.355 4.108 4.605 . 0 0 "[ . 1 . 2]" 1
481 1 37 GLU HA 1 37 GLU HG3 . . 3.920 3.789 3.724 3.891 . 0 0 "[ . 1 . 2]" 1
482 1 37 GLU HA 1 39 ASP H . . 4.470 4.176 3.932 4.407 . 0 0 "[ . 1 . 2]" 1
483 1 37 GLU HA 1 40 ILE H . . 4.100 3.378 3.171 3.528 . 0 0 "[ . 1 . 2]" 1
484 1 37 GLU HA 1 40 ILE HB . . 3.590 3.074 2.115 3.600 0.010 11 0 "[ . 1 . 2]" 1
485 1 37 GLU HA 1 40 ILE MD . . 3.660 2.013 1.898 3.205 . 0 0 "[ . 1 . 2]" 1
486 1 37 GLU HA 1 40 ILE MG . . 4.690 4.401 3.584 4.697 0.007 2 0 "[ . 1 . 2]" 1
487 1 37 GLU HA 1 41 LEU H . . 4.950 4.441 3.665 4.982 0.032 11 0 "[ . 1 . 2]" 1
488 1 37 GLU HA 1 41 LEU QD . . 4.560 4.161 3.727 4.528 . 0 0 "[ . 1 . 2]" 1
489 1 37 GLU HB2 1 38 GLU HA . . 4.940 4.487 4.322 4.621 . 0 0 "[ . 1 . 2]" 1
490 1 37 GLU HB2 1 40 ILE H . . 5.140 5.103 4.537 5.148 0.008 10 0 "[ . 1 . 2]" 1
491 1 37 GLU HB2 1 41 LEU QD . . 3.570 3.088 2.686 3.446 . 0 0 "[ . 1 . 2]" 1
492 1 37 GLU HB3 1 40 ILE MD . . 4.670 3.934 3.517 4.886 0.216 11 0 "[ . 1 . 2]" 1
493 1 37 GLU HG2 1 38 GLU H . . 3.210 2.678 2.246 3.237 0.027 11 0 "[ . 1 . 2]" 1
494 1 37 GLU HG2 1 41 LEU QD . . 5.120 4.720 4.143 5.069 . 0 0 "[ . 1 . 2]" 1
495 1 37 GLU HG3 1 38 GLU H . . 3.610 2.449 2.190 2.662 . 0 0 "[ . 1 . 2]" 1
496 1 37 GLU HG3 1 39 ASP H . . 5.120 4.973 4.746 5.138 0.018 11 0 "[ . 1 . 2]" 1
497 1 37 GLU HG3 1 41 LEU QD . . 3.810 3.385 2.676 3.828 0.018 11 0 "[ . 1 . 2]" 1
498 1 38 GLU H 1 38 GLU HB3 . . 2.910 2.542 2.377 2.648 . 0 0 "[ . 1 . 2]" 1
499 1 38 GLU H 1 38 GLU HG2 . . 4.100 2.130 1.947 2.431 . 0 0 "[ . 1 . 2]" 1
500 1 38 GLU H 1 38 GLU HG3 . . 4.100 3.532 3.082 3.820 . 0 0 "[ . 1 . 2]" 1
501 1 38 GLU H 1 39 ASP H . . 3.710 2.710 2.604 2.818 . 0 0 "[ . 1 . 2]" 1
502 1 38 GLU H 1 40 ILE H . . 4.580 4.218 3.800 4.470 . 0 0 "[ . 1 . 2]" 1
503 1 38 GLU H 1 41 LEU H . . 5.050 4.809 4.576 5.151 0.101 11 0 "[ . 1 . 2]" 1
504 1 38 GLU H 1 41 LEU QD . . 4.370 4.231 3.868 4.371 0.001 10 0 "[ . 1 . 2]" 1
505 1 38 GLU HA 1 41 LEU H . . 4.060 3.387 3.164 3.787 . 0 0 "[ . 1 . 2]" 1
506 1 38 GLU HA 1 41 LEU HB2 . . 3.830 2.644 2.361 3.235 . 0 0 "[ . 1 . 2]" 1
507 1 38 GLU HA 1 41 LEU HB3 . . 4.900 4.242 3.908 4.914 0.014 11 0 "[ . 1 . 2]" 1
508 1 38 GLU HA 1 41 LEU QD . . 3.470 2.778 2.130 3.197 . 0 0 "[ . 1 . 2]" 1
509 1 38 GLU HA 1 41 LEU HG . . 4.510 3.732 2.959 4.439 . 0 0 "[ . 1 . 2]" 1
510 1 38 GLU HA 1 42 GLN H . . 4.950 4.338 4.118 4.794 . 0 0 "[ . 1 . 2]" 1
511 1 38 GLU HB3 1 39 ASP H . . 4.060 3.934 3.881 4.062 0.002 20 0 "[ . 1 . 2]" 1
512 1 38 GLU QG 1 40 ILE H . . 5.160 4.332 3.882 4.532 . 0 0 "[ . 1 . 2]" 1
513 1 38 GLU HG2 1 39 ASP H . . 3.510 2.225 1.948 2.937 . 0 0 "[ . 1 . 2]" 1
514 1 38 GLU HG3 1 39 ASP H . . 3.510 2.613 2.068 3.118 . 0 0 "[ . 1 . 2]" 1
515 1 39 ASP H 1 39 ASP HB2 . . 3.800 2.511 2.114 3.557 . 0 0 "[ . 1 . 2]" 1
516 1 39 ASP H 1 39 ASP QB . . 3.230 2.429 2.080 2.801 . 0 0 "[ . 1 . 2]" 1
517 1 39 ASP H 1 39 ASP HB3 . . 3.800 3.492 2.882 3.606 . 0 0 "[ . 1 . 2]" 1
518 1 39 ASP H 1 40 ILE H . . 3.590 2.654 2.394 2.798 . 0 0 "[ . 1 . 2]" 1
519 1 39 ASP H 1 40 ILE HB . . 5.140 4.896 4.619 5.148 0.008 11 0 "[ . 1 . 2]" 1
520 1 39 ASP H 1 40 ILE MD . . 4.500 3.622 3.321 4.480 . 0 0 "[ . 1 . 2]" 1
521 1 39 ASP H 1 41 LEU H . . 4.320 4.018 3.786 4.349 0.029 11 0 "[ . 1 . 2]" 1
522 1 39 ASP H 1 42 GLN H . . 4.990 4.775 4.640 4.970 . 0 0 "[ . 1 . 2]" 1
523 1 39 ASP H 1 42 GLN QG . . 5.140 4.670 4.289 4.926 . 0 0 "[ . 1 . 2]" 1
524 1 39 ASP HA 1 42 GLN H . . 3.520 3.456 3.315 3.535 0.015 19 0 "[ . 1 . 2]" 1
525 1 39 ASP HA 1 42 GLN HB2 . . 4.820 2.806 2.619 3.272 . 0 0 "[ . 1 . 2]" 1
526 1 39 ASP HA 1 42 GLN QB . . 4.020 2.774 2.594 3.215 . 0 0 "[ . 1 . 2]" 1
527 1 39 ASP HA 1 42 GLN HB3 . . 4.820 4.366 4.212 4.723 . 0 0 "[ . 1 . 2]" 1
528 1 39 ASP HA 1 42 GLN HG2 . . 4.700 3.572 3.033 4.233 . 0 0 "[ . 1 . 2]" 1
529 1 39 ASP HA 1 42 GLN QG . . 3.980 3.031 2.485 3.318 . 0 0 "[ . 1 . 2]" 1
530 1 39 ASP HA 1 42 GLN HG3 . . 4.700 3.360 2.502 3.798 . 0 0 "[ . 1 . 2]" 1
531 1 39 ASP HA 1 43 VAL H . . 4.840 4.408 4.139 4.571 . 0 0 "[ . 1 . 2]" 1
532 1 39 ASP QB 1 40 ILE H . . 3.660 2.662 2.411 3.466 . 0 0 "[ . 1 . 2]" 1
533 1 39 ASP HB2 1 40 ILE H . . 4.210 2.811 2.457 3.697 . 0 0 "[ . 1 . 2]" 1
534 1 39 ASP HB3 1 40 ILE H . . 4.210 3.603 2.791 4.188 . 0 0 "[ . 1 . 2]" 1
535 1 40 ILE H 1 40 ILE HB . . 3.510 2.504 2.446 2.727 . 0 0 "[ . 1 . 2]" 1
536 1 40 ILE H 1 40 ILE MD . . 3.700 2.150 1.890 3.238 . 0 0 "[ . 1 . 2]" 1
537 1 40 ILE H 1 40 ILE HG12 . . 4.120 3.761 1.853 3.955 . 0 0 "[ . 1 . 2]" 1
538 1 40 ILE H 1 40 ILE HG13 . . 4.120 2.902 2.217 3.448 . 0 0 "[ . 1 . 2]" 1
539 1 40 ILE H 1 40 ILE MG . . 3.930 3.762 3.753 3.767 . 0 0 "[ . 1 . 2]" 1
540 1 40 ILE H 1 41 LEU H . . 3.730 2.534 2.487 2.658 . 0 0 "[ . 1 . 2]" 1
541 1 40 ILE H 1 41 LEU HA . . 5.530 5.169 5.129 5.270 . 0 0 "[ . 1 . 2]" 1
542 1 40 ILE H 1 41 LEU HB2 . . 4.850 4.586 4.388 4.780 . 0 0 "[ . 1 . 2]" 1
543 1 40 ILE H 1 41 LEU QD . . 5.140 4.355 3.574 4.851 . 0 0 "[ . 1 . 2]" 1
544 1 40 ILE HA 1 40 ILE MD . . 3.970 3.403 2.112 3.877 . 0 0 "[ . 1 . 2]" 1
545 1 40 ILE HA 1 40 ILE MG . . 3.500 2.347 2.325 2.382 . 0 0 "[ . 1 . 2]" 1
546 1 40 ILE HA 1 42 GLN H . . 4.480 4.159 4.062 4.187 . 0 0 "[ . 1 . 2]" 1
547 1 40 ILE HA 1 43 VAL H . . 4.260 3.672 3.490 3.762 . 0 0 "[ . 1 . 2]" 1
548 1 40 ILE HA 1 43 VAL HB . . 5.230 4.989 4.718 5.233 0.003 7 0 "[ . 1 . 2]" 1
549 1 40 ILE HA 1 43 VAL MG2 . . 3.960 2.147 1.913 2.333 . 0 0 "[ . 1 . 2]" 1
550 1 40 ILE HB 1 40 ILE MD . . 3.710 2.173 2.096 3.230 . 0 0 "[ . 1 . 2]" 1
551 1 40 ILE HB 1 41 LEU H . . 3.820 2.839 2.639 2.875 . 0 0 "[ . 1 . 2]" 1
552 1 40 ILE MD 1 40 ILE MG . . 3.230 2.958 1.923 3.164 . 0 0 "[ . 1 . 2]" 1
553 1 40 ILE MD 1 41 LEU H . . 4.440 3.841 3.636 4.469 0.029 11 0 "[ . 1 . 2]" 1
554 1 40 ILE MD 1 81 ALA HA . . 4.840 4.529 3.579 4.846 0.006 14 0 "[ . 1 . 2]" 1
555 1 40 ILE MD 1 81 ALA MB . . 3.450 3.245 2.367 3.458 0.008 6 0 "[ . 1 . 2]" 1
556 1 40 ILE MG 1 41 LEU H . . 3.850 3.637 3.576 3.737 . 0 0 "[ . 1 . 2]" 1
557 1 40 ILE MG 1 44 VAL H . . 4.550 4.219 3.850 4.401 . 0 0 "[ . 1 . 2]" 1
558 1 40 ILE MG 1 44 VAL QG . . 3.620 2.513 2.196 2.657 . 0 0 "[ . 1 . 2]" 1
559 1 40 ILE MG 1 81 ALA MB . . 4.000 3.219 2.804 3.608 . 0 0 "[ . 1 . 2]" 1
560 1 40 ILE MG 1 84 PHE HB3 . . 4.310 3.445 3.047 3.785 . 0 0 "[ . 1 . 2]" 1
561 1 40 ILE MG 1 84 PHE QD . . 3.460 2.418 1.999 2.938 . 0 0 "[ . 1 . 2]" 1
562 1 40 ILE MG 1 84 PHE QE . . 3.710 2.979 2.518 3.690 . 0 0 "[ . 1 . 2]" 1
563 1 40 ILE MG 1 85 ILE H . . 4.000 3.673 3.312 3.979 . 0 0 "[ . 1 . 2]" 1
564 1 40 ILE MG 1 85 ILE HA . . 4.640 3.429 3.080 3.734 . 0 0 "[ . 1 . 2]" 1
565 1 40 ILE MG 1 85 ILE HB . . 4.470 4.273 4.103 4.465 . 0 0 "[ . 1 . 2]" 1
566 1 40 ILE MG 1 85 ILE MD . . 3.590 2.561 2.300 2.765 . 0 0 "[ . 1 . 2]" 1
567 1 40 ILE MG 1 85 ILE HG12 . . 3.770 1.961 1.895 2.113 . 0 0 "[ . 1 . 2]" 1
568 1 40 ILE MG 1 85 ILE MG . . 4.370 3.473 3.304 3.577 . 0 0 "[ . 1 . 2]" 1
569 1 41 LEU H 1 41 LEU HB2 . . 3.500 2.299 2.155 2.458 . 0 0 "[ . 1 . 2]" 1
570 1 41 LEU H 1 41 LEU HB3 . . 3.710 3.544 3.472 3.596 . 0 0 "[ . 1 . 2]" 1
571 1 41 LEU H 1 41 LEU MD1 . . 4.080 3.755 3.346 3.975 . 0 0 "[ . 1 . 2]" 1
572 1 41 LEU H 1 41 LEU QD . . 3.520 2.906 2.093 3.373 . 0 0 "[ . 1 . 2]" 1
573 1 41 LEU H 1 41 LEU MD2 . . 4.080 3.161 2.106 3.951 . 0 0 "[ . 1 . 2]" 1
574 1 41 LEU H 1 41 LEU HG . . 4.090 3.092 2.319 4.096 0.006 13 0 "[ . 1 . 2]" 1
575 1 41 LEU H 1 42 GLN H . . 3.410 2.460 2.439 2.528 . 0 0 "[ . 1 . 2]" 1
576 1 41 LEU H 1 42 GLN QB . . 4.690 4.386 4.262 4.683 . 0 0 "[ . 1 . 2]" 1
577 1 41 LEU H 1 43 VAL H . . 4.580 4.321 4.295 4.359 . 0 0 "[ . 1 . 2]" 1
578 1 41 LEU H 1 43 VAL MG2 . . 4.470 4.075 4.018 4.162 . 0 0 "[ . 1 . 2]" 1
579 1 41 LEU HA 1 41 LEU MD1 . . 4.080 3.247 2.064 3.919 . 0 0 "[ . 1 . 2]" 1
580 1 41 LEU HA 1 41 LEU QD . . 2.940 2.098 1.952 2.393 . 0 0 "[ . 1 . 2]" 1
581 1 41 LEU HA 1 41 LEU MD2 . . 4.080 2.268 1.970 2.692 . 0 0 "[ . 1 . 2]" 1
582 1 41 LEU HA 1 41 LEU HG . . 4.160 3.242 2.758 3.697 . 0 0 "[ . 1 . 2]" 1
583 1 41 LEU HA 1 43 VAL H . . 4.640 4.593 4.503 4.655 0.015 11 0 "[ . 1 . 2]" 1
584 1 41 LEU HA 1 44 VAL H . . 3.600 3.494 3.362 3.610 0.010 19 0 "[ . 1 . 2]" 1
585 1 41 LEU HA 1 44 VAL HB . . 3.740 2.709 2.589 2.757 . 0 0 "[ . 1 . 2]" 1
586 1 41 LEU HA 1 44 VAL MG1 . . 4.060 4.042 3.907 4.073 0.013 20 0 "[ . 1 . 2]" 1
587 1 41 LEU HA 1 44 VAL QG . . 3.540 2.794 2.440 3.165 . 0 0 "[ . 1 . 2]" 1
588 1 41 LEU HA 1 44 VAL MG2 . . 4.060 2.855 2.465 3.300 . 0 0 "[ . 1 . 2]" 1
589 1 41 LEU HA 1 45 ARG H . . 4.330 4.227 3.857 4.353 0.023 16 0 "[ . 1 . 2]" 1
590 1 41 LEU HB2 1 41 LEU MD1 . . 3.430 2.598 2.018 3.189 . 0 0 "[ . 1 . 2]" 1
591 1 41 LEU HB2 1 41 LEU QD . . 2.980 2.264 1.996 2.377 . 0 0 "[ . 1 . 2]" 1
592 1 41 LEU HB2 1 41 LEU MD2 . . 3.430 2.901 2.304 3.193 . 0 0 "[ . 1 . 2]" 1
593 1 41 LEU HB2 1 42 GLN H . . 4.110 2.947 2.881 3.047 . 0 0 "[ . 1 . 2]" 1
594 1 41 LEU HB3 1 42 GLN H . . 3.910 3.702 3.521 3.868 . 0 0 "[ . 1 . 2]" 1
595 1 41 LEU QD 1 44 VAL HB . . 3.980 3.504 3.180 3.916 . 0 0 "[ . 1 . 2]" 1
596 1 41 LEU QD 1 84 PHE QD . . 4.580 4.447 3.916 4.586 0.006 16 0 "[ . 1 . 2]" 1
597 1 41 LEU QD 1 84 PHE QE . . 3.440 2.892 2.612 3.190 . 0 0 "[ . 1 . 2]" 1
598 1 41 LEU QD 1 84 PHE HZ . . 3.890 3.682 3.434 3.882 . 0 0 "[ . 1 . 2]" 1
599 1 41 LEU MD1 1 42 GLN H . . 4.900 4.720 4.458 4.836 . 0 0 "[ . 1 . 2]" 1
600 1 41 LEU MD2 1 42 GLN H . . 4.900 4.551 4.042 4.886 . 0 0 "[ . 1 . 2]" 1
601 1 42 GLN H 1 42 GLN HB2 . . 3.730 2.316 2.204 2.561 . 0 0 "[ . 1 . 2]" 1
602 1 42 GLN H 1 42 GLN QB . . 2.900 2.287 2.182 2.510 . 0 0 "[ . 1 . 2]" 1
603 1 42 GLN H 1 42 GLN HB3 . . 3.730 3.552 3.506 3.607 . 0 0 "[ . 1 . 2]" 1
604 1 42 GLN H 1 42 GLN QE . . 4.630 4.531 3.984 4.634 0.004 10 0 "[ . 1 . 2]" 1
605 1 42 GLN H 1 42 GLN HG2 . . 3.970 2.640 2.239 2.960 . 0 0 "[ . 1 . 2]" 1
606 1 42 GLN H 1 42 GLN QG . . 3.220 2.573 2.210 2.839 . 0 0 "[ . 1 . 2]" 1
607 1 42 GLN H 1 42 GLN HG3 . . 3.970 3.728 2.546 3.978 0.008 14 0 "[ . 1 . 2]" 1
608 1 42 GLN H 1 43 VAL HA . . 5.350 5.264 5.191 5.325 . 0 0 "[ . 1 . 2]" 1
609 1 42 GLN H 1 43 VAL MG1 . . 4.520 4.410 4.340 4.490 . 0 0 "[ . 1 . 2]" 1
610 1 42 GLN H 1 43 VAL MG2 . . 4.000 3.600 3.520 3.683 . 0 0 "[ . 1 . 2]" 1
611 1 42 GLN H 1 44 VAL H . . 4.110 3.923 3.881 3.954 . 0 0 "[ . 1 . 2]" 1
612 1 42 GLN H 1 45 ARG H . . 4.800 4.681 4.507 4.803 0.003 2 0 "[ . 1 . 2]" 1
613 1 42 GLN HA 1 42 GLN HE21 . . 4.840 3.194 2.403 4.704 . 0 0 "[ . 1 . 2]" 1
614 1 42 GLN HA 1 42 GLN QE . . 4.210 2.988 2.373 4.203 . 0 0 "[ . 1 . 2]" 1
615 1 42 GLN HA 1 42 GLN HE22 . . 4.840 3.690 3.270 4.747 . 0 0 "[ . 1 . 2]" 1
616 1 42 GLN HA 1 42 GLN HG2 . . 4.150 2.814 2.421 3.076 . 0 0 "[ . 1 . 2]" 1
617 1 42 GLN HA 1 42 GLN QG . . 3.550 2.724 2.387 2.937 . 0 0 "[ . 1 . 2]" 1
618 1 42 GLN HA 1 42 GLN HG3 . . 4.150 3.671 3.595 3.800 . 0 0 "[ . 1 . 2]" 1
619 1 42 GLN HA 1 45 ARG QB . . 3.600 2.685 2.481 2.886 . 0 0 "[ . 1 . 2]" 1
620 1 42 GLN HA 1 45 ARG HG2 . . 4.980 4.084 3.781 4.479 . 0 0 "[ . 1 . 2]" 1
621 1 42 GLN HA 1 45 ARG QG . . 4.170 3.546 3.147 4.176 0.006 10 0 "[ . 1 . 2]" 1
622 1 42 GLN HA 1 45 ARG HG3 . . 4.980 3.974 3.345 4.991 0.011 10 0 "[ . 1 . 2]" 1
623 1 42 GLN QB 1 43 VAL H . . 3.150 2.475 2.404 2.528 . 0 0 "[ . 1 . 2]" 1
624 1 42 GLN QB 1 43 VAL MG1 . . 4.570 3.295 3.162 3.356 . 0 0 "[ . 1 . 2]" 1
625 1 42 GLN HB2 1 43 VAL H . . 3.700 2.559 2.446 2.655 . 0 0 "[ . 1 . 2]" 1
626 1 42 GLN HB3 1 43 VAL H . . 3.700 3.325 3.174 3.639 . 0 0 "[ . 1 . 2]" 1
627 1 42 GLN QE 1 42 GLN QG . . 3.020 2.363 2.070 2.575 . 0 0 "[ . 1 . 2]" 1
628 1 43 VAL H 1 43 VAL HB . . 3.790 3.609 3.608 3.611 . 0 0 "[ . 1 . 2]" 1
629 1 43 VAL H 1 43 VAL MG1 . . 2.850 2.443 2.334 2.473 . 0 0 "[ . 1 . 2]" 1
630 1 43 VAL H 1 43 VAL MG2 . . 3.120 1.926 1.911 1.937 . 0 0 "[ . 1 . 2]" 1
631 1 43 VAL H 1 44 VAL H . . 3.350 2.639 2.610 2.655 . 0 0 "[ . 1 . 2]" 1
632 1 43 VAL H 1 44 VAL QG . . 4.280 4.095 4.024 4.158 . 0 0 "[ . 1 . 2]" 1
633 1 43 VAL H 1 45 ARG H . . 4.540 4.107 3.964 4.185 . 0 0 "[ . 1 . 2]" 1
634 1 43 VAL H 1 45 ARG QB . . 5.120 4.910 4.737 5.021 . 0 0 "[ . 1 . 2]" 1
635 1 43 VAL HA 1 43 VAL MG2 . . 3.490 3.201 3.200 3.201 . 0 0 "[ . 1 . 2]" 1
636 1 43 VAL HA 1 46 TYR H . . 3.740 3.628 3.497 3.725 . 0 0 "[ . 1 . 2]" 1
637 1 43 VAL HA 1 46 TYR HB2 . . 4.660 4.004 3.781 4.340 . 0 0 "[ . 1 . 2]" 1
638 1 43 VAL HA 1 46 TYR QB . . 4.060 3.073 2.906 3.295 . 0 0 "[ . 1 . 2]" 1
639 1 43 VAL HA 1 46 TYR HB3 . . 4.660 3.195 2.985 3.413 . 0 0 "[ . 1 . 2]" 1
640 1 43 VAL HA 1 46 TYR QD . . 4.510 4.383 3.794 4.515 0.005 14 0 "[ . 1 . 2]" 1
641 1 43 VAL HA 1 47 CYS H . . 5.080 4.645 4.469 4.861 . 0 0 "[ . 1 . 2]" 1
642 1 43 VAL HB 1 44 VAL H . . 3.940 3.750 3.724 3.761 . 0 0 "[ . 1 . 2]" 1
643 1 43 VAL HB 1 44 VAL QG . . 6.050 3.986 3.897 4.086 . 0 0 "[ . 1 . 2]" 1
644 1 43 VAL HB 1 46 TYR QD . . 6.100 5.101 4.468 5.409 . 0 0 "[ . 1 . 2]" 1
645 1 43 VAL HB 1 85 ILE MD . . 4.560 4.341 4.139 4.559 . 0 0 "[ . 1 . 2]" 1
646 1 43 VAL HB 1 85 ILE MG . . 4.560 3.394 3.056 3.726 . 0 0 "[ . 1 . 2]" 1
647 1 43 VAL MG1 1 44 VAL H . . 4.090 4.011 3.996 4.021 . 0 0 "[ . 1 . 2]" 1
648 1 43 VAL MG1 1 46 TYR H . . 5.510 5.316 5.248 5.394 . 0 0 "[ . 1 . 2]" 1
649 1 43 VAL MG2 1 44 VAL H . . 2.870 2.141 2.113 2.153 . 0 0 "[ . 1 . 2]" 1
650 1 43 VAL MG2 1 45 ARG H . . 4.460 4.231 4.134 4.291 . 0 0 "[ . 1 . 2]" 1
651 1 43 VAL MG2 1 46 TYR H . . 5.730 5.127 4.966 5.323 . 0 0 "[ . 1 . 2]" 1
652 1 43 VAL MG2 1 66 MET ME . . 4.420 4.296 4.105 4.427 0.007 13 0 "[ . 1 . 2]" 1
653 1 43 VAL MG2 1 70 MET ME . . 4.310 4.189 4.018 4.317 0.007 17 0 "[ . 1 . 2]" 1
654 1 43 VAL MG2 1 85 ILE MD . . 3.620 2.563 2.357 2.782 . 0 0 "[ . 1 . 2]" 1
655 1 43 VAL MG2 1 85 ILE MG . . 3.400 2.333 2.089 2.573 . 0 0 "[ . 1 . 2]" 1
656 1 44 VAL H 1 44 VAL HB . . 3.650 2.482 2.439 2.501 . 0 0 "[ . 1 . 2]" 1
657 1 44 VAL H 1 44 VAL MG1 . . 3.840 3.762 3.752 3.766 . 0 0 "[ . 1 . 2]" 1
658 1 44 VAL H 1 44 VAL QG . . 3.270 2.302 2.243 2.359 . 0 0 "[ . 1 . 2]" 1
659 1 44 VAL H 1 44 VAL MG2 . . 3.840 2.323 2.260 2.384 . 0 0 "[ . 1 . 2]" 1
660 1 44 VAL H 1 45 ARG H . . 3.950 2.514 2.452 2.588 . 0 0 "[ . 1 . 2]" 1
661 1 44 VAL H 1 46 TYR H . . 4.690 4.167 3.914 4.396 . 0 0 "[ . 1 . 2]" 1
662 1 44 VAL H 1 85 ILE MG . . 4.380 4.013 3.818 4.238 . 0 0 "[ . 1 . 2]" 1
663 1 44 VAL HA 1 44 VAL MG1 . . 3.480 2.370 2.333 2.416 . 0 0 "[ . 1 . 2]" 1
664 1 44 VAL HA 1 44 VAL MG2 . . 3.480 2.367 2.347 2.411 . 0 0 "[ . 1 . 2]" 1
665 1 44 VAL HA 1 47 CYS H . . 3.610 3.491 3.282 3.626 0.016 13 0 "[ . 1 . 2]" 1
666 1 44 VAL HA 1 47 CYS HB2 . . 4.770 3.086 2.823 3.803 . 0 0 "[ . 1 . 2]" 1
667 1 44 VAL HA 1 47 CYS QB . . 4.020 2.955 2.756 3.094 . 0 0 "[ . 1 . 2]" 1
668 1 44 VAL HA 1 47 CYS HB3 . . 4.770 4.473 2.828 4.772 0.002 18 0 "[ . 1 . 2]" 1
669 1 44 VAL HA 1 48 THR H . . 4.840 4.008 3.703 4.383 . 0 0 "[ . 1 . 2]" 1
670 1 44 VAL HA 1 85 ILE MG . . 4.460 3.200 2.931 3.449 . 0 0 "[ . 1 . 2]" 1
671 1 44 VAL HA 1 89 VAL QG . . 3.880 2.978 2.726 3.114 . 0 0 "[ . 1 . 2]" 1
672 1 44 VAL HB 1 45 ARG H . . 3.870 2.809 2.694 3.013 . 0 0 "[ . 1 . 2]" 1
673 1 44 VAL QG 1 45 ARG H . . 3.720 3.308 3.230 3.406 . 0 0 "[ . 1 . 2]" 1
674 1 44 VAL QG 1 45 ARG HA . . 3.500 3.457 3.348 3.508 0.008 14 0 "[ . 1 . 2]" 1
675 1 44 VAL QG 1 47 CYS H . . 5.350 4.304 4.087 4.477 . 0 0 "[ . 1 . 2]" 1
676 1 44 VAL QG 1 47 CYS QB . . 4.500 3.424 3.248 3.602 . 0 0 "[ . 1 . 2]" 1
677 1 44 VAL QG 1 48 THR HB . . 5.180 3.874 3.503 4.949 . 0 0 "[ . 1 . 2]" 1
678 1 44 VAL QG 1 84 PHE QD . . 4.270 3.425 3.105 3.629 . 0 0 "[ . 1 . 2]" 1
679 1 44 VAL QG 1 84 PHE QE . . 3.590 3.200 2.788 3.512 . 0 0 "[ . 1 . 2]" 1
680 1 44 VAL QG 1 85 ILE H . . 4.500 4.355 4.121 4.515 0.015 13 0 "[ . 1 . 2]" 1
681 1 44 VAL QG 1 85 ILE HA . . 3.530 2.235 1.958 2.426 . 0 0 "[ . 1 . 2]" 1
682 1 44 VAL QG 1 85 ILE HB . . 4.450 4.097 3.888 4.273 . 0 0 "[ . 1 . 2]" 1
683 1 44 VAL QG 1 85 ILE MD . . 3.870 3.779 3.581 3.878 0.008 9 0 "[ . 1 . 2]" 1
684 1 44 VAL QG 1 85 ILE MG . . 2.900 2.092 1.910 2.257 . 0 0 "[ . 1 . 2]" 1
685 1 44 VAL QG 1 88 ASN H . . 4.080 3.884 3.717 4.092 0.012 16 0 "[ . 1 . 2]" 1
686 1 44 VAL QG 1 88 ASN HA . . 4.270 4.082 3.924 4.266 . 0 0 "[ . 1 . 2]" 1
687 1 44 VAL QG 1 88 ASN QB . . 3.090 1.901 1.786 2.084 . 0 0 "[ . 1 . 2]" 1
688 1 44 VAL QG 1 88 ASN HD22 . . 4.940 4.186 3.918 4.467 . 0 0 "[ . 1 . 2]" 1
689 1 44 VAL QG 1 89 VAL HA . . 4.250 3.832 3.542 4.096 . 0 0 "[ . 1 . 2]" 1
690 1 44 VAL QG 1 89 VAL QG . . 3.730 2.460 2.195 2.698 . 0 0 "[ . 1 . 2]" 1
691 1 44 VAL MG1 1 45 ARG H . . 4.630 3.559 3.442 3.694 . 0 0 "[ . 1 . 2]" 1
692 1 44 VAL MG1 1 84 PHE QD . . 5.250 4.990 4.552 5.172 . 0 0 "[ . 1 . 2]" 1
693 1 44 VAL MG1 1 84 PHE QE . . 4.760 4.208 3.684 4.505 . 0 0 "[ . 1 . 2]" 1
694 1 44 VAL MG1 1 85 ILE HA . . 4.350 3.887 3.556 4.076 . 0 0 "[ . 1 . 2]" 1
695 1 44 VAL MG1 1 88 ASN H . . 4.780 4.455 4.232 4.726 . 0 0 "[ . 1 . 2]" 1
696 1 44 VAL MG1 1 88 ASN HA . . 5.270 4.275 4.101 4.502 . 0 0 "[ . 1 . 2]" 1
697 1 44 VAL MG1 1 88 ASN HB2 . . 4.200 2.640 2.408 2.976 . 0 0 "[ . 1 . 2]" 1
698 1 44 VAL MG1 1 88 ASN HB3 . . 4.200 2.034 1.886 2.265 . 0 0 "[ . 1 . 2]" 1
699 1 44 VAL MG1 1 88 ASN HD21 . . 4.690 4.517 4.192 4.697 0.007 14 0 "[ . 1 . 2]" 1
700 1 44 VAL MG2 1 45 ARG H . . 4.630 3.933 3.880 4.005 . 0 0 "[ . 1 . 2]" 1
701 1 44 VAL MG2 1 84 PHE QD . . 5.250 3.489 3.161 3.707 . 0 0 "[ . 1 . 2]" 1
702 1 44 VAL MG2 1 84 PHE QE . . 4.760 3.319 2.857 3.665 . 0 0 "[ . 1 . 2]" 1
703 1 44 VAL MG2 1 85 ILE HA . . 4.350 2.249 1.967 2.448 . 0 0 "[ . 1 . 2]" 1
704 1 44 VAL MG2 1 88 ASN H . . 4.780 4.284 4.067 4.483 . 0 0 "[ . 1 . 2]" 1
705 1 44 VAL MG2 1 88 ASN HA . . 5.270 5.185 4.970 5.287 0.017 16 0 "[ . 1 . 2]" 1
706 1 44 VAL MG2 1 88 ASN HB2 . . 4.200 2.630 2.352 2.829 . 0 0 "[ . 1 . 2]" 1
707 1 44 VAL MG2 1 88 ASN HB3 . . 4.200 3.259 2.991 3.433 . 0 0 "[ . 1 . 2]" 1
708 1 44 VAL MG2 1 88 ASN HD21 . . 4.690 4.538 4.319 4.691 0.001 13 0 "[ . 1 . 2]" 1
709 1 45 ARG H 1 45 ARG HB2 . . 3.670 2.350 2.147 2.726 . 0 0 "[ . 1 . 2]" 1
710 1 45 ARG H 1 45 ARG QB . . 3.210 2.200 2.128 2.244 . 0 0 "[ . 1 . 2]" 1
711 1 45 ARG H 1 45 ARG HB3 . . 3.670 3.172 2.359 3.536 . 0 0 "[ . 1 . 2]" 1
712 1 45 ARG H 1 45 ARG QD . . 4.590 4.191 3.946 4.492 . 0 0 "[ . 1 . 2]" 1
713 1 45 ARG H 1 45 ARG QG . . 4.280 3.139 2.640 4.001 . 0 0 "[ . 1 . 2]" 1
714 1 45 ARG H 1 46 TYR H . . 3.910 2.638 2.488 2.786 . 0 0 "[ . 1 . 2]" 1
715 1 45 ARG H 1 47 CYS H . . 4.640 4.245 4.016 4.483 . 0 0 "[ . 1 . 2]" 1
716 1 45 ARG HA 1 45 ARG HD2 . . 3.760 3.285 2.120 3.765 0.005 10 0 "[ . 1 . 2]" 1
717 1 45 ARG HA 1 45 ARG HD3 . . 3.760 2.188 1.998 2.989 . 0 0 "[ . 1 . 2]" 1
718 1 45 ARG HA 1 45 ARG HG2 . . 4.050 2.980 2.534 3.823 . 0 0 "[ . 1 . 2]" 1
719 1 45 ARG HA 1 45 ARG QG . . 3.490 2.727 2.488 3.122 . 0 0 "[ . 1 . 2]" 1
720 1 45 ARG HA 1 45 ARG HG3 . . 4.050 3.535 3.193 3.674 . 0 0 "[ . 1 . 2]" 1
721 1 45 ARG HA 1 47 CYS H . . 4.800 4.494 4.215 4.803 0.003 8 0 "[ . 1 . 2]" 1
722 1 45 ARG HA 1 48 THR H . . 4.610 3.637 3.270 3.871 . 0 0 "[ . 1 . 2]" 1
723 1 45 ARG HA 1 48 THR HB . . 3.890 2.849 2.551 3.614 . 0 0 "[ . 1 . 2]" 1
724 1 45 ARG HA 1 48 THR MG . . 4.660 4.202 3.953 4.579 . 0 0 "[ . 1 . 2]" 1
725 1 45 ARG HA 1 49 ASP H . . 4.590 4.035 3.381 4.214 . 0 0 "[ . 1 . 2]" 1
726 1 45 ARG QB 1 45 ARG QD . . 3.060 2.384 2.197 2.829 . 0 0 "[ . 1 . 2]" 1
727 1 45 ARG QB 1 46 TYR H . . 3.420 2.704 2.478 2.936 . 0 0 "[ . 1 . 2]" 1
728 1 45 ARG QB 1 47 CYS H . . 5.590 4.817 4.515 5.078 . 0 0 "[ . 1 . 2]" 1
729 1 45 ARG HB2 1 46 TYR H . . 4.110 3.188 2.593 4.099 . 0 0 "[ . 1 . 2]" 1
730 1 45 ARG HB3 1 46 TYR H . . 4.110 3.185 2.758 3.635 . 0 0 "[ . 1 . 2]" 1
731 1 45 ARG QD 1 46 TYR H . . 5.110 4.710 4.406 4.913 . 0 0 "[ . 1 . 2]" 1
732 1 45 ARG QD 1 49 ASP H . . 4.950 4.522 3.436 4.936 . 0 0 "[ . 1 . 2]" 1
733 1 45 ARG QG 1 46 TYR H . . 4.770 4.126 3.506 4.489 . 0 0 "[ . 1 . 2]" 1
734 1 46 TYR H 1 46 TYR HB2 . . 3.330 2.719 2.641 2.837 . 0 0 "[ . 1 . 2]" 1
735 1 46 TYR H 1 46 TYR QB . . 2.850 2.227 2.174 2.241 . 0 0 "[ . 1 . 2]" 1
736 1 46 TYR H 1 46 TYR HB3 . . 3.330 2.367 2.258 2.421 . 0 0 "[ . 1 . 2]" 1
737 1 46 TYR H 1 46 TYR QD . . 4.240 4.172 4.133 4.190 . 0 0 "[ . 1 . 2]" 1
738 1 46 TYR H 1 48 THR H . . 4.990 4.221 3.814 4.583 . 0 0 "[ . 1 . 2]" 1
739 1 46 TYR HA 1 46 TYR QD . . 3.500 2.532 2.284 2.658 . 0 0 "[ . 1 . 2]" 1
740 1 46 TYR HA 1 49 ASP H . . 4.560 3.674 3.399 4.040 . 0 0 "[ . 1 . 2]" 1
741 1 46 TYR HA 1 49 ASP HB2 . . 4.830 3.034 2.572 3.854 . 0 0 "[ . 1 . 2]" 1
742 1 46 TYR HA 1 49 ASP QB . . 4.120 2.741 2.540 2.979 . 0 0 "[ . 1 . 2]" 1
743 1 46 TYR HA 1 49 ASP HB3 . . 4.830 3.695 2.784 4.599 . 0 0 "[ . 1 . 2]" 1
744 1 46 TYR QB 1 47 CYS H . . 3.360 2.580 2.389 2.722 . 0 0 "[ . 1 . 2]" 1
745 1 46 TYR HB2 1 47 CYS H . . 4.120 3.956 3.832 4.047 . 0 0 "[ . 1 . 2]" 1
746 1 46 TYR HB3 1 47 CYS H . . 4.120 2.616 2.413 2.767 . 0 0 "[ . 1 . 2]" 1
747 1 46 TYR QD 1 47 CYS H . . 3.560 3.511 3.327 3.572 0.012 16 0 "[ . 1 . 2]" 1
748 1 46 TYR QD 1 47 CYS HA . . 4.330 3.863 3.677 4.135 . 0 0 "[ . 1 . 2]" 1
749 1 46 TYR QD 1 50 LEU MD1 . . 4.740 3.534 2.377 3.968 . 0 0 "[ . 1 . 2]" 1
750 1 46 TYR QD 1 50 LEU QD . . 3.870 3.377 2.355 3.751 . 0 0 "[ . 1 . 2]" 1
751 1 46 TYR QD 1 50 LEU MD2 . . 4.740 4.345 3.836 4.745 0.005 12 0 "[ . 1 . 2]" 1
752 1 46 TYR QD 1 50 LEU HG . . 5.230 4.200 3.482 5.329 0.099 16 0 "[ . 1 . 2]" 1
753 1 46 TYR QD 1 59 LEU QD . . 6.310 4.551 4.080 5.353 . 0 0 "[ . 1 . 2]" 1
754 1 46 TYR QD 1 62 VAL MG1 . . 4.530 4.138 3.905 4.263 . 0 0 "[ . 1 . 2]" 1
755 1 46 TYR QD 1 62 VAL QG . . 3.890 3.774 3.471 3.900 0.010 13 0 "[ . 1 . 2]" 1
756 1 46 TYR QD 1 62 VAL MG2 . . 4.530 4.358 3.881 4.538 0.008 13 0 "[ . 1 . 2]" 1
757 1 46 TYR QD 1 66 MET ME . . 5.260 5.115 4.885 5.264 0.004 13 0 "[ . 1 . 2]" 1
758 1 46 TYR QE 1 50 LEU MD1 . . 4.490 2.921 1.890 3.272 . 0 0 "[ . 1 . 2]" 1
759 1 46 TYR QE 1 50 LEU QD . . 3.840 2.717 1.857 3.052 . 0 0 "[ . 1 . 2]" 1
760 1 46 TYR QE 1 50 LEU MD2 . . 4.490 3.288 2.654 3.721 . 0 0 "[ . 1 . 2]" 1
761 1 46 TYR QE 1 62 VAL MG1 . . 3.740 3.706 3.059 3.751 0.011 19 0 "[ . 1 . 2]" 1
762 1 46 TYR QE 1 62 VAL QG . . 3.270 2.848 2.368 2.999 . 0 0 "[ . 1 . 2]" 1
763 1 46 TYR QE 1 62 VAL MG2 . . 3.740 2.965 2.465 3.156 . 0 0 "[ . 1 . 2]" 1
764 1 47 CYS H 1 47 CYS HB2 . . 3.610 2.492 2.340 2.720 . 0 0 "[ . 1 . 2]" 1
765 1 47 CYS H 1 47 CYS QB . . 2.920 2.412 2.220 2.568 . 0 0 "[ . 1 . 2]" 1
766 1 47 CYS H 1 47 CYS HB3 . . 3.610 3.471 2.354 3.603 . 0 0 "[ . 1 . 2]" 1
767 1 47 CYS H 1 48 THR H . . 3.760 2.672 2.482 2.813 . 0 0 "[ . 1 . 2]" 1
768 1 47 CYS H 1 48 THR HA . . 5.470 5.273 5.133 5.398 . 0 0 "[ . 1 . 2]" 1
769 1 47 CYS H 1 49 ASP H . . 4.470 3.972 3.762 4.289 . 0 0 "[ . 1 . 2]" 1
770 1 47 CYS H 1 59 LEU QD . . 4.980 4.274 3.976 4.996 0.016 14 0 "[ . 1 . 2]" 1
771 1 47 CYS H 1 66 MET ME . . 6.350 5.779 5.488 6.049 . 0 0 "[ . 1 . 2]" 1
772 1 47 CYS H 1 89 VAL QG . . 4.500 3.981 3.737 4.533 0.033 13 0 "[ . 1 . 2]" 1
773 1 47 CYS HA 1 49 ASP H . . 4.750 4.211 3.909 4.782 0.032 16 0 "[ . 1 . 2]" 1
774 1 47 CYS HA 1 50 LEU HB2 . . 4.610 3.077 2.507 3.361 . 0 0 "[ . 1 . 2]" 1
775 1 47 CYS HA 1 50 LEU HB3 . . 4.910 4.594 3.698 4.912 0.002 14 0 "[ . 1 . 2]" 1
776 1 47 CYS HA 1 50 LEU MD1 . . 4.960 2.281 1.897 3.529 . 0 0 "[ . 1 . 2]" 1
777 1 47 CYS HA 1 50 LEU QD . . 3.950 2.242 1.895 2.852 . 0 0 "[ . 1 . 2]" 1
778 1 47 CYS HA 1 50 LEU MD2 . . 4.960 4.529 3.012 4.963 0.003 13 0 "[ . 1 . 2]" 1
779 1 47 CYS HA 1 50 LEU HG . . 5.090 3.457 2.795 5.107 0.017 16 0 "[ . 1 . 2]" 1
780 1 47 CYS HA 1 51 ILE MD . . 5.420 4.563 4.292 4.868 . 0 0 "[ . 1 . 2]" 1
781 1 47 CYS HA 1 59 LEU QB . . 5.330 3.321 2.628 4.137 . 0 0 "[ . 1 . 2]" 1
782 1 47 CYS HA 1 59 LEU MD1 . . 4.730 3.050 2.037 3.910 . 0 0 "[ . 1 . 2]" 1
783 1 47 CYS HA 1 59 LEU QD . . 3.730 2.625 2.026 3.228 . 0 0 "[ . 1 . 2]" 1
784 1 47 CYS HA 1 59 LEU MD2 . . 4.730 3.097 2.412 3.697 . 0 0 "[ . 1 . 2]" 1
785 1 47 CYS QB 1 59 LEU QD . . 3.410 1.939 1.714 3.249 . 0 0 "[ . 1 . 2]" 1
786 1 47 CYS QB 1 89 VAL HA . . 5.460 4.024 3.756 4.659 . 0 0 "[ . 1 . 2]" 1
787 1 47 CYS QB 1 89 VAL QG . . 3.420 1.885 1.778 2.503 . 0 0 "[ . 1 . 2]" 1
788 1 47 CYS HB2 1 48 THR H . . 4.430 2.630 2.283 3.928 . 0 0 "[ . 1 . 2]" 1
789 1 47 CYS HB2 1 59 LEU MD1 . . 5.350 3.361 2.822 3.747 . 0 0 "[ . 1 . 2]" 1
790 1 47 CYS HB2 1 59 LEU MD2 . . 5.350 3.625 3.294 4.342 . 0 0 "[ . 1 . 2]" 1
791 1 47 CYS HB3 1 48 THR H . . 4.430 3.419 2.398 3.836 . 0 0 "[ . 1 . 2]" 1
792 1 47 CYS HB3 1 59 LEU MD1 . . 5.350 2.247 1.905 4.435 . 0 0 "[ . 1 . 2]" 1
793 1 47 CYS HB3 1 59 LEU MD2 . . 5.350 2.402 1.915 4.579 . 0 0 "[ . 1 . 2]" 1
794 1 48 THR H 1 48 THR MG . . 3.820 3.758 3.620 3.773 . 0 0 "[ . 1 . 2]" 1
795 1 48 THR H 1 49 ASP H . . 3.610 2.666 2.428 2.850 . 0 0 "[ . 1 . 2]" 1
796 1 48 THR H 1 51 ILE MD . . 4.520 4.206 3.877 4.404 . 0 0 "[ . 1 . 2]" 1
797 1 48 THR H 1 89 VAL HA . . 5.590 5.038 4.749 5.558 . 0 0 "[ . 1 . 2]" 1
798 1 48 THR H 1 92 VAL QG . . 4.940 4.308 4.004 4.581 . 0 0 "[ . 1 . 2]" 1
799 1 48 THR HA 1 48 THR MG . . 3.610 2.268 2.014 2.315 . 0 0 "[ . 1 . 2]" 1
800 1 48 THR HA 1 51 ILE H . . 3.850 3.540 3.300 3.725 . 0 0 "[ . 1 . 2]" 1
801 1 48 THR HA 1 51 ILE HB . . 4.000 3.332 2.945 3.554 . 0 0 "[ . 1 . 2]" 1
802 1 48 THR HA 1 51 ILE MD . . 3.610 2.164 1.947 2.359 . 0 0 "[ . 1 . 2]" 1
803 1 48 THR HA 1 51 ILE MG . . 4.930 4.639 4.322 4.831 . 0 0 "[ . 1 . 2]" 1
804 1 48 THR HA 1 52 GLU H . . 5.270 4.792 4.405 4.984 . 0 0 "[ . 1 . 2]" 1
805 1 48 THR HA 1 92 VAL MG1 . . 4.100 2.939 2.682 3.475 . 0 0 "[ . 1 . 2]" 1
806 1 48 THR HA 1 92 VAL QG . . 3.540 2.748 2.559 3.144 . 0 0 "[ . 1 . 2]" 1
807 1 48 THR HA 1 92 VAL MG2 . . 4.100 3.365 2.911 3.769 . 0 0 "[ . 1 . 2]" 1
808 1 48 THR HB 1 49 ASP H . . 4.090 2.813 2.332 3.039 . 0 0 "[ . 1 . 2]" 1
809 1 48 THR HB 1 51 ILE MD . . 5.140 4.778 4.495 4.956 . 0 0 "[ . 1 . 2]" 1
810 1 48 THR HB 1 92 VAL MG1 . . 5.070 4.590 4.355 5.099 0.029 13 0 "[ . 1 . 2]" 1
811 1 48 THR HB 1 92 VAL QG . . 4.350 3.996 3.747 4.298 . 0 0 "[ . 1 . 2]" 1
812 1 48 THR HB 1 92 VAL MG2 . . 5.070 4.412 4.049 4.817 . 0 0 "[ . 1 . 2]" 1
813 1 48 THR MG 1 49 ASP H . . 3.950 3.715 3.400 3.978 0.028 13 0 "[ . 1 . 2]" 1
814 1 48 THR MG 1 51 ILE H . . 4.870 4.572 4.287 4.826 . 0 0 "[ . 1 . 2]" 1
815 1 48 THR MG 1 51 ILE MD . . 3.680 3.145 2.826 3.428 . 0 0 "[ . 1 . 2]" 1
816 1 48 THR MG 1 51 ILE MG . . 4.550 4.370 3.989 4.564 0.014 16 0 "[ . 1 . 2]" 1
817 1 48 THR MG 1 52 GLU H . . 4.750 4.516 4.152 4.678 . 0 0 "[ . 1 . 2]" 1
818 1 48 THR MG 1 52 GLU QG . . 3.950 3.050 2.630 3.237 . 0 0 "[ . 1 . 2]" 1
819 1 48 THR MG 1 89 VAL HA . . 4.980 4.657 4.144 5.000 0.020 13 0 "[ . 1 . 2]" 1
820 1 48 THR MG 1 92 VAL HB . . 5.490 3.228 2.952 3.726 . 0 0 "[ . 1 . 2]" 1
821 1 49 ASP H 1 49 ASP HB2 . . 3.770 2.361 2.165 2.852 . 0 0 "[ . 1 . 2]" 1
822 1 49 ASP H 1 49 ASP QB . . 3.190 2.230 2.144 2.378 . 0 0 "[ . 1 . 2]" 1
823 1 49 ASP H 1 49 ASP HB3 . . 3.770 3.122 2.311 3.581 . 0 0 "[ . 1 . 2]" 1
824 1 49 ASP H 1 51 ILE H . . 4.560 4.361 4.211 4.543 . 0 0 "[ . 1 . 2]" 1
825 1 49 ASP H 1 51 ILE MD . . 5.170 4.908 4.695 5.174 0.004 14 0 "[ . 1 . 2]" 1
826 1 49 ASP H 1 52 GLU H . . 5.120 4.988 4.856 5.070 . 0 0 "[ . 1 . 2]" 1
827 1 49 ASP HA 1 52 GLU H . . 3.870 3.512 3.374 3.587 . 0 0 "[ . 1 . 2]" 1
828 1 49 ASP HA 1 52 GLU HB2 . . 4.250 2.928 2.744 3.087 . 0 0 "[ . 1 . 2]" 1
829 1 49 ASP HA 1 52 GLU HG2 . . 4.950 3.530 2.572 4.413 . 0 0 "[ . 1 . 2]" 1
830 1 49 ASP HA 1 52 GLU QG . . 4.080 2.622 2.075 3.214 . 0 0 "[ . 1 . 2]" 1
831 1 49 ASP HA 1 52 GLU HG3 . . 4.950 2.807 2.084 3.371 . 0 0 "[ . 1 . 2]" 1
832 1 49 ASP HA 1 53 GLU H . . 5.010 4.993 4.922 5.019 0.009 19 0 "[ . 1 . 2]" 1
833 1 49 ASP QB 1 52 GLU HB2 . . 5.020 4.427 4.028 4.794 . 0 0 "[ . 1 . 2]" 1
834 1 50 LEU HA 1 50 LEU QD . . 3.230 2.104 1.964 2.549 . 0 0 "[ . 1 . 2]" 1
835 1 50 LEU HA 1 51 ILE HA . . 5.590 4.801 4.773 4.827 . 0 0 "[ . 1 . 2]" 1
836 1 50 LEU HA 1 53 GLU H . . 4.090 3.435 3.382 3.517 . 0 0 "[ . 1 . 2]" 1
837 1 50 LEU HA 1 54 LYS H . . 5.100 5.013 4.948 5.108 0.008 16 0 "[ . 1 . 2]" 1
838 1 50 LEU HA 1 55 ASP H . . 4.380 3.639 3.542 3.833 . 0 0 "[ . 1 . 2]" 1
839 1 50 LEU HA 1 55 ASP HB2 . . 4.770 3.420 2.670 4.057 . 0 0 "[ . 1 . 2]" 1
840 1 50 LEU HA 1 55 ASP HB3 . . 4.850 3.505 2.664 4.527 . 0 0 "[ . 1 . 2]" 1
841 1 50 LEU HB2 1 51 ILE H . . 3.770 2.560 2.404 3.200 . 0 0 "[ . 1 . 2]" 1
842 1 50 LEU HB2 1 56 LEU HA . . 5.080 3.089 2.733 3.822 . 0 0 "[ . 1 . 2]" 1
843 1 50 LEU HB3 1 50 LEU MD1 . . 3.610 2.500 2.207 3.195 . 0 0 "[ . 1 . 2]" 1
844 1 50 LEU HB3 1 50 LEU QD . . 3.120 2.099 1.965 2.158 . 0 0 "[ . 1 . 2]" 1
845 1 50 LEU HB3 1 50 LEU MD2 . . 3.610 2.281 2.023 2.371 . 0 0 "[ . 1 . 2]" 1
846 1 50 LEU HB3 1 53 GLU H . . 5.180 4.978 4.920 5.141 . 0 0 "[ . 1 . 2]" 1
847 1 50 LEU HB3 1 56 LEU H . . 4.440 3.634 3.442 3.966 . 0 0 "[ . 1 . 2]" 1
848 1 50 LEU HB3 1 56 LEU HA . . 4.270 2.300 2.145 2.416 . 0 0 "[ . 1 . 2]" 1
849 1 50 LEU HB3 1 57 GLU H . . 5.410 4.696 4.452 5.221 . 0 0 "[ . 1 . 2]" 1
850 1 50 LEU QD 1 53 GLU QG . . 4.240 3.084 2.947 3.443 . 0 0 "[ . 1 . 2]" 1
851 1 50 LEU QD 1 55 ASP H . . 4.440 3.926 3.784 4.392 . 0 0 "[ . 1 . 2]" 1
852 1 50 LEU QD 1 55 ASP HA . . 4.750 4.064 3.893 4.444 . 0 0 "[ . 1 . 2]" 1
853 1 50 LEU QD 1 55 ASP HB2 . . 3.720 2.765 1.965 3.496 . 0 0 "[ . 1 . 2]" 1
854 1 50 LEU QD 1 55 ASP HB3 . . 3.730 2.238 1.882 3.282 . 0 0 "[ . 1 . 2]" 1
855 1 50 LEU QD 1 56 LEU H . . 4.960 4.269 4.166 4.369 . 0 0 "[ . 1 . 2]" 1
856 1 50 LEU QD 1 56 LEU HA . . 4.280 2.828 2.391 2.993 . 0 0 "[ . 1 . 2]" 1
857 1 50 LEU QD 1 58 LYS H . . 4.110 3.670 2.872 3.940 . 0 0 "[ . 1 . 2]" 1
858 1 50 LEU QD 1 58 LYS QB . . 3.550 2.877 1.895 3.562 0.012 7 0 "[ . 1 . 2]" 1
859 1 50 LEU QD 1 58 LYS QE . . 4.050 3.499 1.882 4.128 0.078 12 0 "[ . 1 . 2]" 1
860 1 50 LEU QD 1 58 LYS QG . . 4.750 3.935 1.936 4.561 . 0 0 "[ . 1 . 2]" 1
861 1 50 LEU QD 1 59 LEU H . . 3.980 2.670 2.175 2.950 . 0 0 "[ . 1 . 2]" 1
862 1 50 LEU QD 1 59 LEU HA . . 3.930 3.051 2.970 3.174 . 0 0 "[ . 1 . 2]" 1
863 1 50 LEU QD 1 59 LEU QB . . 4.070 1.914 1.815 2.265 . 0 0 "[ . 1 . 2]" 1
864 1 50 LEU QD 1 59 LEU QD . . 3.850 2.665 2.350 3.272 . 0 0 "[ . 1 . 2]" 1
865 1 50 LEU QD 1 60 ASP H . . 4.690 4.615 4.320 4.709 0.019 13 0 "[ . 1 . 2]" 1
866 1 50 LEU QD 1 62 VAL HB . . 5.120 4.808 4.624 5.005 . 0 0 "[ . 1 . 2]" 1
867 1 50 LEU QD 1 62 VAL QG . . 3.970 3.440 3.304 3.566 . 0 0 "[ . 1 . 2]" 1
868 1 50 LEU MD1 1 58 LYS H . . 5.040 4.174 3.340 5.110 0.070 16 0 "[ . 1 . 2]" 1
869 1 50 LEU MD1 1 58 LYS HB2 . . 4.810 3.497 1.936 4.431 . 0 0 "[ . 1 . 2]" 1
870 1 50 LEU MD1 1 58 LYS HB3 . . 4.810 3.984 3.117 4.636 . 0 0 "[ . 1 . 2]" 1
871 1 50 LEU MD1 1 58 LYS QE . . 5.530 4.517 3.331 5.527 . 0 0 "[ . 1 . 2]" 1
872 1 50 LEU MD1 1 59 LEU H . . 4.710 2.844 2.254 4.733 0.023 16 0 "[ . 1 . 2]" 1
873 1 50 LEU MD2 1 58 LYS H . . 5.040 4.212 2.887 4.960 . 0 0 "[ . 1 . 2]" 1
874 1 50 LEU MD2 1 58 LYS HB2 . . 4.810 3.592 1.968 4.813 0.003 7 0 "[ . 1 . 2]" 1
875 1 50 LEU MD2 1 58 LYS HB3 . . 4.810 4.395 3.011 4.814 0.004 3 0 "[ . 1 . 2]" 1
876 1 50 LEU MD2 1 58 LYS QE . . 5.530 3.696 1.891 4.745 . 0 0 "[ . 1 . 2]" 1
877 1 50 LEU MD2 1 59 LEU H . . 4.710 4.004 2.179 4.708 . 0 0 "[ . 1 . 2]" 1
878 1 50 LEU HG 1 53 GLU QG . . 6.050 4.612 3.515 4.959 . 0 0 "[ . 1 . 2]" 1
879 1 51 ILE H 1 51 ILE MD . . 3.190 3.021 2.881 3.196 0.006 11 0 "[ . 1 . 2]" 1
880 1 51 ILE H 1 51 ILE HG13 . . 2.850 2.148 2.038 2.250 . 0 0 "[ . 1 . 2]" 1
881 1 51 ILE H 1 52 GLU H . . 3.730 2.656 2.581 2.720 . 0 0 "[ . 1 . 2]" 1
882 1 51 ILE H 1 52 GLU HA . . 5.300 5.241 5.170 5.307 0.007 11 0 "[ . 1 . 2]" 1
883 1 51 ILE H 1 52 GLU QG . . 4.360 4.211 3.885 4.362 0.002 6 0 "[ . 1 . 2]" 1
884 1 51 ILE H 1 53 GLU H . . 4.220 4.178 4.144 4.225 0.005 14 0 "[ . 1 . 2]" 1
885 1 51 ILE H 1 56 LEU QD . . 4.730 4.530 4.358 4.727 . 0 0 "[ . 1 . 2]" 1
886 1 51 ILE H 1 59 LEU QB . . 4.980 4.864 4.682 4.990 0.010 14 0 "[ . 1 . 2]" 1
887 1 51 ILE HA 1 51 ILE MD . . 3.910 3.864 3.845 3.882 . 0 0 "[ . 1 . 2]" 1
888 1 51 ILE HA 1 51 ILE HG12 . . 3.850 2.889 2.772 2.973 . 0 0 "[ . 1 . 2]" 1
889 1 51 ILE HA 1 51 ILE HG13 . . 3.980 2.629 2.563 2.736 . 0 0 "[ . 1 . 2]" 1
890 1 51 ILE HA 1 51 ILE MG . . 3.290 2.316 2.309 2.355 . 0 0 "[ . 1 . 2]" 1
891 1 51 ILE HA 1 53 GLU H . . 4.360 3.933 3.891 3.972 . 0 0 "[ . 1 . 2]" 1
892 1 51 ILE HA 1 54 LYS H . . 3.570 3.321 3.262 3.362 . 0 0 "[ . 1 . 2]" 1
893 1 51 ILE HA 1 54 LYS HA . . 4.620 3.435 3.353 3.495 . 0 0 "[ . 1 . 2]" 1
894 1 51 ILE HA 1 55 ASP H . . 4.190 3.814 3.753 3.871 . 0 0 "[ . 1 . 2]" 1
895 1 51 ILE HA 1 56 LEU HA . . 5.760 4.144 3.896 4.249 . 0 0 "[ . 1 . 2]" 1
896 1 51 ILE HA 1 56 LEU QD . . 4.030 2.798 2.657 2.975 . 0 0 "[ . 1 . 2]" 1
897 1 51 ILE HA 1 59 LEU QD . . 5.160 4.406 3.967 4.936 . 0 0 "[ . 1 . 2]" 1
898 1 51 ILE HA 1 97 TYR QE . . 4.770 4.665 4.426 4.782 0.012 16 0 "[ . 1 . 2]" 1
899 1 51 ILE HB 1 51 ILE MD . . 3.490 2.097 2.055 2.156 . 0 0 "[ . 1 . 2]" 1
900 1 51 ILE HB 1 52 GLU H . . 3.740 3.011 2.853 3.056 . 0 0 "[ . 1 . 2]" 1
901 1 51 ILE MD 1 51 ILE MG . . 2.590 2.507 2.354 2.595 0.005 1 0 "[ . 1 . 2]" 1
902 1 51 ILE MD 1 52 GLU H . . 4.630 4.447 4.337 4.570 . 0 0 "[ . 1 . 2]" 1
903 1 51 ILE MD 1 56 LEU QD . . 4.030 3.485 3.226 3.680 . 0 0 "[ . 1 . 2]" 1
904 1 51 ILE MD 1 59 LEU MD1 . . 4.160 3.638 2.217 4.169 0.009 12 0 "[ . 1 . 2]" 1
905 1 51 ILE MD 1 59 LEU QD . . 3.450 2.254 2.074 2.503 . 0 0 "[ . 1 . 2]" 1
906 1 51 ILE MD 1 59 LEU MD2 . . 4.160 2.627 2.084 4.070 . 0 0 "[ . 1 . 2]" 1
907 1 51 ILE MD 1 89 VAL HA . . 3.950 3.324 2.944 3.837 . 0 0 "[ . 1 . 2]" 1
908 1 51 ILE MD 1 89 VAL QG . . 4.540 3.445 3.076 3.953 . 0 0 "[ . 1 . 2]" 1
909 1 51 ILE MD 1 92 VAL H . . 5.110 4.741 4.496 5.119 0.009 14 0 "[ . 1 . 2]" 1
910 1 51 ILE MD 1 92 VAL QG . . 4.690 1.899 1.788 2.219 . 0 0 "[ . 1 . 2]" 1
911 1 51 ILE MD 1 93 LEU HA . . 3.660 3.422 3.205 3.617 . 0 0 "[ . 1 . 2]" 1
912 1 51 ILE MD 1 93 LEU HB3 . . 3.660 2.137 1.981 2.290 . 0 0 "[ . 1 . 2]" 1
913 1 51 ILE MD 1 93 LEU HG . . 4.720 4.500 4.327 4.643 . 0 0 "[ . 1 . 2]" 1
914 1 51 ILE MD 1 96 THR MG . . 4.560 4.288 4.040 4.500 . 0 0 "[ . 1 . 2]" 1
915 1 51 ILE MD 1 97 TYR QE . . 4.880 4.655 4.188 4.890 0.010 12 0 "[ . 1 . 2]" 1
916 1 51 ILE HG12 1 51 ILE MG . . 3.370 2.107 2.037 2.238 . 0 0 "[ . 1 . 2]" 1
917 1 51 ILE HG13 1 51 ILE MG . . 3.580 3.116 3.089 3.152 . 0 0 "[ . 1 . 2]" 1
918 1 51 ILE HG13 1 59 LEU QD . . 3.700 2.531 2.290 2.942 . 0 0 "[ . 1 . 2]" 1
919 1 51 ILE MG 1 52 GLU H . . 4.060 3.763 3.670 3.802 . 0 0 "[ . 1 . 2]" 1
920 1 51 ILE MG 1 52 GLU HA . . 4.470 3.715 3.587 3.760 . 0 0 "[ . 1 . 2]" 1
921 1 51 ILE MG 1 52 GLU QG . . 4.430 4.023 3.837 4.260 . 0 0 "[ . 1 . 2]" 1
922 1 51 ILE MG 1 54 LYS H . . 4.300 4.105 3.998 4.211 . 0 0 "[ . 1 . 2]" 1
923 1 51 ILE MG 1 56 LEU QD . . 4.570 2.320 2.056 2.452 . 0 0 "[ . 1 . 2]" 1
924 1 51 ILE MG 1 92 VAL QG . . 3.800 2.986 2.642 3.296 . 0 0 "[ . 1 . 2]" 1
925 1 51 ILE MG 1 93 LEU HA . . 3.590 2.685 2.346 2.948 . 0 0 "[ . 1 . 2]" 1
926 1 51 ILE MG 1 93 LEU MD1 . . 4.420 4.162 3.957 4.293 . 0 0 "[ . 1 . 2]" 1
927 1 51 ILE MG 1 96 THR HB . . 3.950 3.842 3.639 3.963 0.013 12 0 "[ . 1 . 2]" 1
928 1 51 ILE MG 1 96 THR MG . . 3.230 2.392 2.247 2.514 . 0 0 "[ . 1 . 2]" 1
929 1 51 ILE MG 1 97 TYR QD . . 3.680 3.680 3.631 3.695 0.015 17 0 "[ . 1 . 2]" 1
930 1 51 ILE MG 1 97 TYR QE . . 3.020 2.731 2.568 2.849 . 0 0 "[ . 1 . 2]" 1
931 1 52 GLU H 1 52 GLU HB2 . . 3.380 2.425 2.330 2.558 . 0 0 "[ . 1 . 2]" 1
932 1 52 GLU H 1 52 GLU HB3 . . 3.660 3.591 3.569 3.605 . 0 0 "[ . 1 . 2]" 1
933 1 52 GLU H 1 52 GLU QG . . 4.060 2.402 2.170 2.589 . 0 0 "[ . 1 . 2]" 1
934 1 52 GLU H 1 53 GLU H . . 3.430 2.477 2.441 2.553 . 0 0 "[ . 1 . 2]" 1
935 1 52 GLU H 1 54 LYS H . . 4.830 3.880 3.844 3.924 . 0 0 "[ . 1 . 2]" 1
936 1 52 GLU HA 1 52 GLU HG2 . . 3.790 2.745 2.299 3.130 . 0 0 "[ . 1 . 2]" 1
937 1 52 GLU HA 1 52 GLU HG3 . . 3.790 3.556 2.797 3.787 . 0 0 "[ . 1 . 2]" 1
938 1 52 GLU HA 1 54 LYS H . . 3.960 3.864 3.827 3.878 . 0 0 "[ . 1 . 2]" 1
939 1 52 GLU HB2 1 53 GLU H . . 3.380 2.999 2.956 3.027 . 0 0 "[ . 1 . 2]" 1
940 1 52 GLU QG 1 53 GLU H . . 4.380 4.215 4.043 4.361 . 0 0 "[ . 1 . 2]" 1
941 1 53 GLU H 1 53 GLU HB2 . . 3.850 3.680 3.663 3.696 . 0 0 "[ . 1 . 2]" 1
942 1 53 GLU H 1 53 GLU HB3 . . 3.290 3.124 3.094 3.147 . 0 0 "[ . 1 . 2]" 1
943 1 53 GLU H 1 53 GLU HG2 . . 3.130 2.088 2.007 2.184 . 0 0 "[ . 1 . 2]" 1
944 1 53 GLU H 1 53 GLU HG3 . . 3.130 2.687 2.609 2.736 . 0 0 "[ . 1 . 2]" 1
945 1 53 GLU H 1 54 LYS H . . 3.190 2.331 2.309 2.352 . 0 0 "[ . 1 . 2]" 1
946 1 53 GLU H 1 54 LYS HA . . 4.440 4.449 4.436 4.462 0.022 12 0 "[ . 1 . 2]" 1
947 1 53 GLU H 1 55 ASP H . . 4.080 3.076 3.042 3.129 . 0 0 "[ . 1 . 2]" 1
948 1 53 GLU H 1 55 ASP HB2 . . 4.800 4.501 4.317 4.765 . 0 0 "[ . 1 . 2]" 1
949 1 53 GLU HA 1 53 GLU QG . . 3.580 3.326 3.322 3.331 . 0 0 "[ . 1 . 2]" 1
950 1 53 GLU HA 1 54 LYS H . . 3.380 3.120 3.102 3.144 . 0 0 "[ . 1 . 2]" 1
951 1 53 GLU HA 1 55 ASP H . . 4.290 4.279 4.259 4.286 . 0 0 "[ . 1 . 2]" 1
952 1 53 GLU HB2 1 55 ASP H . . 3.850 3.819 3.745 3.856 0.006 18 0 "[ . 1 . 2]" 1
953 1 53 GLU HB3 1 54 LYS H . . 4.560 4.541 4.522 4.549 . 0 0 "[ . 1 . 2]" 1
954 1 53 GLU HB3 1 55 ASP H . . 4.580 4.593 4.560 4.606 0.026 3 0 "[ . 1 . 2]" 1
955 1 53 GLU QG 1 54 LYS H . . 3.380 3.373 3.316 3.406 0.026 12 0 "[ . 1 . 2]" 1
956 1 53 GLU QG 1 55 ASP H . . 2.940 2.044 1.953 2.097 . 0 0 "[ . 1 . 2]" 1
957 1 53 GLU QG 1 55 ASP HB2 . . 3.860 2.014 1.977 2.170 . 0 0 "[ . 1 . 2]" 1
958 1 53 GLU HG2 1 54 LYS H . . 4.080 4.047 3.971 4.088 0.008 13 0 "[ . 1 . 2]" 1
959 1 53 GLU HG3 1 54 LYS H . . 4.080 3.613 3.518 3.673 . 0 0 "[ . 1 . 2]" 1
960 1 54 LYS H 1 54 LYS HA . . 2.690 2.275 2.274 2.277 . 0 0 "[ . 1 . 2]" 1
961 1 54 LYS H 1 54 LYS HB2 . . 3.910 3.714 3.686 3.726 . 0 0 "[ . 1 . 2]" 1
962 1 54 LYS H 1 54 LYS HB3 . . 4.050 4.012 4.005 4.031 . 0 0 "[ . 1 . 2]" 1
963 1 54 LYS H 1 54 LYS QD . . 4.880 4.482 4.217 4.691 . 0 0 "[ . 1 . 2]" 1
964 1 54 LYS H 1 54 LYS HG2 . . 3.380 2.651 2.606 2.685 . 0 0 "[ . 1 . 2]" 1
965 1 54 LYS H 1 54 LYS HG3 . . 3.800 3.666 3.590 3.851 0.051 12 0 "[ . 1 . 2]" 1
966 1 54 LYS H 1 55 ASP H . . 3.080 2.620 2.615 2.625 . 0 0 "[ . 1 . 2]" 1
967 1 54 LYS H 1 55 ASP HA . . 5.340 5.263 5.258 5.267 . 0 0 "[ . 1 . 2]" 1
968 1 54 LYS H 1 55 ASP HB2 . . 5.040 4.884 4.774 4.968 . 0 0 "[ . 1 . 2]" 1
969 1 54 LYS H 1 56 LEU H . . 4.300 4.288 4.165 4.350 0.050 13 0 "[ . 1 . 2]" 1
970 1 54 LYS H 1 56 LEU QD . . 4.800 4.511 4.424 4.620 . 0 0 "[ . 1 . 2]" 1
971 1 54 LYS H 1 56 LEU HG . . 4.260 4.252 4.157 4.321 0.061 12 0 "[ . 1 . 2]" 1
972 1 54 LYS HA 1 54 LYS HD2 . . 4.720 4.046 3.204 4.720 . 0 0 "[ . 1 . 2]" 1
973 1 54 LYS HA 1 54 LYS QD . . 3.930 3.514 3.131 3.902 . 0 0 "[ . 1 . 2]" 1
974 1 54 LYS HA 1 54 LYS HD3 . . 4.720 4.140 3.474 4.601 . 0 0 "[ . 1 . 2]" 1
975 1 54 LYS HA 1 54 LYS HE2 . . 5.450 4.580 2.900 5.512 0.062 12 0 "[ . 1 . 2]" 1
976 1 54 LYS HA 1 54 LYS HE3 . . 5.450 4.787 3.323 5.430 . 0 0 "[ . 1 . 2]" 1
977 1 54 LYS HA 1 54 LYS HG2 . . 3.790 2.618 2.598 2.637 . 0 0 "[ . 1 . 2]" 1
978 1 54 LYS HA 1 54 LYS HG3 . . 3.830 3.735 3.710 3.785 . 0 0 "[ . 1 . 2]" 1
979 1 54 LYS HA 1 55 ASP H . . 3.330 3.097 3.091 3.113 . 0 0 "[ . 1 . 2]" 1
980 1 54 LYS HA 1 56 LEU H . . 4.270 3.232 3.188 3.277 . 0 0 "[ . 1 . 2]" 1
981 1 54 LYS HA 1 56 LEU MD1 . . 4.500 3.691 3.584 3.754 . 0 0 "[ . 1 . 2]" 1
982 1 54 LYS HA 1 56 LEU QD . . 3.800 3.315 3.244 3.383 . 0 0 "[ . 1 . 2]" 1
983 1 54 LYS HA 1 56 LEU MD2 . . 4.500 3.753 3.700 3.878 . 0 0 "[ . 1 . 2]" 1
984 1 54 LYS HA 1 56 LEU HG . . 4.300 2.823 2.781 2.853 . 0 0 "[ . 1 . 2]" 1
985 1 54 LYS HB2 1 54 LYS QD . . 3.450 3.061 2.854 3.402 . 0 0 "[ . 1 . 2]" 1
986 1 54 LYS HB2 1 54 LYS QE . . 4.730 3.344 2.355 4.386 . 0 0 "[ . 1 . 2]" 1
987 1 54 LYS HB2 1 55 ASP H . . 3.940 3.852 3.826 3.861 . 0 0 "[ . 1 . 2]" 1
988 1 54 LYS HB2 1 56 LEU H . . 5.010 5.027 5.012 5.053 0.043 12 0 "[ . 1 . 2]" 1
989 1 54 LYS HB3 1 54 LYS HD2 . . 3.640 2.624 2.076 3.495 . 0 0 "[ . 1 . 2]" 1
990 1 54 LYS HB3 1 54 LYS HD3 . . 3.640 2.867 2.032 3.520 . 0 0 "[ . 1 . 2]" 1
991 1 54 LYS HB3 1 54 LYS QE . . 4.520 2.931 2.292 3.942 . 0 0 "[ . 1 . 2]" 1
992 1 54 LYS QE 1 54 LYS HG2 . . 3.600 2.800 2.098 3.332 . 0 0 "[ . 1 . 2]" 1
993 1 54 LYS QE 1 54 LYS HG3 . . 3.590 2.543 2.064 3.312 . 0 0 "[ . 1 . 2]" 1
994 1 54 LYS HE2 1 54 LYS HG2 . . 4.130 3.156 2.118 4.065 . 0 0 "[ . 1 . 2]" 1
995 1 54 LYS HE3 1 54 LYS HG2 . . 4.130 3.383 2.197 4.109 . 0 0 "[ . 1 . 2]" 1
996 1 54 LYS HG2 1 55 ASP H . . 4.660 4.629 4.575 4.658 . 0 0 "[ . 1 . 2]" 1
997 1 54 LYS HG2 1 56 LEU MD1 . . 6.540 5.780 5.661 5.872 . 0 0 "[ . 1 . 2]" 1
998 1 54 LYS HG2 1 56 LEU QD . . 5.630 5.016 4.925 5.147 . 0 0 "[ . 1 . 2]" 1
999 1 54 LYS HG2 1 56 LEU MD2 . . 6.540 5.505 5.415 5.701 . 0 0 "[ . 1 . 2]" 1
1000 1 54 LYS HG3 1 55 ASP H . . 5.250 5.028 4.951 5.186 . 0 0 "[ . 1 . 2]" 1
1001 1 55 ASP H 1 55 ASP HB2 . . 3.130 2.508 2.448 2.619 . 0 0 "[ . 1 . 2]" 1
1002 1 55 ASP H 1 55 ASP HB3 . . 3.820 3.199 2.693 3.670 . 0 0 "[ . 1 . 2]" 1
1003 1 55 ASP H 1 56 LEU H . . 3.650 2.841 2.738 2.907 . 0 0 "[ . 1 . 2]" 1
1004 1 55 ASP H 1 56 LEU HA . . 4.720 4.688 4.633 4.712 . 0 0 "[ . 1 . 2]" 1
1005 1 55 ASP H 1 56 LEU HB3 . . 5.180 4.823 4.799 4.911 . 0 0 "[ . 1 . 2]" 1
1006 1 55 ASP H 1 56 LEU QD . . 4.540 4.263 4.206 4.295 . 0 0 "[ . 1 . 2]" 1
1007 1 55 ASP HA 1 56 LEU H . . 3.180 2.924 2.881 2.981 . 0 0 "[ . 1 . 2]" 1
1008 1 55 ASP HA 1 57 GLU H . . 3.500 2.995 2.966 3.029 . 0 0 "[ . 1 . 2]" 1
1009 1 55 ASP HA 1 58 LYS H . . 4.790 4.439 4.160 4.620 . 0 0 "[ . 1 . 2]" 1
1010 1 55 ASP HA 1 59 LEU H . . 6.060 5.911 5.800 6.098 0.038 12 0 "[ . 1 . 2]" 1
1011 1 55 ASP HB2 1 56 LEU H . . 4.640 4.306 4.027 4.514 . 0 0 "[ . 1 . 2]" 1
1012 1 55 ASP HB3 1 56 LEU H . . 4.650 4.259 4.031 4.471 . 0 0 "[ . 1 . 2]" 1
1013 1 55 ASP HB3 1 58 LYS H . . 5.240 4.865 4.234 5.252 0.012 17 0 "[ . 1 . 2]" 1
1014 1 55 ASP HB3 1 59 LEU H . . 5.860 5.695 5.552 5.872 0.012 2 0 "[ . 1 . 2]" 1
1015 1 56 LEU H 1 56 LEU HB2 . . 3.610 3.535 3.524 3.539 . 0 0 "[ . 1 . 2]" 1
1016 1 56 LEU H 1 56 LEU HB3 . . 3.480 2.932 2.875 2.957 . 0 0 "[ . 1 . 2]" 1
1017 1 56 LEU H 1 56 LEU MD1 . . 3.600 2.149 2.116 2.263 . 0 0 "[ . 1 . 2]" 1
1018 1 56 LEU H 1 56 LEU QD . . 3.060 2.133 2.102 2.240 . 0 0 "[ . 1 . 2]" 1
1019 1 56 LEU H 1 56 LEU MD2 . . 3.600 3.591 3.577 3.597 . 0 0 "[ . 1 . 2]" 1
1020 1 56 LEU H 1 56 LEU HG . . 3.130 1.909 1.884 1.918 . 0 0 "[ . 1 . 2]" 1
1021 1 56 LEU H 1 57 GLU QB . . 4.790 4.589 4.506 4.693 . 0 0 "[ . 1 . 2]" 1
1022 1 56 LEU HA 1 56 LEU MD1 . . 4.180 3.466 3.454 3.474 . 0 0 "[ . 1 . 2]" 1
1023 1 56 LEU HA 1 56 LEU QD . . 3.420 3.293 3.288 3.296 . 0 0 "[ . 1 . 2]" 1
1024 1 56 LEU HA 1 56 LEU MD2 . . 4.180 4.107 4.096 4.127 . 0 0 "[ . 1 . 2]" 1
1025 1 56 LEU HA 1 58 LYS H . . 4.310 4.033 3.725 4.200 . 0 0 "[ . 1 . 2]" 1
1026 1 56 LEU HA 1 59 LEU H . . 3.150 3.000 2.963 3.059 . 0 0 "[ . 1 . 2]" 1
1027 1 56 LEU HA 1 59 LEU HB2 . . 4.160 3.161 2.150 4.180 0.020 11 0 "[ . 1 . 2]" 1
1028 1 56 LEU HA 1 59 LEU HB3 . . 4.160 2.522 2.083 3.053 . 0 0 "[ . 1 . 2]" 1
1029 1 56 LEU HA 1 59 LEU QD . . 4.170 2.835 1.949 3.466 . 0 0 "[ . 1 . 2]" 1
1030 1 56 LEU HA 1 60 ASP H . . 4.410 4.294 4.174 4.451 0.041 12 0 "[ . 1 . 2]" 1
1031 1 56 LEU HB2 1 57 GLU H . . 4.060 4.038 3.949 4.079 0.019 13 0 "[ . 1 . 2]" 1
1032 1 56 LEU HB2 1 59 LEU H . . 4.730 4.527 4.407 4.681 . 0 0 "[ . 1 . 2]" 1
1033 1 56 LEU HB2 1 60 ASP H . . 4.530 4.113 3.863 4.501 . 0 0 "[ . 1 . 2]" 1
1034 1 56 LEU HB3 1 56 LEU MD1 . . 3.450 3.188 3.186 3.189 . 0 0 "[ . 1 . 2]" 1
1035 1 56 LEU HB3 1 56 LEU MD2 . . 3.450 2.407 2.332 2.458 . 0 0 "[ . 1 . 2]" 1
1036 1 56 LEU HB3 1 57 GLU H . . 4.530 4.442 4.407 4.472 . 0 0 "[ . 1 . 2]" 1
1037 1 56 LEU QD 1 57 GLU H . . 3.550 2.175 2.055 2.296 . 0 0 "[ . 1 . 2]" 1
1038 1 56 LEU QD 1 57 GLU QB . . 4.630 3.607 3.412 3.762 . 0 0 "[ . 1 . 2]" 1
1039 1 56 LEU QD 1 57 GLU QG . . 3.930 2.499 2.283 2.731 . 0 0 "[ . 1 . 2]" 1
1040 1 56 LEU QD 1 58 LYS H . . 4.960 4.394 4.185 4.529 . 0 0 "[ . 1 . 2]" 1
1041 1 56 LEU QD 1 59 LEU H . . 4.950 4.589 4.490 4.727 . 0 0 "[ . 1 . 2]" 1
1042 1 56 LEU QD 1 59 LEU QB . . 4.630 4.043 3.808 4.632 0.002 18 0 "[ . 1 . 2]" 1
1043 1 56 LEU QD 1 59 LEU QD . . 3.740 3.451 2.868 3.787 0.047 12 0 "[ . 1 . 2]" 1
1044 1 56 LEU QD 1 60 ASP H . . 4.860 4.259 4.127 4.458 . 0 0 "[ . 1 . 2]" 1
1045 1 56 LEU QD 1 93 LEU MD2 . . 4.650 3.526 3.133 3.881 . 0 0 "[ . 1 . 2]" 1
1046 1 56 LEU QD 1 97 TYR QD . . 4.600 3.682 3.483 3.764 . 0 0 "[ . 1 . 2]" 1
1047 1 56 LEU QD 1 97 TYR QE . . 2.960 1.945 1.869 1.997 . 0 0 "[ . 1 . 2]" 1
1048 1 56 LEU MD1 1 57 GLU H . . 4.820 2.178 2.058 2.301 . 0 0 "[ . 1 . 2]" 1
1049 1 56 LEU MD1 1 97 TYR QE . . 3.940 3.959 3.932 3.994 0.054 12 0 "[ . 1 . 2]" 1
1050 1 56 LEU MD2 1 57 GLU H . . 4.820 4.668 4.560 4.743 . 0 0 "[ . 1 . 2]" 1
1051 1 56 LEU MD2 1 97 TYR QE . . 3.940 1.950 1.873 2.003 . 0 0 "[ . 1 . 2]" 1
1052 1 56 LEU HG 1 57 GLU H . . 4.200 3.867 3.770 3.932 . 0 0 "[ . 1 . 2]" 1
1053 1 57 GLU H 1 57 GLU HB2 . . 3.600 2.370 2.256 2.483 . 0 0 "[ . 1 . 2]" 1
1054 1 57 GLU H 1 57 GLU QB . . 2.860 2.338 2.232 2.440 . 0 0 "[ . 1 . 2]" 1
1055 1 57 GLU H 1 57 GLU HB3 . . 3.600 3.569 3.534 3.591 . 0 0 "[ . 1 . 2]" 1
1056 1 57 GLU H 1 57 GLU HG2 . . 3.500 2.931 2.224 3.484 . 0 0 "[ . 1 . 2]" 1
1057 1 57 GLU H 1 57 GLU HG3 . . 3.500 3.014 2.209 3.501 0.001 5 0 "[ . 1 . 2]" 1
1058 1 57 GLU H 1 58 LYS H . . 2.920 2.845 2.716 2.924 0.004 20 0 "[ . 1 . 2]" 1
1059 1 57 GLU H 1 58 LYS HA . . 5.740 5.417 5.324 5.469 . 0 0 "[ . 1 . 2]" 1
1060 1 57 GLU H 1 58 LYS QB . . 4.970 4.737 4.410 5.031 0.061 12 0 "[ . 1 . 2]" 1
1061 1 57 GLU H 1 58 LYS QE . . 5.730 4.689 3.463 5.887 0.157 12 0 "[ . 1 . 2]" 1
1062 1 57 GLU H 1 59 LEU QB . . 5.670 4.647 4.377 5.058 . 0 0 "[ . 1 . 2]" 1
1063 1 57 GLU H 1 60 ASP H . . 5.020 4.981 4.815 5.044 0.024 20 0 "[ . 1 . 2]" 1
1064 1 57 GLU H 1 60 ASP QB . . 5.380 5.289 5.017 5.400 0.020 1 0 "[ . 1 . 2]" 1
1065 1 57 GLU HA 1 57 GLU HG2 . . 3.820 2.453 2.150 2.792 . 0 0 "[ . 1 . 2]" 1
1066 1 57 GLU HA 1 57 GLU QG . . 3.090 2.398 2.124 2.720 . 0 0 "[ . 1 . 2]" 1
1067 1 57 GLU HA 1 57 GLU HG3 . . 3.820 3.424 2.964 3.749 . 0 0 "[ . 1 . 2]" 1
1068 1 57 GLU HA 1 59 LEU H . . 4.800 4.429 4.318 4.629 . 0 0 "[ . 1 . 2]" 1
1069 1 57 GLU HA 1 60 ASP H . . 4.010 3.865 3.558 4.014 0.004 1 0 "[ . 1 . 2]" 1
1070 1 57 GLU HA 1 60 ASP QB . . 3.680 3.313 2.809 3.569 . 0 0 "[ . 1 . 2]" 1
1071 1 57 GLU HA 1 61 LEU H . . 5.430 5.282 5.005 5.478 0.048 13 0 "[ . 1 . 2]" 1
1072 1 57 GLU QB 1 58 LYS H . . 3.060 2.487 2.330 2.768 . 0 0 "[ . 1 . 2]" 1
1073 1 57 GLU QB 1 58 LYS HA . . 4.360 3.858 3.828 3.890 . 0 0 "[ . 1 . 2]" 1
1074 1 57 GLU HB2 1 58 LYS H . . 3.510 2.568 2.379 2.904 . 0 0 "[ . 1 . 2]" 1
1075 1 57 GLU HB3 1 58 LYS H . . 3.510 3.342 3.173 3.509 . 0 0 "[ . 1 . 2]" 1
1076 1 57 GLU HG2 1 58 LYS H . . 4.940 4.716 4.360 4.937 . 0 0 "[ . 1 . 2]" 1
1077 1 57 GLU HG3 1 58 LYS H . . 4.940 4.659 4.327 4.935 . 0 0 "[ . 1 . 2]" 1
1078 1 58 LYS H 1 58 LYS QB . . 3.330 2.266 2.056 2.677 . 0 0 "[ . 1 . 2]" 1
1079 1 58 LYS H 1 58 LYS QD . . 4.170 3.014 1.942 4.197 0.027 15 0 "[ . 1 . 2]" 1
1080 1 58 LYS H 1 58 LYS QE . . 4.430 3.051 1.916 3.754 . 0 0 "[ . 1 . 2]" 1
1081 1 58 LYS H 1 58 LYS QG . . 4.270 3.041 1.958 3.909 . 0 0 "[ . 1 . 2]" 1
1082 1 58 LYS H 1 59 LEU HA . . 5.180 5.139 5.108 5.194 0.014 8 0 "[ . 1 . 2]" 1
1083 1 58 LYS H 1 59 LEU QB . . 4.400 4.225 4.186 4.294 . 0 0 "[ . 1 . 2]" 1
1084 1 58 LYS H 1 61 LEU QD . . 5.360 4.496 4.089 5.245 . 0 0 "[ . 1 . 2]" 1
1085 1 58 LYS HA 1 58 LYS QD . . 4.240 3.267 2.120 4.349 0.109 7 0 "[ . 1 . 2]" 1
1086 1 58 LYS HA 1 58 LYS QE . . 4.610 4.001 1.961 4.628 0.018 15 0 "[ . 1 . 2]" 1
1087 1 58 LYS HA 1 60 ASP H . . 4.580 4.342 3.926 4.582 0.002 1 0 "[ . 1 . 2]" 1
1088 1 58 LYS HA 1 61 LEU H . . 3.860 3.521 3.431 3.839 . 0 0 "[ . 1 . 2]" 1
1089 1 58 LYS HA 1 61 LEU QB . . 4.670 3.521 3.172 4.294 . 0 0 "[ . 1 . 2]" 1
1090 1 58 LYS HA 1 61 LEU QD . . 3.520 2.350 1.976 3.129 . 0 0 "[ . 1 . 2]" 1
1091 1 58 LYS QB 1 58 LYS QD . . 3.490 2.343 1.985 2.916 . 0 0 "[ . 1 . 2]" 1
1092 1 58 LYS QB 1 58 LYS QE . . 3.310 2.409 1.939 3.372 0.062 2 0 "[ . 1 . 2]" 1
1093 1 58 LYS QB 1 61 LEU QD . . 5.170 3.672 3.217 4.475 . 0 0 "[ . 1 . 2]" 1
1094 1 58 LYS HB2 1 59 LEU H . . 3.910 3.021 2.618 3.916 0.006 15 0 "[ . 1 . 2]" 1
1095 1 58 LYS HB3 1 59 LEU H . . 3.910 3.548 3.048 3.923 0.013 12 0 "[ . 1 . 2]" 1
1096 1 58 LYS QD 1 59 LEU H . . 4.830 4.552 4.167 4.852 0.022 2 0 "[ . 1 . 2]" 1
1097 1 58 LYS QE 1 59 LEU H . . 5.360 4.683 4.109 5.307 . 0 0 "[ . 1 . 2]" 1
1098 1 58 LYS QE 1 61 LEU QD . . 5.460 4.763 2.252 5.462 0.002 8 0 "[ . 1 . 2]" 1
1099 1 58 LYS QG 1 59 LEU H . . 5.370 4.184 2.221 4.629 . 0 0 "[ . 1 . 2]" 1
1100 1 59 LEU H 1 59 LEU HB2 . . 3.940 2.777 2.157 3.439 . 0 0 "[ . 1 . 2]" 1
1101 1 59 LEU H 1 59 LEU HB3 . . 3.940 2.363 2.073 2.921 . 0 0 "[ . 1 . 2]" 1
1102 1 59 LEU H 1 59 LEU MD1 . . 4.340 4.207 4.149 4.272 . 0 0 "[ . 1 . 2]" 1
1103 1 59 LEU H 1 59 LEU QD . . 3.700 3.654 3.323 3.749 0.049 17 0 "[ . 1 . 2]" 1
1104 1 59 LEU H 1 59 LEU MD2 . . 4.340 4.047 3.473 4.226 . 0 0 "[ . 1 . 2]" 1
1105 1 59 LEU H 1 60 ASP H . . 3.290 2.772 2.524 2.858 . 0 0 "[ . 1 . 2]" 1
1106 1 59 LEU H 1 60 ASP HA . . 5.430 5.337 5.103 5.413 . 0 0 "[ . 1 . 2]" 1
1107 1 59 LEU H 1 60 ASP QB . . 4.520 4.445 4.244 4.532 0.012 5 0 "[ . 1 . 2]" 1
1108 1 59 LEU H 1 62 VAL HB . . 5.750 5.372 5.189 5.574 . 0 0 "[ . 1 . 2]" 1
1109 1 59 LEU HA 1 59 LEU QD . . 3.550 2.455 2.156 3.112 . 0 0 "[ . 1 . 2]" 1
1110 1 59 LEU HA 1 62 VAL H . . 3.760 3.110 2.977 3.177 . 0 0 "[ . 1 . 2]" 1
1111 1 59 LEU HA 1 62 VAL HB . . 4.220 2.690 2.511 2.845 . 0 0 "[ . 1 . 2]" 1
1112 1 59 LEU HA 1 62 VAL QG . . 4.000 2.149 1.951 2.445 . 0 0 "[ . 1 . 2]" 1
1113 1 59 LEU QB 1 60 ASP H . . 3.310 2.691 2.276 3.408 0.098 18 0 "[ . 1 . 2]" 1
1114 1 59 LEU QD 1 60 ASP H . . 3.590 3.501 3.289 3.632 0.042 4 0 "[ . 1 . 2]" 1
1115 1 59 LEU QD 1 62 VAL HB . . 4.190 2.648 2.281 3.173 . 0 0 "[ . 1 . 2]" 1
1116 1 59 LEU QD 1 62 VAL QG . . 3.960 3.000 2.771 3.430 . 0 0 "[ . 1 . 2]" 1
1117 1 59 LEU QD 1 63 ILE H . . 4.170 3.352 3.152 3.645 . 0 0 "[ . 1 . 2]" 1
1118 1 59 LEU QD 1 63 ILE MD . . 3.870 2.150 1.925 2.385 . 0 0 "[ . 1 . 2]" 1
1119 1 59 LEU QD 1 63 ILE QG . . 3.750 2.336 1.961 2.718 . 0 0 "[ . 1 . 2]" 1
1120 1 59 LEU QD 1 89 VAL HA . . 6.550 4.080 3.642 4.977 . 0 0 "[ . 1 . 2]" 1
1121 1 59 LEU MD1 1 60 ASP H . . 4.140 3.980 3.545 4.193 0.053 17 0 "[ . 1 . 2]" 1
1122 1 59 LEU MD2 1 60 ASP H . . 4.140 3.931 3.490 4.145 0.005 15 0 "[ . 1 . 2]" 1
1123 1 60 ASP H 1 60 ASP QB . . 2.580 2.182 2.063 2.258 . 0 0 "[ . 1 . 2]" 1
1124 1 60 ASP H 1 61 LEU H . . 3.540 2.783 2.720 2.811 . 0 0 "[ . 1 . 2]" 1
1125 1 60 ASP H 1 61 LEU QD . . 4.630 4.485 4.349 4.586 . 0 0 "[ . 1 . 2]" 1
1126 1 60 ASP H 1 61 LEU HG . . 4.210 4.072 3.971 4.175 . 0 0 "[ . 1 . 2]" 1
1127 1 60 ASP H 1 62 VAL H . . 4.690 4.119 4.000 4.240 . 0 0 "[ . 1 . 2]" 1
1128 1 60 ASP H 1 63 ILE H . . 5.270 5.063 4.910 5.183 . 0 0 "[ . 1 . 2]" 1
1129 1 60 ASP H 1 101 LEU QD . . 5.010 4.702 4.314 5.021 0.011 14 0 "[ . 1 . 2]" 1
1130 1 60 ASP HA 1 63 ILE H . . 3.890 3.741 3.625 3.861 . 0 0 "[ . 1 . 2]" 1
1131 1 60 ASP HA 1 63 ILE HB . . 4.250 3.728 3.395 3.988 . 0 0 "[ . 1 . 2]" 1
1132 1 60 ASP HA 1 63 ILE MD . . 4.500 4.308 3.981 4.506 0.006 2 0 "[ . 1 . 2]" 1
1133 1 60 ASP HA 1 63 ILE QG . . 3.990 2.749 2.488 2.962 . 0 0 "[ . 1 . 2]" 1
1134 1 60 ASP HA 1 63 ILE MG . . 5.150 4.724 4.495 4.984 . 0 0 "[ . 1 . 2]" 1
1135 1 60 ASP HA 1 64 LYS H . . 5.500 5.235 5.034 5.465 . 0 0 "[ . 1 . 2]" 1
1136 1 60 ASP HA 1 101 LEU QD . . 5.090 3.230 3.022 3.500 . 0 0 "[ . 1 . 2]" 1
1137 1 60 ASP QB 1 61 LEU H . . 3.020 2.767 2.652 2.874 . 0 0 "[ . 1 . 2]" 1
1138 1 60 ASP QB 1 61 LEU QB . . 5.540 4.617 4.508 4.805 . 0 0 "[ . 1 . 2]" 1
1139 1 60 ASP QB 1 61 LEU QD . . 4.560 3.184 2.667 3.467 . 0 0 "[ . 1 . 2]" 1
1140 1 60 ASP QB 1 63 ILE QG . . 5.950 4.509 4.274 4.699 . 0 0 "[ . 1 . 2]" 1
1141 1 60 ASP QB 1 101 LEU MD1 . . 4.430 3.376 2.538 4.314 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ASP QB 1 101 LEU QD . . 3.790 3.206 2.500 3.670 . 0 0 "[ . 1 . 2]" 1
1143 1 60 ASP QB 1 101 LEU MD2 . . 4.430 4.178 3.578 4.436 0.006 11 0 "[ . 1 . 2]" 1
1144 1 61 LEU H 1 61 LEU HB2 . . 3.610 2.697 2.665 2.724 . 0 0 "[ . 1 . 2]" 1
1145 1 61 LEU H 1 61 LEU QB . . 2.980 2.625 2.599 2.647 . 0 0 "[ . 1 . 2]" 1
1146 1 61 LEU H 1 61 LEU HB3 . . 3.610 3.600 3.596 3.604 . 0 0 "[ . 1 . 2]" 1
1147 1 61 LEU H 1 61 LEU MD1 . . 3.660 3.486 3.441 3.590 . 0 0 "[ . 1 . 2]" 1
1148 1 61 LEU H 1 61 LEU QD . . 3.070 2.908 2.770 2.952 . 0 0 "[ . 1 . 2]" 1
1149 1 61 LEU H 1 61 LEU MD2 . . 3.660 3.119 2.884 3.205 . 0 0 "[ . 1 . 2]" 1
1150 1 61 LEU H 1 61 LEU HG . . 2.990 1.971 1.945 2.047 . 0 0 "[ . 1 . 2]" 1
1151 1 61 LEU H 1 62 VAL H . . 3.570 2.440 2.430 2.456 . 0 0 "[ . 1 . 2]" 1
1152 1 61 LEU H 1 62 VAL HB . . 4.940 4.709 4.675 4.777 . 0 0 "[ . 1 . 2]" 1
1153 1 61 LEU H 1 62 VAL QG . . 4.030 3.737 3.587 3.885 . 0 0 "[ . 1 . 2]" 1
1154 1 61 LEU H 1 63 ILE H . . 4.400 4.127 4.009 4.269 . 0 0 "[ . 1 . 2]" 1
1155 1 61 LEU HA 1 61 LEU MD1 . . 3.990 3.965 3.920 3.979 . 0 0 "[ . 1 . 2]" 1
1156 1 61 LEU HA 1 61 LEU QD . . 2.930 2.232 2.154 2.418 . 0 0 "[ . 1 . 2]" 1
1157 1 61 LEU HA 1 61 LEU MD2 . . 3.990 2.244 2.163 2.440 . 0 0 "[ . 1 . 2]" 1
1158 1 61 LEU HA 1 61 LEU HG . . 4.270 3.270 3.236 3.372 . 0 0 "[ . 1 . 2]" 1
1159 1 61 LEU HA 1 63 ILE H . . 4.280 4.180 3.977 4.283 0.003 15 0 "[ . 1 . 2]" 1
1160 1 61 LEU HA 1 64 LYS H . . 3.760 3.519 3.330 3.656 . 0 0 "[ . 1 . 2]" 1
1161 1 61 LEU HA 1 64 LYS QD . . 4.790 4.086 1.940 4.792 0.002 8 0 "[ . 1 . 2]" 1
1162 1 61 LEU HA 1 64 LYS QG . . 4.140 2.721 2.352 3.533 . 0 0 "[ . 1 . 2]" 1
1163 1 61 LEU QB 1 62 VAL H . . 3.810 2.754 2.647 2.822 . 0 0 "[ . 1 . 2]" 1
1164 1 61 LEU QD 1 62 VAL H . . 4.050 4.018 3.938 4.055 0.005 16 0 "[ . 1 . 2]" 1
1165 1 61 LEU QD 1 63 ILE H . . 5.450 5.323 5.160 5.418 . 0 0 "[ . 1 . 2]" 1
1166 1 61 LEU QD 1 64 LYS H . . 5.410 5.085 4.925 5.191 . 0 0 "[ . 1 . 2]" 1
1167 1 61 LEU MD1 1 62 VAL H . . 4.630 4.418 4.265 4.561 . 0 0 "[ . 1 . 2]" 1
1168 1 61 LEU MD2 1 62 VAL H . . 4.630 4.622 4.537 4.641 0.011 20 0 "[ . 1 . 2]" 1
1169 1 61 LEU HG 1 62 VAL H . . 4.260 3.975 3.914 4.034 . 0 0 "[ . 1 . 2]" 1
1170 1 62 VAL H 1 62 VAL HB . . 3.580 2.544 2.511 2.579 . 0 0 "[ . 1 . 2]" 1
1171 1 62 VAL H 1 62 VAL MG1 . . 3.820 3.764 3.762 3.772 . 0 0 "[ . 1 . 2]" 1
1172 1 62 VAL H 1 62 VAL QG . . 3.210 2.099 1.970 2.323 . 0 0 "[ . 1 . 2]" 1
1173 1 62 VAL H 1 62 VAL MG2 . . 3.820 2.111 1.976 2.345 . 0 0 "[ . 1 . 2]" 1
1174 1 62 VAL H 1 63 ILE H . . 3.480 2.656 2.539 2.735 . 0 0 "[ . 1 . 2]" 1
1175 1 62 VAL H 1 63 ILE MD . . 4.850 4.831 4.770 4.858 0.008 12 0 "[ . 1 . 2]" 1
1176 1 62 VAL H 1 64 LYS H . . 4.660 4.225 4.126 4.393 . 0 0 "[ . 1 . 2]" 1
1177 1 62 VAL HA 1 62 VAL MG1 . . 3.390 2.318 2.256 2.395 . 0 0 "[ . 1 . 2]" 1
1178 1 62 VAL HA 1 62 VAL QG . . 2.900 2.091 2.056 2.143 . 0 0 "[ . 1 . 2]" 1
1179 1 62 VAL HA 1 62 VAL MG2 . . 3.390 2.382 2.289 2.434 . 0 0 "[ . 1 . 2]" 1
1180 1 62 VAL HA 1 64 LYS H . . 4.360 4.120 3.954 4.363 0.003 17 0 "[ . 1 . 2]" 1
1181 1 62 VAL HA 1 65 TYR H . . 3.360 3.230 3.167 3.336 . 0 0 "[ . 1 . 2]" 1
1182 1 62 VAL HA 1 65 TYR HB2 . . 4.400 2.995 2.852 3.176 . 0 0 "[ . 1 . 2]" 1
1183 1 62 VAL HA 1 65 TYR QB . . 3.820 2.729 2.592 2.843 . 0 0 "[ . 1 . 2]" 1
1184 1 62 VAL HA 1 65 TYR HB3 . . 4.400 3.154 2.965 3.315 . 0 0 "[ . 1 . 2]" 1
1185 1 62 VAL HA 1 65 TYR QD . . 4.690 4.561 4.341 4.686 . 0 0 "[ . 1 . 2]" 1
1186 1 62 VAL HA 1 66 MET H . . 4.590 4.141 3.939 4.354 . 0 0 "[ . 1 . 2]" 1
1187 1 62 VAL HB 1 63 ILE H . . 3.560 2.712 2.592 2.852 . 0 0 "[ . 1 . 2]" 1
1188 1 62 VAL HB 1 63 ILE MD . . 4.530 3.454 3.307 3.553 . 0 0 "[ . 1 . 2]" 1
1189 1 62 VAL HB 1 66 MET ME . . 4.440 3.581 3.333 3.821 . 0 0 "[ . 1 . 2]" 1
1190 1 62 VAL QG 1 63 ILE H . . 3.480 3.282 3.212 3.352 . 0 0 "[ . 1 . 2]" 1
1191 1 62 VAL QG 1 64 LYS H . . 4.860 4.505 4.411 4.656 . 0 0 "[ . 1 . 2]" 1
1192 1 62 VAL QG 1 65 TYR H . . 4.110 3.941 3.830 4.114 0.004 13 0 "[ . 1 . 2]" 1
1193 1 62 VAL QG 1 65 TYR QB . . 3.920 3.022 2.904 3.230 . 0 0 "[ . 1 . 2]" 1
1194 1 62 VAL QG 1 65 TYR QD . . 4.270 3.965 3.766 4.197 . 0 0 "[ . 1 . 2]" 1
1195 1 62 VAL QG 1 66 MET H . . 4.280 3.548 3.411 3.685 . 0 0 "[ . 1 . 2]" 1
1196 1 62 VAL QG 1 66 MET ME . . 2.980 1.979 1.843 2.199 . 0 0 "[ . 1 . 2]" 1
1197 1 62 VAL MG1 1 63 ILE H . . 4.050 3.554 3.455 3.661 . 0 0 "[ . 1 . 2]" 1
1198 1 62 VAL MG1 1 64 LYS H . . 5.780 4.869 4.744 5.030 . 0 0 "[ . 1 . 2]" 1
1199 1 62 VAL MG1 1 65 TYR H . . 5.270 4.107 3.970 4.330 . 0 0 "[ . 1 . 2]" 1
1200 1 62 VAL MG1 1 65 TYR QD . . 5.280 4.115 3.879 4.406 . 0 0 "[ . 1 . 2]" 1
1201 1 62 VAL MG1 1 66 MET H . . 5.690 3.590 3.444 3.733 . 0 0 "[ . 1 . 2]" 1
1202 1 62 VAL MG1 1 66 MET ME . . 4.330 1.983 1.845 2.205 . 0 0 "[ . 1 . 2]" 1
1203 1 62 VAL MG2 1 63 ILE H . . 4.050 3.859 3.797 3.913 . 0 0 "[ . 1 . 2]" 1
1204 1 62 VAL MG2 1 64 LYS H . . 5.780 5.311 5.217 5.493 . 0 0 "[ . 1 . 2]" 1
1205 1 62 VAL MG2 1 65 TYR H . . 5.270 5.078 5.006 5.137 . 0 0 "[ . 1 . 2]" 1
1206 1 62 VAL MG2 1 65 TYR QD . . 5.280 5.193 4.977 5.287 0.007 15 0 "[ . 1 . 2]" 1
1207 1 62 VAL MG2 1 66 MET H . . 5.690 5.565 5.469 5.678 . 0 0 "[ . 1 . 2]" 1
1208 1 62 VAL MG2 1 66 MET ME . . 4.330 4.236 4.081 4.334 0.004 14 0 "[ . 1 . 2]" 1
1209 1 63 ILE H 1 63 ILE HB . . 3.370 2.615 2.556 2.645 . 0 0 "[ . 1 . 2]" 1
1210 1 63 ILE H 1 63 ILE MD . . 3.430 3.005 2.887 3.155 . 0 0 "[ . 1 . 2]" 1
1211 1 63 ILE H 1 63 ILE HG12 . . 3.650 1.990 1.941 2.090 . 0 0 "[ . 1 . 2]" 1
1212 1 63 ILE H 1 63 ILE QG . . 3.140 1.979 1.932 2.077 . 0 0 "[ . 1 . 2]" 1
1213 1 63 ILE H 1 63 ILE HG13 . . 3.650 3.532 3.473 3.600 . 0 0 "[ . 1 . 2]" 1
1214 1 63 ILE H 1 63 ILE MG . . 3.940 3.763 3.760 3.766 . 0 0 "[ . 1 . 2]" 1
1215 1 63 ILE H 1 64 LYS H . . 3.650 2.719 2.611 2.801 . 0 0 "[ . 1 . 2]" 1
1216 1 63 ILE H 1 64 LYS QB . . 5.130 4.897 4.734 4.970 . 0 0 "[ . 1 . 2]" 1
1217 1 63 ILE H 1 64 LYS QG . . 4.470 4.050 3.883 4.326 . 0 0 "[ . 1 . 2]" 1
1218 1 63 ILE H 1 66 MET HB2 . . 5.250 4.947 4.856 5.103 . 0 0 "[ . 1 . 2]" 1
1219 1 63 ILE H 1 66 MET ME . . 4.410 4.097 3.849 4.288 . 0 0 "[ . 1 . 2]" 1
1220 1 63 ILE H 1 101 LEU QD . . 5.620 5.594 5.087 5.645 0.025 17 0 "[ . 1 . 2]" 1
1221 1 63 ILE HA 1 63 ILE MD . . 3.680 2.043 1.961 2.167 . 0 0 "[ . 1 . 2]" 1
1222 1 63 ILE HA 1 66 MET H . . 4.770 3.414 3.275 3.485 . 0 0 "[ . 1 . 2]" 1
1223 1 63 ILE HA 1 66 MET HB2 . . 5.030 2.850 2.648 3.042 . 0 0 "[ . 1 . 2]" 1
1224 1 63 ILE HA 1 66 MET ME . . 3.290 2.603 2.396 2.735 . 0 0 "[ . 1 . 2]" 1
1225 1 63 ILE HA 1 67 LYS H . . 4.310 3.915 3.764 4.066 . 0 0 "[ . 1 . 2]" 1
1226 1 63 ILE HA 1 82 PHE QE . . 5.060 3.507 3.006 3.949 . 0 0 "[ . 1 . 2]" 1
1227 1 63 ILE HB 1 64 LYS H . . 3.880 2.722 2.511 2.818 . 0 0 "[ . 1 . 2]" 1
1228 1 63 ILE HB 1 101 LEU QD . . 4.440 4.401 3.746 4.454 0.014 12 0 "[ . 1 . 2]" 1
1229 1 63 ILE MD 1 63 ILE MG . . 3.460 2.058 1.954 2.144 . 0 0 "[ . 1 . 2]" 1
1230 1 63 ILE MD 1 64 LYS H . . 4.610 4.602 4.552 4.627 0.017 5 0 "[ . 1 . 2]" 1
1231 1 63 ILE MD 1 65 TYR H . . 5.730 5.456 5.350 5.526 . 0 0 "[ . 1 . 2]" 1
1232 1 63 ILE MD 1 66 MET ME . . 3.000 2.407 2.198 2.660 . 0 0 "[ . 1 . 2]" 1
1233 1 63 ILE MD 1 82 PHE QE . . 4.400 3.291 2.544 3.853 . 0 0 "[ . 1 . 2]" 1
1234 1 63 ILE MD 1 85 ILE MG . . 4.170 3.841 3.346 4.175 0.005 17 0 "[ . 1 . 2]" 1
1235 1 63 ILE MD 1 86 LEU HA . . 4.680 3.107 2.596 3.876 . 0 0 "[ . 1 . 2]" 1
1236 1 63 ILE MD 1 89 VAL MG1 . . 3.530 3.207 2.724 3.521 . 0 0 "[ . 1 . 2]" 1
1237 1 63 ILE MD 1 89 VAL QG . . 3.020 1.971 1.845 2.284 . 0 0 "[ . 1 . 2]" 1
1238 1 63 ILE MD 1 89 VAL MG2 . . 3.530 1.990 1.876 2.325 . 0 0 "[ . 1 . 2]" 1
1239 1 63 ILE MD 1 90 GLN HE22 . . 5.750 5.656 5.231 5.771 0.021 13 0 "[ . 1 . 2]" 1
1240 1 63 ILE QG 1 63 ILE MG . . 3.150 2.233 2.188 2.303 . 0 0 "[ . 1 . 2]" 1
1241 1 63 ILE HG12 1 63 ILE MG . . 3.620 3.194 3.183 3.202 . 0 0 "[ . 1 . 2]" 1
1242 1 63 ILE HG13 1 63 ILE MG . . 3.620 2.280 2.229 2.360 . 0 0 "[ . 1 . 2]" 1
1243 1 63 ILE MG 1 64 LYS H . . 3.710 3.615 3.429 3.712 0.002 19 0 "[ . 1 . 2]" 1
1244 1 63 ILE MG 1 64 LYS HA . . 4.860 3.623 3.440 3.777 . 0 0 "[ . 1 . 2]" 1
1245 1 63 ILE MG 1 66 MET H . . 5.340 4.634 4.442 4.762 . 0 0 "[ . 1 . 2]" 1
1246 1 63 ILE MG 1 66 MET ME . . 3.990 3.796 3.541 3.994 0.004 11 0 "[ . 1 . 2]" 1
1247 1 63 ILE MG 1 67 LYS H . . 4.480 3.955 3.727 4.155 . 0 0 "[ . 1 . 2]" 1
1248 1 63 ILE MG 1 82 PHE QE . . 3.840 2.550 2.181 3.239 . 0 0 "[ . 1 . 2]" 1
1249 1 63 ILE MG 1 82 PHE HZ . . 3.720 2.783 2.307 3.250 . 0 0 "[ . 1 . 2]" 1
1250 1 63 ILE MG 1 101 LEU QD . . 5.440 4.014 3.217 4.281 . 0 0 "[ . 1 . 2]" 1
1251 1 64 LYS H 1 64 LYS HB2 . . 3.700 2.616 2.547 2.659 . 0 0 "[ . 1 . 2]" 1
1252 1 64 LYS H 1 64 LYS QB . . 3.050 2.557 2.498 2.593 . 0 0 "[ . 1 . 2]" 1
1253 1 64 LYS H 1 64 LYS HB3 . . 3.700 3.601 3.587 3.605 . 0 0 "[ . 1 . 2]" 1
1254 1 64 LYS H 1 64 LYS QD . . 4.180 3.692 2.951 4.176 . 0 0 "[ . 1 . 2]" 1
1255 1 64 LYS H 1 64 LYS QE . . 4.590 4.230 2.599 4.591 0.001 10 0 "[ . 1 . 2]" 1
1256 1 64 LYS H 1 64 LYS HG2 . . 3.480 2.460 1.952 3.585 0.105 17 0 "[ . 1 . 2]" 1
1257 1 64 LYS H 1 64 LYS QG . . 3.030 2.084 1.942 2.335 . 0 0 "[ . 1 . 2]" 1
1258 1 64 LYS H 1 64 LYS HG3 . . 3.480 2.887 2.048 3.481 0.001 16 0 "[ . 1 . 2]" 1
1259 1 64 LYS H 1 65 TYR H . . 3.300 2.498 2.480 2.637 . 0 0 "[ . 1 . 2]" 1
1260 1 64 LYS H 1 65 TYR HA . . 5.200 5.140 5.123 5.254 0.054 17 0 "[ . 1 . 2]" 1
1261 1 64 LYS H 1 65 TYR QB . . 4.740 4.259 4.232 4.396 . 0 0 "[ . 1 . 2]" 1
1262 1 64 LYS H 1 65 TYR QD . . 6.180 6.053 5.940 6.182 0.002 17 0 "[ . 1 . 2]" 1
1263 1 64 LYS H 1 66 MET H . . 4.920 4.049 4.018 4.153 . 0 0 "[ . 1 . 2]" 1
1264 1 64 LYS H 1 66 MET HB2 . . 5.760 5.216 5.094 5.307 . 0 0 "[ . 1 . 2]" 1
1265 1 64 LYS H 1 67 LYS QG . . 4.680 4.239 4.183 4.342 . 0 0 "[ . 1 . 2]" 1
1266 1 64 LYS HA 1 64 LYS QD . . 4.010 3.100 2.093 4.108 0.098 17 0 "[ . 1 . 2]" 1
1267 1 64 LYS HA 1 64 LYS QE . . 4.760 3.428 2.008 4.757 . 0 0 "[ . 1 . 2]" 1
1268 1 64 LYS HA 1 64 LYS HG2 . . 4.050 2.866 2.463 3.208 . 0 0 "[ . 1 . 2]" 1
1269 1 64 LYS HA 1 64 LYS QG . . 3.550 2.746 2.420 3.058 . 0 0 "[ . 1 . 2]" 1
1270 1 64 LYS HA 1 64 LYS HG3 . . 4.050 3.631 2.735 3.852 . 0 0 "[ . 1 . 2]" 1
1271 1 64 LYS HA 1 67 LYS H . . 3.980 3.650 3.583 3.773 . 0 0 "[ . 1 . 2]" 1
1272 1 64 LYS HA 1 67 LYS QB . . 4.240 3.637 3.471 3.753 . 0 0 "[ . 1 . 2]" 1
1273 1 64 LYS HA 1 67 LYS HD2 . . 4.260 2.714 2.540 2.861 . 0 0 "[ . 1 . 2]" 1
1274 1 64 LYS HA 1 67 LYS QD . . 3.570 2.022 1.959 2.140 . 0 0 "[ . 1 . 2]" 1
1275 1 64 LYS HA 1 67 LYS HD3 . . 4.260 2.091 1.995 2.260 . 0 0 "[ . 1 . 2]" 1
1276 1 64 LYS HA 1 67 LYS QE . . 5.430 4.062 4.010 4.089 . 0 0 "[ . 1 . 2]" 1
1277 1 64 LYS HA 1 67 LYS QG . . 4.520 1.984 1.974 2.041 . 0 0 "[ . 1 . 2]" 1
1278 1 64 LYS HA 1 68 ARG H . . 4.210 4.102 3.995 4.223 0.013 13 0 "[ . 1 . 2]" 1
1279 1 64 LYS QB 1 64 LYS QD . . 3.420 2.359 1.938 2.720 . 0 0 "[ . 1 . 2]" 1
1280 1 64 LYS QB 1 64 LYS QE . . 4.280 2.351 1.976 3.144 . 0 0 "[ . 1 . 2]" 1
1281 1 64 LYS QB 1 65 TYR H . . 3.310 2.847 2.839 2.861 . 0 0 "[ . 1 . 2]" 1
1282 1 64 LYS QB 1 67 LYS QE . . 5.160 5.084 4.840 5.161 0.001 12 0 "[ . 1 . 2]" 1
1283 1 64 LYS QB 1 68 ARG H . . 5.300 4.946 4.846 5.100 . 0 0 "[ . 1 . 2]" 1
1284 1 64 LYS HB2 1 65 TYR H . . 4.130 2.912 2.908 2.933 . 0 0 "[ . 1 . 2]" 1
1285 1 64 LYS HB3 1 65 TYR H . . 4.130 4.010 3.959 4.042 . 0 0 "[ . 1 . 2]" 1
1286 1 64 LYS QE 1 65 TYR HA . . 7.000 6.342 5.967 6.930 . 0 0 "[ . 1 . 2]" 1
1287 1 64 LYS QG 1 65 TYR H . . 4.110 3.951 3.885 4.116 0.006 17 0 "[ . 1 . 2]" 1
1288 1 65 TYR H 1 65 TYR HB2 . . 3.470 2.346 2.299 2.395 . 0 0 "[ . 1 . 2]" 1
1289 1 65 TYR H 1 65 TYR QB . . 2.840 2.239 2.216 2.264 . 0 0 "[ . 1 . 2]" 1
1290 1 65 TYR H 1 65 TYR HB3 . . 3.470 2.835 2.788 2.902 . 0 0 "[ . 1 . 2]" 1
1291 1 65 TYR H 1 65 TYR QD . . 4.060 4.066 4.000 4.119 0.059 13 0 "[ . 1 . 2]" 1
1292 1 65 TYR H 1 66 MET H . . 3.270 2.390 2.359 2.426 . 0 0 "[ . 1 . 2]" 1
1293 1 65 TYR H 1 66 MET HB2 . . 4.690 4.279 4.223 4.418 . 0 0 "[ . 1 . 2]" 1
1294 1 65 TYR H 1 66 MET ME . . 5.060 5.005 4.780 5.074 0.014 13 0 "[ . 1 . 2]" 1
1295 1 65 TYR H 1 67 LYS H . . 4.290 3.906 3.768 4.094 . 0 0 "[ . 1 . 2]" 1
1296 1 65 TYR H 1 67 LYS QG . . 4.510 4.010 3.951 4.121 . 0 0 "[ . 1 . 2]" 1
1297 1 65 TYR H 1 68 ARG H . . 5.610 4.662 4.599 4.765 . 0 0 "[ . 1 . 2]" 1
1298 1 65 TYR H 1 68 ARG HG2 . . 4.620 4.367 4.255 4.450 . 0 0 "[ . 1 . 2]" 1
1299 1 65 TYR HA 1 65 TYR QD . . 3.230 2.265 2.115 2.412 . 0 0 "[ . 1 . 2]" 1
1300 1 65 TYR HA 1 65 TYR QE . . 4.350 4.262 4.210 4.334 . 0 0 "[ . 1 . 2]" 1
1301 1 65 TYR HA 1 68 ARG H . . 4.140 3.585 3.473 3.737 . 0 0 "[ . 1 . 2]" 1
1302 1 65 TYR HA 1 68 ARG QB . . 4.030 3.736 3.648 3.875 . 0 0 "[ . 1 . 2]" 1
1303 1 65 TYR HA 1 68 ARG QD . . 3.940 2.311 1.986 2.925 . 0 0 "[ . 1 . 2]" 1
1304 1 65 TYR HA 1 68 ARG HG2 . . 3.970 1.988 1.971 2.018 . 0 0 "[ . 1 . 2]" 1
1305 1 65 TYR HA 1 69 LEU H . . 4.430 4.188 4.045 4.437 0.007 8 0 "[ . 1 . 2]" 1
1306 1 65 TYR HB2 1 66 MET H . . 4.410 3.669 3.609 3.704 . 0 0 "[ . 1 . 2]" 1
1307 1 65 TYR HB3 1 66 MET H . . 4.410 2.787 2.701 2.820 . 0 0 "[ . 1 . 2]" 1
1308 1 65 TYR QD 1 66 MET H . . 4.800 4.452 4.323 4.503 . 0 0 "[ . 1 . 2]" 1
1309 1 65 TYR QD 1 66 MET HA . . 5.280 4.594 4.368 4.727 . 0 0 "[ . 1 . 2]" 1
1310 1 65 TYR QD 1 68 ARG QB . . 5.080 4.828 4.579 5.087 0.007 15 0 "[ . 1 . 2]" 1
1311 1 65 TYR QD 1 68 ARG QD . . 4.260 2.188 1.967 2.981 . 0 0 "[ . 1 . 2]" 1
1312 1 65 TYR QD 1 69 LEU MD1 . . 3.820 2.458 2.174 2.677 . 0 0 "[ . 1 . 2]" 1
1313 1 65 TYR QD 1 69 LEU MD2 . . 4.720 4.446 4.176 4.728 0.008 19 0 "[ . 1 . 2]" 1
1314 1 65 TYR QE 1 69 LEU MD1 . . 3.460 2.616 2.402 2.927 . 0 0 "[ . 1 . 2]" 1
1315 1 65 TYR QE 1 69 LEU MD2 . . 4.140 3.835 3.516 4.111 . 0 0 "[ . 1 . 2]" 1
1316 1 66 MET H 1 66 MET ME . . 4.170 3.616 3.387 3.693 . 0 0 "[ . 1 . 2]" 1
1317 1 66 MET H 1 66 MET HG2 . . 4.710 4.209 3.662 4.648 . 0 0 "[ . 1 . 2]" 1
1318 1 66 MET H 1 66 MET QG . . 3.920 3.311 2.675 3.788 . 0 0 "[ . 1 . 2]" 1
1319 1 66 MET H 1 66 MET HG3 . . 4.710 3.473 2.750 4.013 . 0 0 "[ . 1 . 2]" 1
1320 1 66 MET H 1 67 LYS H . . 3.770 2.499 2.458 2.574 . 0 0 "[ . 1 . 2]" 1
1321 1 66 MET H 1 67 LYS QG . . 4.800 3.900 3.820 3.994 . 0 0 "[ . 1 . 2]" 1
1322 1 66 MET H 1 68 ARG H . . 4.620 3.970 3.910 4.016 . 0 0 "[ . 1 . 2]" 1
1323 1 66 MET H 1 68 ARG HG2 . . 4.360 4.289 4.153 4.380 0.020 19 0 "[ . 1 . 2]" 1
1324 1 66 MET H 1 69 LEU H . . 4.870 4.579 4.476 4.672 . 0 0 "[ . 1 . 2]" 1
1325 1 66 MET H 1 69 LEU HB2 . . 5.750 4.722 4.576 4.840 . 0 0 "[ . 1 . 2]" 1
1326 1 66 MET H 1 69 LEU MD1 . . 4.750 4.395 3.928 4.690 . 0 0 "[ . 1 . 2]" 1
1327 1 66 MET HA 1 68 ARG H . . 4.550 4.320 4.208 4.399 . 0 0 "[ . 1 . 2]" 1
1328 1 66 MET HA 1 69 LEU H . . 4.450 3.374 3.199 3.509 . 0 0 "[ . 1 . 2]" 1
1329 1 66 MET HA 1 69 LEU HB2 . . 4.560 2.421 2.228 2.590 . 0 0 "[ . 1 . 2]" 1
1330 1 66 MET HA 1 69 LEU HB3 . . 4.480 3.912 3.739 4.103 . 0 0 "[ . 1 . 2]" 1
1331 1 66 MET HA 1 69 LEU MD1 . . 4.510 2.791 2.391 3.090 . 0 0 "[ . 1 . 2]" 1
1332 1 66 MET HA 1 70 MET H . . 4.470 3.618 3.398 3.824 . 0 0 "[ . 1 . 2]" 1
1333 1 66 MET HA 1 70 MET ME . . 4.230 3.946 3.625 4.212 . 0 0 "[ . 1 . 2]" 1
1334 1 66 MET HB2 1 66 MET ME . . 3.560 2.060 1.942 2.355 . 0 0 "[ . 1 . 2]" 1
1335 1 66 MET HB2 1 67 LYS H . . 4.330 3.121 2.627 3.492 . 0 0 "[ . 1 . 2]" 1
1336 1 66 MET HB2 1 82 PHE QD . . 4.880 4.450 3.796 4.882 0.002 14 0 "[ . 1 . 2]" 1
1337 1 66 MET HB3 1 68 ARG H . . 6.030 5.222 5.095 5.433 . 0 0 "[ . 1 . 2]" 1
1338 1 66 MET HB3 1 82 PHE QD . . 4.360 3.124 2.857 3.271 . 0 0 "[ . 1 . 2]" 1
1339 1 66 MET HB3 1 82 PHE QE . . 5.080 3.205 2.506 3.994 . 0 0 "[ . 1 . 2]" 1
1340 1 66 MET ME 1 66 MET QG . . 3.570 2.429 2.248 2.556 . 0 0 "[ . 1 . 2]" 1
1341 1 66 MET ME 1 82 PHE QD . . 4.730 3.851 3.181 4.455 . 0 0 "[ . 1 . 2]" 1
1342 1 66 MET ME 1 82 PHE QE . . 4.500 3.576 2.861 4.130 . 0 0 "[ . 1 . 2]" 1
1343 1 66 MET ME 1 85 ILE MD . . 4.260 4.120 3.700 4.271 0.011 13 0 "[ . 1 . 2]" 1
1344 1 66 MET ME 1 85 ILE MG . . 3.290 2.634 2.284 2.945 . 0 0 "[ . 1 . 2]" 1
1345 1 66 MET ME 1 89 VAL QG . . 4.610 3.535 3.325 3.823 . 0 0 "[ . 1 . 2]" 1
1346 1 66 MET QG 1 70 MET ME . . 3.890 2.477 1.979 3.127 . 0 0 "[ . 1 . 2]" 1
1347 1 66 MET QG 1 82 PHE QD . . 4.880 4.306 2.963 4.884 0.004 4 0 "[ . 1 . 2]" 1
1348 1 67 LYS H 1 67 LYS QB . . 2.990 2.442 2.374 2.505 . 0 0 "[ . 1 . 2]" 1
1349 1 67 LYS H 1 67 LYS HD2 . . 4.870 4.071 3.958 4.145 . 0 0 "[ . 1 . 2]" 1
1350 1 67 LYS H 1 67 LYS HD3 . . 4.870 4.533 4.444 4.662 . 0 0 "[ . 1 . 2]" 1
1351 1 67 LYS H 1 67 LYS QE . . 5.160 4.851 4.663 5.017 . 0 0 "[ . 1 . 2]" 1
1352 1 67 LYS H 1 67 LYS HG2 . . 3.870 2.257 2.165 2.375 . 0 0 "[ . 1 . 2]" 1
1353 1 67 LYS H 1 67 LYS QG . . 3.260 2.228 2.139 2.338 . 0 0 "[ . 1 . 2]" 1
1354 1 67 LYS H 1 67 LYS HG3 . . 3.870 3.437 3.329 3.533 . 0 0 "[ . 1 . 2]" 1
1355 1 67 LYS H 1 68 ARG H . . 3.600 2.542 2.408 2.724 . 0 0 "[ . 1 . 2]" 1
1356 1 67 LYS H 1 68 ARG QB . . 5.400 4.671 4.519 4.904 . 0 0 "[ . 1 . 2]" 1
1357 1 67 LYS H 1 69 LEU H . . 3.970 3.832 3.737 3.969 . 0 0 "[ . 1 . 2]" 1
1358 1 67 LYS HA 1 67 LYS QD . . 4.710 4.474 4.422 4.518 . 0 0 "[ . 1 . 2]" 1
1359 1 67 LYS HA 1 67 LYS QE . . 4.630 4.336 4.187 4.594 . 0 0 "[ . 1 . 2]" 1
1360 1 67 LYS HA 1 69 LEU H . . 4.800 4.156 4.084 4.325 . 0 0 "[ . 1 . 2]" 1
1361 1 67 LYS HA 1 70 MET H . . 4.330 3.909 3.728 3.977 . 0 0 "[ . 1 . 2]" 1
1362 1 67 LYS HA 1 71 GLN H . . 4.370 4.264 4.034 4.379 0.009 7 0 "[ . 1 . 2]" 1
1363 1 67 LYS HA 1 82 PHE QD . . 5.230 3.730 3.471 3.967 . 0 0 "[ . 1 . 2]" 1
1364 1 67 LYS HA 1 82 PHE QE . . 5.540 3.423 2.881 3.826 . 0 0 "[ . 1 . 2]" 1
1365 1 67 LYS QB 1 67 LYS QE . . 4.010 2.092 1.953 2.489 . 0 0 "[ . 1 . 2]" 1
1366 1 67 LYS QB 1 68 ARG H . . 3.760 3.470 3.457 3.481 . 0 0 "[ . 1 . 2]" 1
1367 1 67 LYS QB 1 71 GLN H . . 5.550 5.334 5.141 5.444 . 0 0 "[ . 1 . 2]" 1
1368 1 67 LYS QB 1 82 PHE QE . . 4.930 2.717 2.504 2.993 . 0 0 "[ . 1 . 2]" 1
1369 1 67 LYS QB 1 82 PHE HZ . . 4.330 2.231 1.984 2.642 . 0 0 "[ . 1 . 2]" 1
1370 1 67 LYS QD 1 68 ARG H . . 5.010 4.126 4.084 4.156 . 0 0 "[ . 1 . 2]" 1
1371 1 67 LYS QD 1 82 PHE QE . . 4.750 4.262 3.895 4.761 0.011 13 0 "[ . 1 . 2]" 1
1372 1 67 LYS QD 1 82 PHE HZ . . 3.960 3.451 3.065 3.943 . 0 0 "[ . 1 . 2]" 1
1373 1 67 LYS QD 1 103 VAL HA . . 4.730 4.334 3.431 4.734 0.004 4 0 "[ . 1 . 2]" 1
1374 1 67 LYS QD 1 103 VAL HB . . 5.320 4.853 3.994 5.237 . 0 0 "[ . 1 . 2]" 1
1375 1 67 LYS QD 1 103 VAL QG . . 3.370 2.924 2.251 3.364 . 0 0 "[ . 1 . 2]" 1
1376 1 67 LYS QE 1 67 LYS QG . . 3.450 2.469 2.132 2.760 . 0 0 "[ . 1 . 2]" 1
1377 1 67 LYS QE 1 68 ARG H . . 5.020 4.706 4.405 4.992 . 0 0 "[ . 1 . 2]" 1
1378 1 67 LYS QE 1 71 GLN QE . . 4.890 3.794 2.230 4.888 . 0 0 "[ . 1 . 2]" 1
1379 1 67 LYS QE 1 82 PHE QE . . 4.150 3.903 3.619 4.160 0.010 4 0 "[ . 1 . 2]" 1
1380 1 67 LYS QE 1 82 PHE HZ . . 4.660 3.953 3.340 4.477 . 0 0 "[ . 1 . 2]" 1
1381 1 67 LYS QE 1 103 VAL HB . . 5.260 4.850 4.330 5.257 . 0 0 "[ . 1 . 2]" 1
1382 1 67 LYS QE 1 103 VAL MG1 . . 5.080 4.711 4.070 5.089 0.009 4 0 "[ . 1 . 2]" 1
1383 1 67 LYS QE 1 103 VAL QG . . 3.800 2.395 1.964 2.712 . 0 0 "[ . 1 . 2]" 1
1384 1 67 LYS QE 1 103 VAL MG2 . . 5.080 2.403 1.966 2.722 . 0 0 "[ . 1 . 2]" 1
1385 1 67 LYS QG 1 68 ARG H . . 3.700 2.195 2.171 2.214 . 0 0 "[ . 1 . 2]" 1
1386 1 67 LYS QG 1 68 ARG HG2 . . 4.280 3.717 3.490 3.853 . 0 0 "[ . 1 . 2]" 1
1387 1 67 LYS QG 1 69 LEU H . . 4.650 4.193 4.167 4.229 . 0 0 "[ . 1 . 2]" 1
1388 1 67 LYS HG2 1 68 ARG H . . 4.450 2.462 2.403 2.516 . 0 0 "[ . 1 . 2]" 1
1389 1 67 LYS HG3 1 68 ARG H . . 4.450 2.469 2.400 2.557 . 0 0 "[ . 1 . 2]" 1
1390 1 68 ARG H 1 68 ARG QB . . 2.860 2.479 2.436 2.562 . 0 0 "[ . 1 . 2]" 1
1391 1 68 ARG H 1 68 ARG QD . . 4.350 3.938 3.641 4.256 . 0 0 "[ . 1 . 2]" 1
1392 1 68 ARG H 1 68 ARG HG2 . . 3.220 2.277 2.142 2.342 . 0 0 "[ . 1 . 2]" 1
1393 1 68 ARG H 1 68 ARG HG3 . . 3.810 3.429 2.970 3.604 . 0 0 "[ . 1 . 2]" 1
1394 1 68 ARG H 1 69 LEU H . . 3.490 2.384 2.376 2.389 . 0 0 "[ . 1 . 2]" 1
1395 1 68 ARG H 1 69 LEU HB2 . . 4.440 4.300 4.256 4.356 . 0 0 "[ . 1 . 2]" 1
1396 1 68 ARG H 1 69 LEU MD1 . . 5.430 5.199 4.842 5.385 . 0 0 "[ . 1 . 2]" 1
1397 1 68 ARG H 1 69 LEU HG . . 4.920 4.778 4.575 4.928 0.008 19 0 "[ . 1 . 2]" 1
1398 1 68 ARG H 1 70 MET H . . 4.590 4.385 4.214 4.442 . 0 0 "[ . 1 . 2]" 1
1399 1 68 ARG H 1 70 MET HB2 . . 6.470 5.415 5.277 5.536 . 0 0 "[ . 1 . 2]" 1
1400 1 68 ARG H 1 71 GLN H . . 4.990 4.776 4.681 4.855 . 0 0 "[ . 1 . 2]" 1
1401 1 68 ARG HA 1 68 ARG QD . . 4.550 4.469 4.268 4.569 0.019 14 0 "[ . 1 . 2]" 1
1402 1 68 ARG HA 1 68 ARG HG2 . . 3.860 3.793 3.739 3.907 0.047 13 0 "[ . 1 . 2]" 1
1403 1 68 ARG HA 1 68 ARG HG3 . . 3.820 3.691 3.629 3.732 . 0 0 "[ . 1 . 2]" 1
1404 1 68 ARG HA 1 71 GLN QB . . 4.630 2.600 2.435 2.730 . 0 0 "[ . 1 . 2]" 1
1405 1 68 ARG QB 1 69 LEU H . . 3.730 3.609 3.540 3.638 . 0 0 "[ . 1 . 2]" 1
1406 1 68 ARG QB 1 71 GLN H . . 5.320 5.134 5.077 5.269 . 0 0 "[ . 1 . 2]" 1
1407 1 68 ARG QD 1 69 LEU H . . 4.680 4.403 4.276 4.528 . 0 0 "[ . 1 . 2]" 1
1408 1 68 ARG HG2 1 69 LEU H . . 4.300 2.731 2.548 3.191 . 0 0 "[ . 1 . 2]" 1
1409 1 68 ARG HG3 1 69 LEU H . . 3.910 2.874 2.445 3.097 . 0 0 "[ . 1 . 2]" 1
1410 1 68 ARG HG3 1 69 LEU HA . . 5.040 3.334 3.266 3.409 . 0 0 "[ . 1 . 2]" 1
1411 1 68 ARG HG3 1 69 LEU MD2 . . 4.050 3.667 3.339 3.957 . 0 0 "[ . 1 . 2]" 1
1412 1 68 ARG HG3 1 69 LEU HG . . 3.620 2.797 2.539 3.032 . 0 0 "[ . 1 . 2]" 1
1413 1 68 ARG HG3 1 71 GLN H . . 6.020 5.595 5.415 5.731 . 0 0 "[ . 1 . 2]" 1
1414 1 69 LEU H 1 69 LEU HB2 . . 4.040 2.192 2.158 2.232 . 0 0 "[ . 1 . 2]" 1
1415 1 69 LEU H 1 69 LEU HB3 . . 3.840 3.494 3.459 3.528 . 0 0 "[ . 1 . 2]" 1
1416 1 69 LEU H 1 69 LEU MD1 . . 4.040 3.787 3.582 3.936 . 0 0 "[ . 1 . 2]" 1
1417 1 69 LEU H 1 69 LEU MD2 . . 4.200 3.981 3.815 4.178 . 0 0 "[ . 1 . 2]" 1
1418 1 69 LEU H 1 69 LEU HG . . 3.390 3.068 2.886 3.203 . 0 0 "[ . 1 . 2]" 1
1419 1 69 LEU H 1 70 MET H . . 3.660 2.588 2.452 2.639 . 0 0 "[ . 1 . 2]" 1
1420 1 69 LEU H 1 70 MET HB2 . . 4.430 4.396 4.318 4.494 0.064 10 0 "[ . 1 . 2]" 1
1421 1 69 LEU HA 1 69 LEU MD1 . . 3.840 3.819 3.801 3.839 . 0 0 "[ . 1 . 2]" 1
1422 1 69 LEU HA 1 69 LEU MD2 . . 3.010 2.031 1.950 2.341 . 0 0 "[ . 1 . 2]" 1
1423 1 69 LEU HA 1 69 LEU HG . . 3.930 2.769 2.602 2.891 . 0 0 "[ . 1 . 2]" 1
1424 1 69 LEU HA 1 71 GLN QB . . 5.070 4.525 4.387 4.883 . 0 0 "[ . 1 . 2]" 1
1425 1 69 LEU HA 1 72 GLN H . . 3.660 3.654 3.583 3.695 0.035 17 0 "[ . 1 . 2]" 1
1426 1 69 LEU HA 1 72 GLN QB . . 4.540 3.665 3.585 3.945 . 0 0 "[ . 1 . 2]" 1
1427 1 69 LEU HA 1 72 GLN QG . . 4.370 3.708 2.108 4.150 . 0 0 "[ . 1 . 2]" 1
1428 1 69 LEU HB2 1 70 MET H . . 3.830 2.507 2.433 2.638 . 0 0 "[ . 1 . 2]" 1
1429 1 69 LEU HB3 1 70 MET H . . 4.310 2.984 2.893 3.176 . 0 0 "[ . 1 . 2]" 1
1430 1 69 LEU MD1 1 70 MET H . . 4.520 4.298 4.192 4.490 . 0 0 "[ . 1 . 2]" 1
1431 1 69 LEU MD2 1 70 MET H . . 4.600 4.504 4.425 4.570 . 0 0 "[ . 1 . 2]" 1
1432 1 69 LEU HG 1 70 MET H . . 4.710 4.654 4.572 4.709 . 0 0 "[ . 1 . 2]" 1
1433 1 70 MET H 1 70 MET HB2 . . 3.960 2.218 2.167 2.482 . 0 0 "[ . 1 . 2]" 1
1434 1 70 MET H 1 70 MET HB3 . . 3.640 3.509 3.481 3.587 . 0 0 "[ . 1 . 2]" 1
1435 1 70 MET H 1 70 MET ME . . 4.410 4.233 3.992 4.431 0.021 10 0 "[ . 1 . 2]" 1
1436 1 70 MET H 1 70 MET HG2 . . 4.490 4.101 2.780 4.306 . 0 0 "[ . 1 . 2]" 1
1437 1 70 MET H 1 70 MET QG . . 3.630 3.216 2.405 3.529 . 0 0 "[ . 1 . 2]" 1
1438 1 70 MET H 1 70 MET HG3 . . 4.490 3.399 2.633 3.848 . 0 0 "[ . 1 . 2]" 1
1439 1 70 MET H 1 71 GLN H . . 3.560 2.672 2.549 2.713 . 0 0 "[ . 1 . 2]" 1
1440 1 70 MET H 1 71 GLN HA . . 5.410 5.233 5.153 5.269 . 0 0 "[ . 1 . 2]" 1
1441 1 70 MET H 1 72 GLN H . . 4.570 4.524 4.438 4.579 0.009 19 0 "[ . 1 . 2]" 1
1442 1 70 MET H 1 82 PHE HB2 . . 5.370 5.225 4.845 5.374 0.004 11 0 "[ . 1 . 2]" 1
1443 1 70 MET HA 1 70 MET ME . . 4.430 4.256 4.019 4.434 0.004 19 0 "[ . 1 . 2]" 1
1444 1 70 MET HA 1 70 MET QG . . 3.640 2.198 2.105 2.320 . 0 0 "[ . 1 . 2]" 1
1445 1 70 MET HA 1 78 TRP HB2 . . 4.660 4.672 4.662 4.684 0.024 10 0 "[ . 1 . 2]" 1
1446 1 70 MET HA 1 78 TRP QB . . 4.100 3.258 3.080 3.346 . 0 0 "[ . 1 . 2]" 1
1447 1 70 MET HA 1 78 TRP HB3 . . 4.660 3.325 3.125 3.427 . 0 0 "[ . 1 . 2]" 1
1448 1 70 MET HA 1 78 TRP HE3 . . 5.160 4.514 4.082 5.011 . 0 0 "[ . 1 . 2]" 1
1449 1 70 MET HB2 1 71 GLN H . . 3.540 3.132 3.001 3.169 . 0 0 "[ . 1 . 2]" 1
1450 1 70 MET HB2 1 82 PHE HB2 . . 4.940 3.280 2.761 3.511 . 0 0 "[ . 1 . 2]" 1
1451 1 70 MET HB2 1 82 PHE HB3 . . 4.880 4.290 3.751 4.576 . 0 0 "[ . 1 . 2]" 1
1452 1 70 MET HB3 1 70 MET ME . . 4.700 4.200 3.959 4.279 . 0 0 "[ . 1 . 2]" 1
1453 1 70 MET HB3 1 71 GLN H . . 4.290 3.641 3.577 3.916 . 0 0 "[ . 1 . 2]" 1
1454 1 70 MET HB3 1 82 PHE HB2 . . 4.680 3.450 2.827 3.780 . 0 0 "[ . 1 . 2]" 1
1455 1 70 MET HB3 1 82 PHE HB3 . . 4.900 4.034 3.477 4.425 . 0 0 "[ . 1 . 2]" 1
1456 1 70 MET ME 1 70 MET QG . . 3.500 2.141 2.058 2.214 . 0 0 "[ . 1 . 2]" 1
1457 1 70 MET ME 1 78 TRP HE3 . . 3.560 2.182 1.948 2.438 . 0 0 "[ . 1 . 2]" 1
1458 1 70 MET ME 1 78 TRP HZ3 . . 4.010 2.083 1.894 2.371 . 0 0 "[ . 1 . 2]" 1
1459 1 70 MET ME 1 81 ALA MB . . 3.740 3.292 2.774 3.727 . 0 0 "[ . 1 . 2]" 1
1460 1 70 MET ME 1 82 PHE HA . . 4.210 3.549 2.972 4.034 . 0 0 "[ . 1 . 2]" 1
1461 1 70 MET ME 1 82 PHE HB2 . . 4.950 3.312 2.403 3.909 . 0 0 "[ . 1 . 2]" 1
1462 1 70 MET ME 1 82 PHE HB3 . . 5.240 4.695 3.797 5.209 . 0 0 "[ . 1 . 2]" 1
1463 1 70 MET ME 1 85 ILE HB . . 5.040 4.433 4.033 4.755 . 0 0 "[ . 1 . 2]" 1
1464 1 70 MET ME 1 85 ILE MD . . 3.110 2.535 1.936 2.734 . 0 0 "[ . 1 . 2]" 1
1465 1 70 MET ME 1 85 ILE MG . . 4.200 4.065 3.850 4.204 0.004 2 0 "[ . 1 . 2]" 1
1466 1 70 MET QG 1 78 TRP HE3 . . 4.000 2.299 1.931 3.541 . 0 0 "[ . 1 . 2]" 1
1467 1 70 MET QG 1 82 PHE QD . . 5.290 4.393 3.374 5.201 . 0 0 "[ . 1 . 2]" 1
1468 1 70 MET HG2 1 78 TRP HE3 . . 4.720 2.656 2.006 3.663 . 0 0 "[ . 1 . 2]" 1
1469 1 70 MET HG3 1 78 TRP HE3 . . 4.720 2.741 2.011 4.695 . 0 0 "[ . 1 . 2]" 1
1470 1 71 GLN H 1 71 GLN QB . . 3.200 2.136 2.096 2.192 . 0 0 "[ . 1 . 2]" 1
1471 1 71 GLN H 1 71 GLN QG . . 3.330 2.930 2.772 3.088 . 0 0 "[ . 1 . 2]" 1
1472 1 71 GLN H 1 72 GLN H . . 3.470 2.704 2.616 2.723 . 0 0 "[ . 1 . 2]" 1
1473 1 71 GLN H 1 72 GLN HA . . 5.270 5.296 5.228 5.317 0.047 10 0 "[ . 1 . 2]" 1
1474 1 71 GLN H 1 72 GLN QB . . 4.810 4.656 4.575 4.791 . 0 0 "[ . 1 . 2]" 1
1475 1 71 GLN H 1 73 SER H . . 4.170 3.968 3.770 4.091 . 0 0 "[ . 1 . 2]" 1
1476 1 71 GLN HA 1 71 GLN QE . . 4.870 4.325 3.816 4.570 . 0 0 "[ . 1 . 2]" 1
1477 1 71 GLN HA 1 71 GLN QG . . 3.450 2.346 2.250 2.480 . 0 0 "[ . 1 . 2]" 1
1478 1 71 GLN QB 1 71 GLN HE22 . . 4.580 4.100 3.838 4.326 . 0 0 "[ . 1 . 2]" 1
1479 1 71 GLN QB 1 72 GLN H . . 3.780 2.625 2.530 2.673 . 0 0 "[ . 1 . 2]" 1
1480 1 71 GLN HE22 1 71 GLN QG . . 3.280 3.221 3.216 3.248 . 0 0 "[ . 1 . 2]" 1
1481 1 71 GLN QG 1 72 GLN H . . 4.490 4.364 4.289 4.412 . 0 0 "[ . 1 . 2]" 1
1482 1 72 GLN H 1 72 GLN QB . . 3.000 2.259 2.173 2.460 . 0 0 "[ . 1 . 2]" 1
1483 1 72 GLN H 1 72 GLN QG . . 3.290 2.695 2.243 2.841 . 0 0 "[ . 1 . 2]" 1
1484 1 72 GLN H 1 73 SER H . . 3.710 2.673 2.619 2.732 . 0 0 "[ . 1 . 2]" 1
1485 1 72 GLN HA 1 72 GLN QG . . 3.410 3.319 3.268 3.417 0.007 3 0 "[ . 1 . 2]" 1
1486 1 72 GLN QB 1 73 SER H . . 4.240 3.588 3.492 3.697 . 0 0 "[ . 1 . 2]" 1
1487 1 72 GLN QB 1 73 SER QB . . 5.780 5.103 4.644 5.349 . 0 0 "[ . 1 . 2]" 1
1488 1 72 GLN QG 1 73 SER QB . . 4.500 3.435 2.739 3.823 . 0 0 "[ . 1 . 2]" 1
1489 1 73 SER H 1 73 SER QB . . 3.830 2.389 2.154 2.712 . 0 0 "[ . 1 . 2]" 1
1490 1 73 SER H 1 74 VAL H . . 4.700 4.589 4.573 4.626 . 0 0 "[ . 1 . 2]" 1
1491 1 73 SER HA 1 73 SER QB . . 2.790 2.402 2.251 2.502 . 0 0 "[ . 1 . 2]" 1
1492 1 73 SER HA 1 74 VAL H . . 3.040 2.276 2.201 2.330 . 0 0 "[ . 1 . 2]" 1
1493 1 73 SER HA 1 74 VAL HB . . 5.550 5.327 4.269 5.682 0.132 20 0 "[ . 1 . 2]" 1
1494 1 73 SER HA 1 74 VAL MG1 . . 5.180 3.642 3.395 4.118 . 0 0 "[ . 1 . 2]" 1
1495 1 73 SER HA 1 74 VAL QG . . 4.390 3.444 3.200 3.992 . 0 0 "[ . 1 . 2]" 1
1496 1 73 SER HA 1 74 VAL MG2 . . 5.180 4.298 3.889 5.375 0.195 10 0 "[ . 1 . 2]" 1
1497 1 73 SER HA 1 75 GLU H . . 4.010 3.882 3.752 3.989 . 0 0 "[ . 1 . 2]" 1
1498 1 73 SER QB 1 74 VAL H . . 3.680 2.836 2.571 3.352 . 0 0 "[ . 1 . 2]" 1
1499 1 73 SER QB 1 75 GLU H . . 3.610 2.906 2.575 3.564 . 0 0 "[ . 1 . 2]" 1
1500 1 73 SER QB 1 75 GLU HB3 . . 6.110 4.995 4.779 5.570 . 0 0 "[ . 1 . 2]" 1
1501 1 73 SER QB 1 78 TRP HB2 . . 4.700 2.880 2.536 3.298 . 0 0 "[ . 1 . 2]" 1
1502 1 73 SER QB 1 78 TRP QB . . 4.070 2.640 2.282 2.975 . 0 0 "[ . 1 . 2]" 1
1503 1 73 SER QB 1 78 TRP HB3 . . 4.700 3.077 2.589 3.414 . 0 0 "[ . 1 . 2]" 1
1504 1 73 SER QB 1 78 TRP HD1 . . 4.030 3.149 2.706 4.030 0.000 17 0 "[ . 1 . 2]" 1
1505 1 73 SER QB 1 78 TRP HE1 . . 6.090 4.753 4.220 5.657 . 0 0 "[ . 1 . 2]" 1
1506 1 73 SER QB 1 79 ASN HD21 . . 5.020 4.578 4.171 4.787 . 0 0 "[ . 1 . 2]" 1
1507 1 73 SER QB 1 79 ASN HD22 . . 4.570 3.968 3.575 4.237 . 0 0 "[ . 1 . 2]" 1
1508 1 74 VAL H 1 74 VAL HB . . 3.730 3.493 2.772 3.745 0.015 8 0 "[ . 1 . 2]" 1
1509 1 74 VAL H 1 74 VAL MG1 . . 4.000 2.461 2.123 2.678 . 0 0 "[ . 1 . 2]" 1
1510 1 74 VAL H 1 74 VAL QG . . 2.890 2.005 1.926 2.158 . 0 0 "[ . 1 . 2]" 1
1511 1 74 VAL H 1 74 VAL MG2 . . 4.000 2.494 2.001 3.869 . 0 0 "[ . 1 . 2]" 1
1512 1 74 VAL H 1 75 GLU H . . 3.560 2.049 2.009 2.138 . 0 0 "[ . 1 . 2]" 1
1513 1 74 VAL HA 1 74 VAL MG1 . . 3.410 2.559 2.322 3.192 . 0 0 "[ . 1 . 2]" 1
1514 1 74 VAL HA 1 74 VAL QG . . 2.820 2.272 2.207 2.330 . 0 0 "[ . 1 . 2]" 1
1515 1 74 VAL HA 1 74 VAL MG2 . . 3.410 2.961 2.251 3.199 . 0 0 "[ . 1 . 2]" 1
1516 1 74 VAL HA 1 75 GLU H . . 3.450 3.430 3.384 3.457 0.007 10 0 "[ . 1 . 2]" 1
1517 1 74 VAL HA 1 79 ASN HD21 . . 4.260 3.983 3.700 4.261 0.001 9 0 "[ . 1 . 2]" 1
1518 1 74 VAL HA 1 79 ASN HD22 . . 3.970 2.686 2.356 2.859 . 0 0 "[ . 1 . 2]" 1
1519 1 74 VAL HB 1 75 GLU H . . 4.400 4.088 3.984 4.191 . 0 0 "[ . 1 . 2]" 1
1520 1 74 VAL HB 1 79 ASN HD21 . . 6.160 5.781 5.573 6.139 . 0 0 "[ . 1 . 2]" 1
1521 1 74 VAL HB 1 79 ASN HD22 . . 4.860 4.856 4.703 4.874 0.014 10 0 "[ . 1 . 2]" 1
1522 1 74 VAL QG 1 75 GLU H . . 2.900 2.342 2.129 2.511 . 0 0 "[ . 1 . 2]" 1
1523 1 74 VAL QG 1 75 GLU HA . . 4.240 3.119 2.998 3.239 . 0 0 "[ . 1 . 2]" 1
1524 1 74 VAL QG 1 75 GLU QG . . 3.670 2.923 2.572 3.138 . 0 0 "[ . 1 . 2]" 1
1525 1 74 VAL QG 1 79 ASN HD21 . . 5.250 4.782 4.200 5.080 . 0 0 "[ . 1 . 2]" 1
1526 1 74 VAL QG 1 79 ASN HD22 . . 4.360 4.137 3.655 4.347 . 0 0 "[ . 1 . 2]" 1
1527 1 74 VAL MG1 1 75 GLU H . . 4.070 3.553 2.273 4.022 . 0 0 "[ . 1 . 2]" 1
1528 1 74 VAL MG1 1 75 GLU HA . . 5.670 4.844 3.080 5.444 . 0 0 "[ . 1 . 2]" 1
1529 1 74 VAL MG1 1 75 GLU QG . . 4.940 4.340 2.582 4.932 . 0 0 "[ . 1 . 2]" 1
1530 1 74 VAL MG1 1 79 ASN HD22 . . 5.050 4.666 4.478 4.795 . 0 0 "[ . 1 . 2]" 1
1531 1 74 VAL MG2 1 75 GLU H . . 4.070 2.785 2.138 4.086 0.016 5 0 "[ . 1 . 2]" 1
1532 1 74 VAL MG2 1 75 GLU HA . . 5.670 3.429 3.089 4.260 . 0 0 "[ . 1 . 2]" 1
1533 1 74 VAL MG2 1 75 GLU QG . . 4.940 3.489 2.686 4.937 . 0 0 "[ . 1 . 2]" 1
1534 1 74 VAL MG2 1 79 ASN HD22 . . 5.050 4.690 3.828 5.055 0.005 7 0 "[ . 1 . 2]" 1
1535 1 75 GLU H 1 75 GLU HB2 . . 2.970 2.678 2.464 2.715 . 0 0 "[ . 1 . 2]" 1
1536 1 75 GLU H 1 75 GLU HB3 . . 3.720 3.582 3.577 3.591 . 0 0 "[ . 1 . 2]" 1
1537 1 75 GLU H 1 75 GLU QG . . 3.080 1.973 1.932 2.216 . 0 0 "[ . 1 . 2]" 1
1538 1 75 GLU H 1 76 SER H . . 4.680 4.519 4.419 4.600 . 0 0 "[ . 1 . 2]" 1
1539 1 75 GLU H 1 77 VAL MG1 . . 5.120 4.641 4.443 4.940 . 0 0 "[ . 1 . 2]" 1
1540 1 75 GLU H 1 79 ASN HD21 . . 4.690 4.363 4.055 4.590 . 0 0 "[ . 1 . 2]" 1
1541 1 75 GLU H 1 79 ASN HD22 . . 4.630 4.102 3.697 4.464 . 0 0 "[ . 1 . 2]" 1
1542 1 75 GLU HA 1 75 GLU QG . . 3.370 2.996 2.472 3.168 . 0 0 "[ . 1 . 2]" 1
1543 1 75 GLU HB2 1 78 TRP H . . 4.710 2.776 2.617 3.138 . 0 0 "[ . 1 . 2]" 1
1544 1 75 GLU HB2 1 78 TRP HD1 . . 3.990 2.036 1.994 2.198 . 0 0 "[ . 1 . 2]" 1
1545 1 75 GLU HB2 1 79 ASN H . . 4.430 4.356 4.069 4.439 0.009 13 0 "[ . 1 . 2]" 1
1546 1 75 GLU HB3 1 77 VAL MG1 . . 3.100 1.956 1.922 2.038 . 0 0 "[ . 1 . 2]" 1
1547 1 75 GLU HB3 1 78 TRP HD1 . . 3.700 3.364 2.568 3.668 . 0 0 "[ . 1 . 2]" 1
1548 1 75 GLU QG 1 78 TRP HD1 . . 3.730 2.677 2.346 2.927 . 0 0 "[ . 1 . 2]" 1
1549 1 75 GLU QG 1 78 TRP HE1 . . 4.670 3.937 3.733 4.431 . 0 0 "[ . 1 . 2]" 1
1550 1 76 SER HA 1 78 TRP H . . 4.310 4.178 4.141 4.262 . 0 0 "[ . 1 . 2]" 1
1551 1 76 SER HA 1 79 ASN H . . 3.630 3.321 3.237 3.442 . 0 0 "[ . 1 . 2]" 1
1552 1 76 SER HA 1 79 ASN QB . . 4.200 2.446 2.303 2.581 . 0 0 "[ . 1 . 2]" 1
1553 1 76 SER HA 1 79 ASN HD21 . . 4.290 2.400 2.022 2.629 . 0 0 "[ . 1 . 2]" 1
1554 1 76 SER HA 1 79 ASN HD22 . . 4.480 3.994 3.590 4.246 . 0 0 "[ . 1 . 2]" 1
1555 1 76 SER HA 1 80 MET H . . 3.860 3.619 3.398 3.863 0.003 14 0 "[ . 1 . 2]" 1
1556 1 76 SER QB 1 77 VAL H . . 3.770 3.000 2.624 3.638 . 0 0 "[ . 1 . 2]" 1
1557 1 76 SER QB 1 78 TRP H . . 5.310 4.897 4.668 5.171 . 0 0 "[ . 1 . 2]" 1
1558 1 76 SER QB 1 79 ASN H . . 5.180 4.878 4.763 4.997 . 0 0 "[ . 1 . 2]" 1
1559 1 76 SER QB 1 80 MET H . . 4.420 4.245 4.078 4.415 . 0 0 "[ . 1 . 2]" 1
1560 1 76 SER HB2 1 77 VAL H . . 4.350 3.165 2.712 4.164 . 0 0 "[ . 1 . 2]" 1
1561 1 76 SER HB3 1 77 VAL H . . 4.350 3.962 3.497 4.213 . 0 0 "[ . 1 . 2]" 1
1562 1 77 VAL H 1 77 VAL HB . . 3.810 2.605 2.580 2.639 . 0 0 "[ . 1 . 2]" 1
1563 1 77 VAL H 1 77 VAL MG1 . . 3.800 1.952 1.921 1.999 . 0 0 "[ . 1 . 2]" 1
1564 1 77 VAL H 1 77 VAL MG2 . . 3.820 3.765 3.763 3.768 . 0 0 "[ . 1 . 2]" 1
1565 1 77 VAL H 1 78 TRP H . . 4.270 2.687 2.576 2.790 . 0 0 "[ . 1 . 2]" 1
1566 1 77 VAL H 1 79 ASN H . . 4.470 4.216 4.052 4.339 . 0 0 "[ . 1 . 2]" 1
1567 1 77 VAL HA 1 77 VAL MG1 . . 3.350 3.194 3.189 3.200 . 0 0 "[ . 1 . 2]" 1
1568 1 77 VAL HA 1 77 VAL MG2 . . 3.220 2.318 2.280 2.372 . 0 0 "[ . 1 . 2]" 1
1569 1 77 VAL HA 1 79 ASN H . . 5.020 4.739 4.558 4.880 . 0 0 "[ . 1 . 2]" 1
1570 1 77 VAL HA 1 80 MET H . . 4.060 3.925 3.741 4.063 0.003 10 0 "[ . 1 . 2]" 1
1571 1 77 VAL HA 1 80 MET QB . . 3.800 3.107 2.861 3.397 . 0 0 "[ . 1 . 2]" 1
1572 1 77 VAL HA 1 80 MET QG . . 4.570 3.996 3.799 4.295 . 0 0 "[ . 1 . 2]" 1
1573 1 77 VAL HB 1 78 TRP H . . 4.330 3.953 3.922 3.967 . 0 0 "[ . 1 . 2]" 1
1574 1 77 VAL MG1 1 78 TRP H . . 3.790 1.977 1.885 2.072 . 0 0 "[ . 1 . 2]" 1
1575 1 77 VAL MG1 1 78 TRP HA . . 4.160 3.444 3.375 3.517 . 0 0 "[ . 1 . 2]" 1
1576 1 77 VAL MG1 1 78 TRP HD1 . . 3.890 2.927 2.794 3.036 . 0 0 "[ . 1 . 2]" 1
1577 1 77 VAL MG1 1 78 TRP HE1 . . 4.420 3.843 3.601 4.057 . 0 0 "[ . 1 . 2]" 1
1578 1 77 VAL MG1 1 79 ASN H . . 4.260 4.134 4.054 4.192 . 0 0 "[ . 1 . 2]" 1
1579 1 77 VAL MG1 1 80 MET H . . 5.890 5.131 5.010 5.273 . 0 0 "[ . 1 . 2]" 1
1580 1 77 VAL MG2 1 78 TRP H . . 4.220 3.541 3.427 3.625 . 0 0 "[ . 1 . 2]" 1
1581 1 77 VAL MG2 1 78 TRP HA . . 4.150 3.607 3.418 3.711 . 0 0 "[ . 1 . 2]" 1
1582 1 77 VAL MG2 1 78 TRP HD1 . . 4.870 4.842 4.664 4.881 0.011 10 0 "[ . 1 . 2]" 1
1583 1 77 VAL MG2 1 79 ASN H . . 5.250 5.235 5.135 5.261 0.011 5 0 "[ . 1 . 2]" 1
1584 1 77 VAL MG2 1 80 MET H . . 5.410 5.113 4.963 5.278 . 0 0 "[ . 1 . 2]" 1
1585 1 77 VAL MG2 1 81 ALA H . . 5.070 4.180 3.977 4.555 . 0 0 "[ . 1 . 2]" 1
1586 1 78 TRP H 1 78 TRP HD1 . . 4.010 3.384 3.311 3.515 . 0 0 "[ . 1 . 2]" 1
1587 1 78 TRP H 1 78 TRP HE1 . . 5.550 5.407 5.224 5.555 0.005 19 0 "[ . 1 . 2]" 1
1588 1 78 TRP H 1 79 ASN HA . . 5.180 5.164 5.141 5.185 0.005 17 0 "[ . 1 . 2]" 1
1589 1 78 TRP H 1 79 ASN QB . . 4.500 4.440 4.384 4.501 0.001 8 0 "[ . 1 . 2]" 1
1590 1 78 TRP H 1 79 ASN HD21 . . 4.440 3.977 3.796 4.181 . 0 0 "[ . 1 . 2]" 1
1591 1 78 TRP HA 1 78 TRP HD1 . . 5.070 4.333 4.246 4.446 . 0 0 "[ . 1 . 2]" 1
1592 1 78 TRP HA 1 78 TRP HE3 . . 3.830 2.479 2.330 2.644 . 0 0 "[ . 1 . 2]" 1
1593 1 78 TRP HA 1 81 ALA H . . 3.720 3.486 3.348 3.613 . 0 0 "[ . 1 . 2]" 1
1594 1 78 TRP HA 1 81 ALA MB . . 3.610 2.279 2.042 2.514 . 0 0 "[ . 1 . 2]" 1
1595 1 78 TRP HA 1 82 PHE H . . 4.250 4.079 3.860 4.253 0.003 11 0 "[ . 1 . 2]" 1
1596 1 78 TRP QB 1 78 TRP HD1 . . 3.390 2.504 2.497 2.513 . 0 0 "[ . 1 . 2]" 1
1597 1 78 TRP QB 1 78 TRP HE1 . . 4.450 4.392 4.386 4.398 . 0 0 "[ . 1 . 2]" 1
1598 1 78 TRP QB 1 79 ASN H . . 3.410 2.573 2.472 2.687 . 0 0 "[ . 1 . 2]" 1
1599 1 78 TRP QB 1 80 MET H . . 5.800 4.762 4.678 4.913 . 0 0 "[ . 1 . 2]" 1
1600 1 78 TRP QB 1 81 ALA MB . . 4.560 4.039 3.818 4.293 . 0 0 "[ . 1 . 2]" 1
1601 1 78 TRP HB2 1 79 ASN H . . 3.960 2.685 2.546 2.832 . 0 0 "[ . 1 . 2]" 1
1602 1 78 TRP HB3 1 79 ASN H . . 3.960 3.301 3.199 3.418 . 0 0 "[ . 1 . 2]" 1
1603 1 78 TRP HE3 1 79 ASN H . . 5.770 5.409 5.313 5.474 . 0 0 "[ . 1 . 2]" 1
1604 1 78 TRP HE3 1 81 ALA MB . . 3.710 3.197 2.948 3.560 . 0 0 "[ . 1 . 2]" 1
1605 1 78 TRP HE3 1 85 ILE MD . . 5.310 4.184 3.816 4.431 . 0 0 "[ . 1 . 2]" 1
1606 1 79 ASN H 1 79 ASN HA . . 2.920 2.802 2.767 2.843 . 0 0 "[ . 1 . 2]" 1
1607 1 79 ASN H 1 79 ASN QB . . 2.630 2.361 2.305 2.419 . 0 0 "[ . 1 . 2]" 1
1608 1 79 ASN H 1 79 ASN HD21 . . 3.540 2.358 2.223 2.502 . 0 0 "[ . 1 . 2]" 1
1609 1 79 ASN H 1 79 ASN HD22 . . 4.090 3.563 3.404 3.704 . 0 0 "[ . 1 . 2]" 1
1610 1 79 ASN H 1 80 MET H . . 3.410 2.750 2.586 2.873 . 0 0 "[ . 1 . 2]" 1
1611 1 79 ASN H 1 80 MET QB . . 5.050 4.729 4.468 4.935 . 0 0 "[ . 1 . 2]" 1
1612 1 79 ASN H 1 80 MET QG . . 4.640 4.511 4.329 4.656 0.016 10 0 "[ . 1 . 2]" 1
1613 1 79 ASN H 1 81 ALA H . . 4.120 3.998 3.837 4.125 0.005 3 0 "[ . 1 . 2]" 1
1614 1 79 ASN H 1 81 ALA MB . . 4.740 4.496 4.336 4.635 . 0 0 "[ . 1 . 2]" 1
1615 1 79 ASN H 1 82 PHE H . . 5.150 4.943 4.683 5.126 . 0 0 "[ . 1 . 2]" 1
1616 1 79 ASN HA 1 79 ASN HD21 . . 3.920 3.914 3.844 3.927 0.007 7 0 "[ . 1 . 2]" 1
1617 1 79 ASN HA 1 79 ASN HD22 . . 4.420 4.319 4.249 4.359 . 0 0 "[ . 1 . 2]" 1
1618 1 79 ASN HA 1 82 PHE H . . 4.010 3.846 3.565 3.996 . 0 0 "[ . 1 . 2]" 1
1619 1 79 ASN HA 1 82 PHE HB2 . . 4.670 4.178 3.739 4.391 . 0 0 "[ . 1 . 2]" 1
1620 1 79 ASN HA 1 82 PHE HB3 . . 4.950 3.441 2.965 3.818 . 0 0 "[ . 1 . 2]" 1
1621 1 79 ASN QB 1 79 ASN HD22 . . 3.400 3.271 3.262 3.279 . 0 0 "[ . 1 . 2]" 1
1622 1 79 ASN QB 1 80 MET H . . 3.150 2.472 2.365 2.576 . 0 0 "[ . 1 . 2]" 1
1623 1 79 ASN QB 1 80 MET HA . . 4.610 3.870 3.823 3.901 . 0 0 "[ . 1 . 2]" 1
1624 1 79 ASN QB 1 81 ALA H . . 4.740 4.544 4.348 4.693 . 0 0 "[ . 1 . 2]" 1
1625 1 79 ASN QB 1 82 PHE H . . 5.400 5.143 4.897 5.301 . 0 0 "[ . 1 . 2]" 1
1626 1 80 MET H 1 80 MET QB . . 2.880 2.395 2.264 2.506 . 0 0 "[ . 1 . 2]" 1
1627 1 80 MET H 1 80 MET HG2 . . 3.620 2.772 2.099 3.455 . 0 0 "[ . 1 . 2]" 1
1628 1 80 MET H 1 80 MET QG . . 3.090 2.365 2.081 2.682 . 0 0 "[ . 1 . 2]" 1
1629 1 80 MET H 1 80 MET HG3 . . 3.620 2.989 2.381 3.523 . 0 0 "[ . 1 . 2]" 1
1630 1 80 MET H 1 81 ALA H . . 3.190 2.562 2.507 2.651 . 0 0 "[ . 1 . 2]" 1
1631 1 80 MET H 1 81 ALA HA . . 5.340 5.167 5.105 5.245 . 0 0 "[ . 1 . 2]" 1
1632 1 80 MET H 1 81 ALA MB . . 4.220 4.163 4.084 4.225 0.005 16 0 "[ . 1 . 2]" 1
1633 1 80 MET H 1 82 PHE H . . 4.530 4.358 4.131 4.533 0.003 10 0 "[ . 1 . 2]" 1
1634 1 80 MET H 1 82 PHE HB3 . . 6.370 5.442 5.224 5.695 . 0 0 "[ . 1 . 2]" 1
1635 1 80 MET HA 1 80 MET HG2 . . 3.980 2.559 2.240 2.954 . 0 0 "[ . 1 . 2]" 1
1636 1 80 MET HA 1 80 MET QG . . 3.410 2.503 2.201 2.861 . 0 0 "[ . 1 . 2]" 1
1637 1 80 MET HA 1 80 MET HG3 . . 3.980 3.545 3.235 3.830 . 0 0 "[ . 1 . 2]" 1
1638 1 80 MET HA 1 82 PHE H . . 4.760 4.475 4.198 4.684 . 0 0 "[ . 1 . 2]" 1
1639 1 80 MET HA 1 83 ASP H . . 3.950 3.534 3.420 3.786 . 0 0 "[ . 1 . 2]" 1
1640 1 80 MET HA 1 83 ASP QB . . 4.420 2.875 2.590 3.226 . 0 0 "[ . 1 . 2]" 1
1641 1 80 MET HA 1 84 PHE H . . 4.950 4.598 4.373 4.869 . 0 0 "[ . 1 . 2]" 1
1642 1 80 MET QB 1 81 ALA H . . 2.960 2.683 2.552 2.950 . 0 0 "[ . 1 . 2]" 1
1643 1 80 MET QG 1 81 ALA H . . 4.310 4.106 3.956 4.237 . 0 0 "[ . 1 . 2]" 1
1644 1 80 MET HG2 1 81 ALA H . . 4.910 4.621 4.197 4.913 0.003 13 0 "[ . 1 . 2]" 1
1645 1 80 MET HG3 1 81 ALA H . . 4.910 4.675 4.378 4.917 0.007 5 0 "[ . 1 . 2]" 1
1646 1 81 ALA H 1 81 ALA MB . . 2.840 2.132 2.070 2.227 . 0 0 "[ . 1 . 2]" 1
1647 1 81 ALA H 1 82 PHE H . . 3.470 2.791 2.550 2.913 . 0 0 "[ . 1 . 2]" 1
1648 1 81 ALA H 1 82 PHE HB3 . . 5.190 4.846 4.622 4.993 . 0 0 "[ . 1 . 2]" 1
1649 1 81 ALA H 1 83 ASP H . . 4.540 4.307 4.118 4.468 . 0 0 "[ . 1 . 2]" 1
1650 1 81 ALA HA 1 84 PHE H . . 3.720 3.559 3.482 3.623 . 0 0 "[ . 1 . 2]" 1
1651 1 81 ALA HA 1 84 PHE HB2 . . 4.280 4.003 3.801 4.261 . 0 0 "[ . 1 . 2]" 1
1652 1 81 ALA HA 1 84 PHE HB3 . . 4.150 3.081 2.828 3.221 . 0 0 "[ . 1 . 2]" 1
1653 1 81 ALA HA 1 84 PHE QD . . 5.100 4.622 4.405 4.873 . 0 0 "[ . 1 . 2]" 1
1654 1 81 ALA MB 1 82 PHE H . . 3.610 2.540 2.386 2.711 . 0 0 "[ . 1 . 2]" 1
1655 1 81 ALA MB 1 83 ASP H . . 5.130 4.571 4.407 4.781 . 0 0 "[ . 1 . 2]" 1
1656 1 81 ALA MB 1 84 PHE H . . 4.620 4.603 4.533 4.635 0.015 12 0 "[ . 1 . 2]" 1
1657 1 81 ALA MB 1 84 PHE HB3 . . 4.400 4.315 4.090 4.405 0.005 2 0 "[ . 1 . 2]" 1
1658 1 81 ALA MB 1 85 ILE H . . 4.870 4.288 4.214 4.384 . 0 0 "[ . 1 . 2]" 1
1659 1 81 ALA MB 1 85 ILE MD . . 3.910 2.060 1.947 2.380 . 0 0 "[ . 1 . 2]" 1
1660 1 82 PHE H 1 82 PHE HB2 . . 3.730 2.619 2.505 2.673 . 0 0 "[ . 1 . 2]" 1
1661 1 82 PHE H 1 82 PHE HB3 . . 3.520 2.446 2.397 2.556 . 0 0 "[ . 1 . 2]" 1
1662 1 82 PHE H 1 82 PHE QD . . 4.220 4.178 4.174 4.183 . 0 0 "[ . 1 . 2]" 1
1663 1 82 PHE H 1 83 ASP H . . 4.170 2.811 2.746 2.876 . 0 0 "[ . 1 . 2]" 1
1664 1 82 PHE H 1 84 PHE H . . 4.360 4.256 4.071 4.369 0.009 13 0 "[ . 1 . 2]" 1
1665 1 82 PHE H 1 85 ILE HG13 . . 5.200 4.980 4.744 5.143 . 0 0 "[ . 1 . 2]" 1
1666 1 82 PHE H 1 86 LEU MD2 . . 5.480 5.161 5.068 5.283 . 0 0 "[ . 1 . 2]" 1
1667 1 82 PHE HA 1 82 PHE QD . . 3.880 2.323 2.228 2.472 . 0 0 "[ . 1 . 2]" 1
1668 1 82 PHE HA 1 82 PHE QE . . 4.780 4.529 4.468 4.572 . 0 0 "[ . 1 . 2]" 1
1669 1 82 PHE HA 1 85 ILE H . . 3.550 3.444 3.296 3.529 . 0 0 "[ . 1 . 2]" 1
1670 1 82 PHE HA 1 85 ILE HB . . 4.230 2.498 2.370 2.677 . 0 0 "[ . 1 . 2]" 1
1671 1 82 PHE HA 1 85 ILE MD . . 4.090 2.148 1.952 2.507 . 0 0 "[ . 1 . 2]" 1
1672 1 82 PHE HA 1 85 ILE MG . . 4.250 3.912 3.795 4.075 . 0 0 "[ . 1 . 2]" 1
1673 1 82 PHE HA 1 86 LEU H . . 3.790 3.453 3.314 3.649 . 0 0 "[ . 1 . 2]" 1
1674 1 82 PHE HA 1 86 LEU MD2 . . 4.180 3.849 3.711 4.049 . 0 0 "[ . 1 . 2]" 1
1675 1 82 PHE HB2 1 83 ASP H . . 4.470 3.896 3.816 3.947 . 0 0 "[ . 1 . 2]" 1
1676 1 82 PHE HB3 1 83 ASP H . . 4.380 2.531 2.410 2.654 . 0 0 "[ . 1 . 2]" 1
1677 1 82 PHE QD 1 83 ASP H . . 4.350 3.658 3.371 3.792 . 0 0 "[ . 1 . 2]" 1
1678 1 82 PHE QD 1 83 ASP HA . . 4.110 4.037 3.825 4.116 0.006 16 0 "[ . 1 . 2]" 1
1679 1 82 PHE QD 1 85 ILE MD . . 4.200 3.498 3.103 3.742 . 0 0 "[ . 1 . 2]" 1
1680 1 82 PHE QD 1 85 ILE MG . . 4.300 3.848 3.651 4.089 . 0 0 "[ . 1 . 2]" 1
1681 1 82 PHE QD 1 86 LEU MD2 . . 4.040 2.820 2.661 2.888 . 0 0 "[ . 1 . 2]" 1
1682 1 82 PHE QE 1 86 LEU MD1 . . 4.870 4.288 4.114 4.464 . 0 0 "[ . 1 . 2]" 1
1683 1 82 PHE QE 1 86 LEU MD2 . . 3.810 2.611 2.522 2.678 . 0 0 "[ . 1 . 2]" 1
1684 1 82 PHE QE 1 103 VAL MG1 . . 4.900 4.522 4.249 4.891 . 0 0 "[ . 1 . 2]" 1
1685 1 82 PHE QE 1 103 VAL QG . . 4.530 2.930 2.436 3.585 . 0 0 "[ . 1 . 2]" 1
1686 1 82 PHE QE 1 103 VAL MG2 . . 4.300 2.976 2.449 3.687 . 0 0 "[ . 1 . 2]" 1
1687 1 82 PHE HZ 1 86 LEU MD1 . . 4.780 4.400 4.091 4.780 0.000 13 0 "[ . 1 . 2]" 1
1688 1 82 PHE HZ 1 86 LEU MD2 . . 3.780 2.727 2.611 3.476 . 0 0 "[ . 1 . 2]" 1
1689 1 82 PHE HZ 1 103 VAL MG1 . . 4.900 4.877 4.364 4.914 0.014 17 0 "[ . 1 . 2]" 1
1690 1 82 PHE HZ 1 103 VAL QG . . 4.230 2.820 2.619 3.207 . 0 0 "[ . 1 . 2]" 1
1691 1 82 PHE HZ 1 103 VAL MG2 . . 4.300 2.840 2.629 3.251 . 0 0 "[ . 1 . 2]" 1
1692 1 83 ASP H 1 83 ASP QB . . 3.640 2.237 2.136 2.477 . 0 0 "[ . 1 . 2]" 1
1693 1 83 ASP H 1 84 PHE H . . 3.780 2.802 2.752 2.836 . 0 0 "[ . 1 . 2]" 1
1694 1 83 ASP H 1 86 LEU HG . . 5.600 4.833 4.588 5.070 . 0 0 "[ . 1 . 2]" 1
1695 1 83 ASP HA 1 86 LEU H . . 4.260 4.188 4.061 4.267 0.007 10 0 "[ . 1 . 2]" 1
1696 1 83 ASP HA 1 86 LEU HB2 . . 5.630 5.213 5.113 5.282 . 0 0 "[ . 1 . 2]" 1
1697 1 83 ASP HA 1 86 LEU HB3 . . 4.680 4.413 4.212 4.611 . 0 0 "[ . 1 . 2]" 1
1698 1 83 ASP HA 1 86 LEU MD2 . . 3.790 1.944 1.903 2.076 . 0 0 "[ . 1 . 2]" 1
1699 1 83 ASP HA 1 86 LEU HG . . 3.840 2.708 2.544 2.869 . 0 0 "[ . 1 . 2]" 1
1700 1 83 ASP QB 1 84 PHE H . . 3.420 2.579 2.470 2.684 . 0 0 "[ . 1 . 2]" 1
1701 1 83 ASP QB 1 84 PHE HA . . 4.470 4.000 3.824 4.349 . 0 0 "[ . 1 . 2]" 1
1702 1 83 ASP QB 1 85 ILE H . . 5.080 4.832 4.657 4.954 . 0 0 "[ . 1 . 2]" 1
1703 1 83 ASP QB 1 86 LEU H . . 5.880 5.474 5.373 5.527 . 0 0 "[ . 1 . 2]" 1
1704 1 84 PHE H 1 84 PHE HB2 . . 3.700 2.651 2.549 2.754 . 0 0 "[ . 1 . 2]" 1
1705 1 84 PHE H 1 84 PHE HB3 . . 3.930 2.465 2.375 2.561 . 0 0 "[ . 1 . 2]" 1
1706 1 84 PHE H 1 84 PHE QD . . 4.360 4.178 4.131 4.200 . 0 0 "[ . 1 . 2]" 1
1707 1 84 PHE H 1 85 ILE H . . 3.420 2.585 2.508 2.635 . 0 0 "[ . 1 . 2]" 1
1708 1 84 PHE H 1 85 ILE HB . . 4.760 4.722 4.699 4.752 . 0 0 "[ . 1 . 2]" 1
1709 1 84 PHE H 1 85 ILE MD . . 6.050 4.552 4.397 4.823 . 0 0 "[ . 1 . 2]" 1
1710 1 84 PHE H 1 85 ILE HG13 . . 4.570 4.252 4.136 4.347 . 0 0 "[ . 1 . 2]" 1
1711 1 84 PHE H 1 86 LEU H . . 4.770 4.330 4.278 4.383 . 0 0 "[ . 1 . 2]" 1
1712 1 84 PHE H 1 86 LEU MD2 . . 4.650 4.549 4.479 4.645 . 0 0 "[ . 1 . 2]" 1
1713 1 84 PHE H 1 86 LEU HG . . 5.380 4.587 4.323 4.800 . 0 0 "[ . 1 . 2]" 1
1714 1 84 PHE HA 1 84 PHE QD . . 3.890 2.918 2.704 3.023 . 0 0 "[ . 1 . 2]" 1
1715 1 84 PHE HA 1 87 ASP H . . 3.960 3.524 3.447 3.631 . 0 0 "[ . 1 . 2]" 1
1716 1 84 PHE HA 1 87 ASP HB2 . . 4.630 3.502 3.374 3.766 . 0 0 "[ . 1 . 2]" 1
1717 1 84 PHE HA 1 87 ASP HB3 . . 3.960 2.355 2.222 2.683 . 0 0 "[ . 1 . 2]" 1
1718 1 84 PHE HA 1 88 ASN H . . 4.770 4.268 4.151 4.447 . 0 0 "[ . 1 . 2]" 1
1719 1 84 PHE HB2 1 85 ILE H . . 4.070 3.804 3.696 3.963 . 0 0 "[ . 1 . 2]" 1
1720 1 84 PHE HB3 1 85 ILE H . . 4.260 2.432 2.326 2.641 . 0 0 "[ . 1 . 2]" 1
1721 1 84 PHE HB3 1 85 ILE HG13 . . 5.300 3.226 3.135 3.319 . 0 0 "[ . 1 . 2]" 1
1722 1 84 PHE QD 1 85 ILE H . . 3.860 3.125 2.867 3.308 . 0 0 "[ . 1 . 2]" 1
1723 1 84 PHE QD 1 85 ILE HA . . 4.780 2.989 2.753 3.282 . 0 0 "[ . 1 . 2]" 1
1724 1 84 PHE QD 1 85 ILE MD . . 5.140 4.425 4.187 4.674 . 0 0 "[ . 1 . 2]" 1
1725 1 84 PHE QE 1 85 ILE HA . . 5.340 4.316 4.000 4.657 . 0 0 "[ . 1 . 2]" 1
1726 1 85 ILE H 1 85 ILE HB . . 3.330 2.581 2.536 2.605 . 0 0 "[ . 1 . 2]" 1
1727 1 85 ILE H 1 85 ILE MD . . 3.530 3.130 2.996 3.327 . 0 0 "[ . 1 . 2]" 1
1728 1 85 ILE H 1 85 ILE HG12 . . 3.670 3.544 3.407 3.660 . 0 0 "[ . 1 . 2]" 1
1729 1 85 ILE H 1 85 ILE HG13 . . 3.290 2.040 1.956 2.156 . 0 0 "[ . 1 . 2]" 1
1730 1 85 ILE H 1 85 ILE MG . . 3.810 3.765 3.763 3.767 . 0 0 "[ . 1 . 2]" 1
1731 1 85 ILE H 1 86 LEU HG . . 5.310 4.579 4.327 4.815 . 0 0 "[ . 1 . 2]" 1
1732 1 85 ILE H 1 88 ASN H . . 5.010 4.753 4.665 4.924 . 0 0 "[ . 1 . 2]" 1
1733 1 85 ILE HA 1 85 ILE MD . . 4.070 3.876 3.867 3.883 . 0 0 "[ . 1 . 2]" 1
1734 1 85 ILE HA 1 85 ILE MG . . 3.460 2.331 2.312 2.374 . 0 0 "[ . 1 . 2]" 1
1735 1 85 ILE HA 1 87 ASP H . . 4.600 4.364 4.224 4.520 . 0 0 "[ . 1 . 2]" 1
1736 1 85 ILE HA 1 88 ASN H . . 3.730 3.558 3.375 3.720 . 0 0 "[ . 1 . 2]" 1
1737 1 85 ILE HA 1 88 ASN HB2 . . 4.810 2.864 2.593 3.125 . 0 0 "[ . 1 . 2]" 1
1738 1 85 ILE HA 1 88 ASN QB . . 4.220 2.831 2.566 3.084 . 0 0 "[ . 1 . 2]" 1
1739 1 85 ILE HA 1 88 ASN HB3 . . 4.810 4.438 4.086 4.723 . 0 0 "[ . 1 . 2]" 1
1740 1 85 ILE HA 1 88 ASN HD21 . . 4.390 4.182 3.990 4.375 . 0 0 "[ . 1 . 2]" 1
1741 1 85 ILE HB 1 85 ILE MD . . 3.660 2.222 2.090 2.382 . 0 0 "[ . 1 . 2]" 1
1742 1 85 ILE HB 1 86 LEU H . . 3.560 2.260 2.244 2.323 . 0 0 "[ . 1 . 2]" 1
1743 1 85 ILE HB 1 87 ASP H . . 4.780 4.680 4.612 4.765 . 0 0 "[ . 1 . 2]" 1
1744 1 85 ILE MD 1 85 ILE MG . . 3.230 2.324 2.102 2.524 . 0 0 "[ . 1 . 2]" 1
1745 1 85 ILE MD 1 86 LEU H . . 4.250 4.038 3.932 4.186 . 0 0 "[ . 1 . 2]" 1
1746 1 85 ILE HG13 1 86 LEU H . . 4.400 4.220 4.136 4.267 . 0 0 "[ . 1 . 2]" 1
1747 1 85 ILE MG 1 86 LEU H . . 3.200 3.137 3.075 3.193 . 0 0 "[ . 1 . 2]" 1
1748 1 85 ILE MG 1 86 LEU HA . . 4.430 3.374 3.228 3.466 . 0 0 "[ . 1 . 2]" 1
1749 1 85 ILE MG 1 86 LEU HB3 . . 4.370 4.088 4.021 4.165 . 0 0 "[ . 1 . 2]" 1
1750 1 85 ILE MG 1 88 ASN QB . . 4.950 3.705 3.626 3.845 . 0 0 "[ . 1 . 2]" 1
1751 1 85 ILE MG 1 89 VAL H . . 4.190 4.135 3.949 4.197 0.007 7 0 "[ . 1 . 2]" 1
1752 1 85 ILE MG 1 89 VAL QG . . 3.100 2.794 2.402 2.934 . 0 0 "[ . 1 . 2]" 1
1753 1 86 LEU H 1 86 LEU HB2 . . 3.690 3.557 3.536 3.581 . 0 0 "[ . 1 . 2]" 1
1754 1 86 LEU H 1 86 LEU HB3 . . 3.660 2.344 2.266 2.464 . 0 0 "[ . 1 . 2]" 1
1755 1 86 LEU H 1 86 LEU MD1 . . 4.090 3.950 3.800 4.048 . 0 0 "[ . 1 . 2]" 1
1756 1 86 LEU H 1 86 LEU MD2 . . 3.330 3.105 3.035 3.163 . 0 0 "[ . 1 . 2]" 1
1757 1 86 LEU H 1 86 LEU HG . . 3.030 2.604 2.346 2.780 . 0 0 "[ . 1 . 2]" 1
1758 1 86 LEU H 1 87 ASP H . . 3.330 2.678 2.623 2.730 . 0 0 "[ . 1 . 2]" 1
1759 1 86 LEU H 1 87 ASP HB2 . . 6.240 5.245 5.068 5.380 . 0 0 "[ . 1 . 2]" 1
1760 1 86 LEU H 1 87 ASP HB3 . . 5.060 4.760 4.629 5.057 . 0 0 "[ . 1 . 2]" 1
1761 1 86 LEU H 1 88 ASN H . . 4.310 4.115 4.082 4.161 . 0 0 "[ . 1 . 2]" 1
1762 1 86 LEU H 1 89 VAL H . . 5.380 4.996 4.858 5.140 . 0 0 "[ . 1 . 2]" 1
1763 1 86 LEU HA 1 86 LEU MD1 . . 3.570 3.477 3.395 3.554 . 0 0 "[ . 1 . 2]" 1
1764 1 86 LEU HA 1 86 LEU MD2 . . 4.180 4.097 4.073 4.107 . 0 0 "[ . 1 . 2]" 1
1765 1 86 LEU HA 1 88 ASN H . . 4.090 4.072 3.904 4.148 0.058 14 0 "[ . 1 . 2]" 1
1766 1 86 LEU HA 1 89 VAL H . . 3.660 3.468 3.453 3.502 . 0 0 "[ . 1 . 2]" 1
1767 1 86 LEU HA 1 89 VAL HB . . 4.830 4.800 4.705 4.843 0.013 9 0 "[ . 1 . 2]" 1
1768 1 86 LEU HA 1 89 VAL MG1 . . 4.140 3.430 3.102 3.572 . 0 0 "[ . 1 . 2]" 1
1769 1 86 LEU HA 1 89 VAL QG . . 3.590 1.917 1.891 1.928 . 0 0 "[ . 1 . 2]" 1
1770 1 86 LEU HA 1 89 VAL MG2 . . 4.140 1.927 1.900 1.940 . 0 0 "[ . 1 . 2]" 1
1771 1 86 LEU HA 1 90 GLN H . . 4.020 3.968 3.816 4.043 0.023 15 0 "[ . 1 . 2]" 1
1772 1 86 LEU HB2 1 87 ASP H . . 4.300 3.940 3.778 4.070 . 0 0 "[ . 1 . 2]" 1
1773 1 86 LEU HB2 1 87 ASP HA . . 5.900 4.746 4.585 4.873 . 0 0 "[ . 1 . 2]" 1
1774 1 86 LEU HB2 1 90 GLN HG3 . . 4.810 3.704 3.460 4.439 . 0 0 "[ . 1 . 2]" 1
1775 1 86 LEU HB3 1 86 LEU MD1 . . 3.130 3.121 3.103 3.128 . 0 0 "[ . 1 . 2]" 1
1776 1 86 LEU HB3 1 87 ASP H . . 4.030 3.819 3.787 3.857 . 0 0 "[ . 1 . 2]" 1
1777 1 86 LEU HB3 1 90 GLN HG2 . . 5.570 5.127 4.641 5.391 . 0 0 "[ . 1 . 2]" 1
1778 1 86 LEU HB3 1 90 GLN HG3 . . 6.120 5.388 5.164 6.130 0.010 13 0 "[ . 1 . 2]" 1
1779 1 86 LEU MD1 1 87 ASP H . . 3.920 2.864 2.594 3.156 . 0 0 "[ . 1 . 2]" 1
1780 1 86 LEU MD1 1 88 ASN H . . 5.310 4.578 4.420 4.745 . 0 0 "[ . 1 . 2]" 1
1781 1 86 LEU MD1 1 89 VAL H . . 5.380 5.171 5.087 5.346 . 0 0 "[ . 1 . 2]" 1
1782 1 86 LEU MD1 1 90 GLN H . . 4.290 4.196 4.054 4.301 0.011 13 0 "[ . 1 . 2]" 1
1783 1 86 LEU MD1 1 90 GLN HB2 . . 4.420 3.267 3.052 3.387 . 0 0 "[ . 1 . 2]" 1
1784 1 86 LEU MD1 1 90 GLN HG2 . . 4.240 3.063 2.593 3.408 . 0 0 "[ . 1 . 2]" 1
1785 1 86 LEU MD1 1 90 GLN HG3 . . 3.890 2.402 2.008 3.100 . 0 0 "[ . 1 . 2]" 1
1786 1 86 LEU MD1 1 103 VAL MG2 . . 3.800 3.795 3.652 3.812 0.012 17 0 "[ . 1 . 2]" 1
1787 1 86 LEU MD2 1 87 ASP H . . 3.940 3.745 3.691 3.791 . 0 0 "[ . 1 . 2]" 1
1788 1 86 LEU MD2 1 90 GLN HG2 . . 5.500 5.329 4.895 5.511 0.011 1 0 "[ . 1 . 2]" 1
1789 1 86 LEU MD2 1 103 VAL MG2 . . 4.800 3.164 2.740 3.792 . 0 0 "[ . 1 . 2]" 1
1790 1 86 LEU HG 1 87 ASP H . . 3.150 2.028 1.947 2.126 . 0 0 "[ . 1 . 2]" 1
1791 1 86 LEU HG 1 87 ASP HB3 . . 4.330 3.930 3.800 4.097 . 0 0 "[ . 1 . 2]" 1
1792 1 86 LEU HG 1 88 ASN H . . 4.630 4.550 4.506 4.590 . 0 0 "[ . 1 . 2]" 1
1793 1 86 LEU HG 1 90 GLN HG2 . . 6.010 5.362 4.924 5.650 . 0 0 "[ . 1 . 2]" 1
1794 1 86 LEU HG 1 90 GLN HG3 . . 6.380 5.092 4.671 5.756 . 0 0 "[ . 1 . 2]" 1
1795 1 87 ASP H 1 87 ASP HB2 . . 2.880 2.725 2.536 2.849 . 0 0 "[ . 1 . 2]" 1
1796 1 87 ASP H 1 87 ASP HB3 . . 3.000 2.365 2.279 2.557 . 0 0 "[ . 1 . 2]" 1
1797 1 87 ASP H 1 88 ASN H . . 3.260 2.595 2.507 2.711 . 0 0 "[ . 1 . 2]" 1
1798 1 87 ASP H 1 88 ASN HA . . 5.480 5.212 5.142 5.308 . 0 0 "[ . 1 . 2]" 1
1799 1 87 ASP H 1 88 ASN HD21 . . 4.450 4.170 3.852 4.437 . 0 0 "[ . 1 . 2]" 1
1800 1 87 ASP HA 1 89 VAL H . . 5.160 4.698 4.546 5.016 . 0 0 "[ . 1 . 2]" 1
1801 1 87 ASP HA 1 90 GLN H . . 3.870 3.562 3.463 3.733 . 0 0 "[ . 1 . 2]" 1
1802 1 87 ASP HA 1 90 GLN HB2 . . 3.950 2.510 2.407 2.643 . 0 0 "[ . 1 . 2]" 1
1803 1 87 ASP HA 1 90 GLN HB3 . . 4.380 4.050 3.969 4.204 . 0 0 "[ . 1 . 2]" 1
1804 1 87 ASP HA 1 90 GLN HG2 . . 4.560 4.184 3.965 4.423 . 0 0 "[ . 1 . 2]" 1
1805 1 87 ASP HA 1 90 GLN HG3 . . 5.280 3.807 3.482 4.300 . 0 0 "[ . 1 . 2]" 1
1806 1 87 ASP HA 1 91 VAL H . . 4.390 4.020 3.869 4.168 . 0 0 "[ . 1 . 2]" 1
1807 1 87 ASP HA 1 91 VAL HB . . 5.090 5.116 5.094 5.128 0.038 1 0 "[ . 1 . 2]" 1
1808 1 87 ASP HA 1 91 VAL QG . . 5.280 3.604 3.550 3.670 . 0 0 "[ . 1 . 2]" 1
1809 1 87 ASP HB2 1 88 ASN H . . 4.200 4.119 3.994 4.176 . 0 0 "[ . 1 . 2]" 1
1810 1 87 ASP HB3 1 88 ASN H . . 3.110 2.907 2.858 2.967 . 0 0 "[ . 1 . 2]" 1
1811 1 88 ASN H 1 88 ASN HB2 . . 3.570 2.188 2.138 2.251 . 0 0 "[ . 1 . 2]" 1
1812 1 88 ASN H 1 88 ASN QB . . 2.810 2.166 2.117 2.227 . 0 0 "[ . 1 . 2]" 1
1813 1 88 ASN H 1 88 ASN HB3 . . 3.570 3.489 3.430 3.536 . 0 0 "[ . 1 . 2]" 1
1814 1 88 ASN H 1 88 ASN HD21 . . 3.540 2.349 2.135 2.612 . 0 0 "[ . 1 . 2]" 1
1815 1 88 ASN H 1 88 ASN HD22 . . 4.300 4.016 3.810 4.283 . 0 0 "[ . 1 . 2]" 1
1816 1 88 ASN H 1 89 VAL H . . 3.290 2.604 2.497 2.700 . 0 0 "[ . 1 . 2]" 1
1817 1 88 ASN H 1 89 VAL MG1 . . 4.180 4.082 3.905 4.193 0.013 18 0 "[ . 1 . 2]" 1
1818 1 88 ASN H 1 89 VAL QG . . 3.630 3.460 3.399 3.492 . 0 0 "[ . 1 . 2]" 1
1819 1 88 ASN H 1 89 VAL MG2 . . 4.180 3.743 3.633 3.835 . 0 0 "[ . 1 . 2]" 1
1820 1 88 ASN H 1 90 GLN H . . 4.240 3.775 3.701 3.816 . 0 0 "[ . 1 . 2]" 1
1821 1 88 ASN H 1 91 VAL H . . 4.630 4.564 4.497 4.593 . 0 0 "[ . 1 . 2]" 1
1822 1 88 ASN H 1 91 VAL HB . . 5.470 5.063 4.958 5.121 . 0 0 "[ . 1 . 2]" 1
1823 1 88 ASN H 1 91 VAL QG . . 4.950 4.604 4.545 4.639 . 0 0 "[ . 1 . 2]" 1
1824 1 88 ASN HA 1 88 ASN HD21 . . 4.290 2.597 2.417 2.918 . 0 0 "[ . 1 . 2]" 1
1825 1 88 ASN HA 1 88 ASN HD22 . . 4.420 3.549 3.450 3.664 . 0 0 "[ . 1 . 2]" 1
1826 1 88 ASN HA 1 90 GLN H . . 4.490 4.274 4.192 4.312 . 0 0 "[ . 1 . 2]" 1
1827 1 88 ASN HA 1 91 VAL H . . 3.620 3.525 3.396 3.602 . 0 0 "[ . 1 . 2]" 1
1828 1 88 ASN HA 1 91 VAL HB . . 3.850 2.820 2.670 2.918 . 0 0 "[ . 1 . 2]" 1
1829 1 88 ASN HA 1 91 VAL MG1 . . 4.420 4.083 3.941 4.188 . 0 0 "[ . 1 . 2]" 1
1830 1 88 ASN HA 1 91 VAL QG . . 3.350 3.308 3.249 3.343 . 0 0 "[ . 1 . 2]" 1
1831 1 88 ASN HA 1 91 VAL MG2 . . 4.420 3.497 3.453 3.556 . 0 0 "[ . 1 . 2]" 1
1832 1 88 ASN HA 1 92 VAL H . . 4.390 3.951 3.827 4.000 . 0 0 "[ . 1 . 2]" 1
1833 1 88 ASN QB 1 88 ASN HD22 . . 3.580 3.423 3.365 3.438 . 0 0 "[ . 1 . 2]" 1
1834 1 88 ASN QB 1 89 VAL H . . 3.080 2.542 2.345 2.685 . 0 0 "[ . 1 . 2]" 1
1835 1 88 ASN QB 1 89 VAL QG . . 3.670 2.974 2.921 3.074 . 0 0 "[ . 1 . 2]" 1
1836 1 88 ASN QB 1 91 VAL H . . 5.450 4.827 4.674 4.918 . 0 0 "[ . 1 . 2]" 1
1837 1 88 ASN HB2 1 89 VAL H . . 3.520 2.689 2.455 2.894 . 0 0 "[ . 1 . 2]" 1
1838 1 88 ASN HB3 1 89 VAL H . . 3.520 3.141 2.814 3.350 . 0 0 "[ . 1 . 2]" 1
1839 1 88 ASN HD21 1 89 VAL H . . 4.860 4.496 4.324 4.678 . 0 0 "[ . 1 . 2]" 1
1840 1 88 ASN HD21 1 91 VAL QG . . 4.960 4.464 4.288 4.791 . 0 0 "[ . 1 . 2]" 1
1841 1 88 ASN HD22 1 91 VAL QG . . 5.200 5.049 4.973 5.173 . 0 0 "[ . 1 . 2]" 1
1842 1 89 VAL H 1 89 VAL HB . . 3.650 3.621 3.607 3.627 . 0 0 "[ . 1 . 2]" 1
1843 1 89 VAL H 1 89 VAL MG1 . . 3.160 2.123 1.921 2.271 . 0 0 "[ . 1 . 2]" 1
1844 1 89 VAL H 1 89 VAL MG2 . . 3.160 2.089 1.976 2.277 . 0 0 "[ . 1 . 2]" 1
1845 1 89 VAL H 1 90 GLN H . . 3.360 2.545 2.503 2.679 . 0 0 "[ . 1 . 2]" 1
1846 1 89 VAL H 1 90 GLN HB2 . . 4.960 4.615 4.525 4.771 . 0 0 "[ . 1 . 2]" 1
1847 1 89 VAL H 1 90 GLN HG2 . . 4.740 4.602 4.490 4.741 0.001 17 0 "[ . 1 . 2]" 1
1848 1 89 VAL H 1 91 VAL H . . 4.110 4.033 3.953 4.106 . 0 0 "[ . 1 . 2]" 1
1849 1 89 VAL HA 1 89 VAL MG1 . . 3.430 2.381 2.325 2.431 . 0 0 "[ . 1 . 2]" 1
1850 1 89 VAL HA 1 89 VAL MG2 . . 3.430 3.201 3.195 3.204 . 0 0 "[ . 1 . 2]" 1
1851 1 89 VAL HA 1 92 VAL H . . 3.700 3.667 3.640 3.703 0.003 8 0 "[ . 1 . 2]" 1
1852 1 89 VAL HA 1 92 VAL HB . . 4.120 3.919 3.871 3.956 . 0 0 "[ . 1 . 2]" 1
1853 1 89 VAL HA 1 92 VAL QG . . 3.690 1.906 1.892 1.915 . 0 0 "[ . 1 . 2]" 1
1854 1 89 VAL HA 1 93 LEU H . . 4.300 4.129 4.091 4.180 . 0 0 "[ . 1 . 2]" 1
1855 1 89 VAL HA 1 93 LEU MD2 . . 5.560 4.485 4.379 4.527 . 0 0 "[ . 1 . 2]" 1
1856 1 89 VAL HB 1 90 GLN H . . 4.030 3.923 3.870 3.983 . 0 0 "[ . 1 . 2]" 1
1857 1 89 VAL QG 1 90 GLN H . . 3.350 2.225 2.206 2.237 . 0 0 "[ . 1 . 2]" 1
1858 1 89 VAL QG 1 90 GLN HA . . 4.150 3.158 3.059 3.241 . 0 0 "[ . 1 . 2]" 1
1859 1 89 VAL QG 1 90 GLN HE21 . . 4.660 3.415 2.749 4.610 . 0 0 "[ . 1 . 2]" 1
1860 1 89 VAL QG 1 90 GLN HE22 . . 4.460 4.401 4.224 4.570 0.110 13 0 "[ . 1 . 2]" 1
1861 1 89 VAL QG 1 90 GLN HG2 . . 4.590 2.287 2.146 2.493 . 0 0 "[ . 1 . 2]" 1
1862 1 89 VAL QG 1 90 GLN HG3 . . 5.290 3.711 3.562 3.916 . 0 0 "[ . 1 . 2]" 1
1863 1 89 VAL QG 1 93 LEU MD2 . . 3.480 3.422 3.241 3.488 0.008 15 0 "[ . 1 . 2]" 1
1864 1 89 VAL QG 1 101 LEU QD . . 4.380 4.189 3.819 4.413 0.033 17 0 "[ . 1 . 2]" 1
1865 1 89 VAL MG1 1 90 GLN H . . 3.980 3.895 3.795 3.955 . 0 0 "[ . 1 . 2]" 1
1866 1 89 VAL MG2 1 90 GLN H . . 3.980 2.238 2.219 2.250 . 0 0 "[ . 1 . 2]" 1
1867 1 90 GLN H 1 90 GLN HB2 . . 3.210 2.313 2.271 2.349 . 0 0 "[ . 1 . 2]" 1
1868 1 90 GLN H 1 90 GLN HB3 . . 3.720 3.565 3.547 3.577 . 0 0 "[ . 1 . 2]" 1
1869 1 90 GLN H 1 90 GLN HE21 . . 4.850 4.204 3.931 4.813 . 0 0 "[ . 1 . 2]" 1
1870 1 90 GLN H 1 90 GLN HE22 . . 5.530 5.513 5.468 5.541 0.011 15 0 "[ . 1 . 2]" 1
1871 1 90 GLN H 1 90 GLN HG2 . . 3.260 2.686 2.602 2.785 . 0 0 "[ . 1 . 2]" 1
1872 1 90 GLN H 1 91 VAL H . . 3.260 2.442 2.413 2.469 . 0 0 "[ . 1 . 2]" 1
1873 1 90 GLN H 1 92 VAL H . . 4.430 4.203 4.157 4.236 . 0 0 "[ . 1 . 2]" 1
1874 1 90 GLN HA 1 90 GLN HE21 . . 4.320 2.236 2.066 2.655 . 0 0 "[ . 1 . 2]" 1
1875 1 90 GLN HA 1 90 GLN HE22 . . 4.460 3.215 2.972 3.383 . 0 0 "[ . 1 . 2]" 1
1876 1 90 GLN HA 1 90 GLN HG2 . . 4.200 2.819 2.687 3.100 . 0 0 "[ . 1 . 2]" 1
1877 1 90 GLN HA 1 92 VAL H . . 4.840 4.779 4.752 4.804 . 0 0 "[ . 1 . 2]" 1
1878 1 90 GLN HA 1 93 LEU H . . 4.660 3.895 3.842 3.932 . 0 0 "[ . 1 . 2]" 1
1879 1 90 GLN HA 1 93 LEU HB2 . . 5.460 5.162 5.063 5.234 . 0 0 "[ . 1 . 2]" 1
1880 1 90 GLN HA 1 93 LEU HB3 . . 4.330 3.969 3.847 4.122 . 0 0 "[ . 1 . 2]" 1
1881 1 90 GLN HA 1 93 LEU MD2 . . 3.550 1.925 1.898 1.937 . 0 0 "[ . 1 . 2]" 1
1882 1 90 GLN HA 1 93 LEU HG . . 4.990 3.026 2.935 3.087 . 0 0 "[ . 1 . 2]" 1
1883 1 90 GLN HA 1 94 GLN H . . 4.470 4.345 4.293 4.441 . 0 0 "[ . 1 . 2]" 1
1884 1 90 GLN HB2 1 90 GLN HE21 . . 4.070 3.934 3.553 4.108 0.038 3 0 "[ . 1 . 2]" 1
1885 1 90 GLN HB2 1 90 GLN HE22 . . 5.310 5.031 4.862 5.112 . 0 0 "[ . 1 . 2]" 1
1886 1 90 GLN HB2 1 91 VAL H . . 3.210 2.910 2.813 2.978 . 0 0 "[ . 1 . 2]" 1
1887 1 90 GLN HB2 1 91 VAL QG . . 4.970 3.561 3.469 3.661 . 0 0 "[ . 1 . 2]" 1
1888 1 90 GLN HB2 1 100 THR MG . . 4.280 3.932 3.454 4.282 0.002 9 0 "[ . 1 . 2]" 1
1889 1 90 GLN HB3 1 90 GLN HE21 . . 4.520 3.148 2.070 3.719 . 0 0 "[ . 1 . 2]" 1
1890 1 90 GLN HB3 1 91 VAL H . . 3.950 3.698 3.658 3.762 . 0 0 "[ . 1 . 2]" 1
1891 1 90 GLN HB3 1 94 GLN QE . . 5.120 5.100 5.039 5.121 0.001 8 0 "[ . 1 . 2]" 1
1892 1 90 GLN HB3 1 100 THR HB . . 4.310 2.709 2.468 3.218 . 0 0 "[ . 1 . 2]" 1
1893 1 90 GLN HB3 1 100 THR MG . . 4.760 2.596 2.117 2.996 . 0 0 "[ . 1 . 2]" 1
1894 1 90 GLN HE21 1 100 THR HB . . 4.480 3.752 2.159 4.483 0.003 11 0 "[ . 1 . 2]" 1
1895 1 90 GLN HE21 1 101 LEU H . . 4.100 3.042 1.898 3.689 . 0 0 "[ . 1 . 2]" 1
1896 1 90 GLN HE21 1 101 LEU QB . . 3.830 3.479 3.046 3.811 . 0 0 "[ . 1 . 2]" 1
1897 1 90 GLN HE21 1 101 LEU QD . . 3.910 3.008 2.537 3.797 . 0 0 "[ . 1 . 2]" 1
1898 1 90 GLN HE22 1 93 LEU MD2 . . 4.570 2.183 1.910 2.480 . 0 0 "[ . 1 . 2]" 1
1899 1 90 GLN HE22 1 100 THR HA . . 4.930 3.616 2.870 3.959 . 0 0 "[ . 1 . 2]" 1
1900 1 90 GLN HE22 1 100 THR HB . . 3.770 3.716 3.432 3.776 0.006 8 0 "[ . 1 . 2]" 1
1901 1 90 GLN HE22 1 100 THR MG . . 4.850 4.563 4.147 4.855 0.005 12 0 "[ . 1 . 2]" 1
1902 1 90 GLN HE22 1 101 LEU H . . 4.050 2.127 1.898 2.346 . 0 0 "[ . 1 . 2]" 1
1903 1 90 GLN HE22 1 101 LEU QB . . 3.950 2.210 1.943 2.606 . 0 0 "[ . 1 . 2]" 1
1904 1 90 GLN HE22 1 101 LEU MD1 . . 4.880 2.313 1.914 4.203 . 0 0 "[ . 1 . 2]" 1
1905 1 90 GLN HE22 1 101 LEU QD . . 3.990 2.097 1.907 2.459 . 0 0 "[ . 1 . 2]" 1
1906 1 90 GLN HE22 1 101 LEU MD2 . . 4.880 3.598 1.909 4.040 . 0 0 "[ . 1 . 2]" 1
1907 1 90 GLN HG2 1 91 VAL H . . 4.730 4.611 4.542 4.687 . 0 0 "[ . 1 . 2]" 1
1908 1 90 GLN HG2 1 93 LEU MD2 . . 4.640 3.837 3.659 4.199 . 0 0 "[ . 1 . 2]" 1
1909 1 90 GLN HG2 1 100 THR HB . . 5.640 4.878 4.571 5.434 . 0 0 "[ . 1 . 2]" 1
1910 1 90 GLN HG3 1 100 THR HB . . 5.580 3.982 3.673 4.203 . 0 0 "[ . 1 . 2]" 1
1911 1 91 VAL H 1 91 VAL HA . . 2.920 2.872 2.856 2.884 . 0 0 "[ . 1 . 2]" 1
1912 1 91 VAL H 1 91 VAL HB . . 2.910 2.314 2.275 2.335 . 0 0 "[ . 1 . 2]" 1
1913 1 91 VAL H 1 91 VAL MG1 . . 3.830 3.689 3.654 3.707 . 0 0 "[ . 1 . 2]" 1
1914 1 91 VAL H 1 91 VAL QG . . 2.800 2.609 2.535 2.705 . 0 0 "[ . 1 . 2]" 1
1915 1 91 VAL H 1 91 VAL MG2 . . 3.830 2.669 2.581 2.786 . 0 0 "[ . 1 . 2]" 1
1916 1 91 VAL H 1 92 VAL H . . 3.160 2.543 2.488 2.612 . 0 0 "[ . 1 . 2]" 1
1917 1 91 VAL H 1 92 VAL QG . . 4.030 3.373 3.337 3.429 . 0 0 "[ . 1 . 2]" 1
1918 1 91 VAL H 1 93 LEU H . . 4.460 4.068 4.039 4.103 . 0 0 "[ . 1 . 2]" 1
1919 1 91 VAL H 1 94 GLN H . . 4.730 4.501 4.459 4.534 . 0 0 "[ . 1 . 2]" 1
1920 1 91 VAL HA 1 91 VAL MG1 . . 3.440 2.510 2.476 2.569 . 0 0 "[ . 1 . 2]" 1
1921 1 91 VAL HA 1 91 VAL QG . . 2.840 2.101 2.069 2.130 . 0 0 "[ . 1 . 2]" 1
1922 1 91 VAL HA 1 91 VAL MG2 . . 3.440 2.255 2.192 2.305 . 0 0 "[ . 1 . 2]" 1
1923 1 91 VAL HA 1 94 GLN H . . 3.760 3.249 3.226 3.261 . 0 0 "[ . 1 . 2]" 1
1924 1 91 VAL HA 1 94 GLN QB . . 3.840 2.180 2.154 2.219 . 0 0 "[ . 1 . 2]" 1
1925 1 91 VAL HA 1 94 GLN QE . . 5.180 2.194 2.159 2.241 . 0 0 "[ . 1 . 2]" 1
1926 1 91 VAL HA 1 94 GLN HG2 . . 4.360 4.356 4.328 4.366 0.006 5 0 "[ . 1 . 2]" 1
1927 1 91 VAL HB 1 92 VAL H . . 3.390 2.562 2.518 2.617 . 0 0 "[ . 1 . 2]" 1
1928 1 91 VAL QG 1 92 VAL H . . 3.780 2.875 2.768 2.928 . 0 0 "[ . 1 . 2]" 1
1929 1 91 VAL QG 1 94 GLN H . . 4.660 4.038 4.017 4.058 . 0 0 "[ . 1 . 2]" 1
1930 1 91 VAL QG 1 94 GLN QB . . 4.060 3.101 3.065 3.141 . 0 0 "[ . 1 . 2]" 1
1931 1 91 VAL QG 1 94 GLN QE . . 3.900 2.421 2.345 2.511 . 0 0 "[ . 1 . 2]" 1
1932 1 91 VAL QG 1 95 GLN H . . 4.950 4.114 4.083 4.151 . 0 0 "[ . 1 . 2]" 1
1933 1 91 VAL QG 1 95 GLN QE . . 3.330 3.295 3.245 3.332 0.002 11 0 "[ . 1 . 2]" 1
1934 1 91 VAL QG 1 95 GLN HG2 . . 4.070 3.262 3.227 3.319 . 0 0 "[ . 1 . 2]" 1
1935 1 91 VAL QG 1 95 GLN HG3 . . 3.910 2.893 2.856 2.930 . 0 0 "[ . 1 . 2]" 1
1936 1 91 VAL MG1 1 94 GLN QB . . 4.810 3.320 3.265 3.410 . 0 0 "[ . 1 . 2]" 1
1937 1 91 VAL MG2 1 94 GLN QB . . 4.810 3.723 3.660 3.783 . 0 0 "[ . 1 . 2]" 1
1938 1 92 VAL H 1 92 VAL HB . . 2.950 2.598 2.586 2.606 . 0 0 "[ . 1 . 2]" 1
1939 1 92 VAL H 1 92 VAL QG . . 2.710 1.922 1.908 1.944 . 0 0 "[ . 1 . 2]" 1
1940 1 92 VAL H 1 93 LEU H . . 3.270 2.828 2.819 2.833 . 0 0 "[ . 1 . 2]" 1
1941 1 92 VAL H 1 93 LEU HA . . 5.520 5.409 5.404 5.412 . 0 0 "[ . 1 . 2]" 1
1942 1 92 VAL H 1 93 LEU HB3 . . 4.980 4.932 4.902 4.989 0.009 20 0 "[ . 1 . 2]" 1
1943 1 92 VAL H 1 93 LEU HG . . 5.300 5.060 4.929 5.146 . 0 0 "[ . 1 . 2]" 1
1944 1 92 VAL H 1 94 GLN H . . 4.300 3.943 3.920 3.966 . 0 0 "[ . 1 . 2]" 1
1945 1 92 VAL H 1 94 GLN QB . . 4.750 4.602 4.574 4.635 . 0 0 "[ . 1 . 2]" 1
1946 1 92 VAL H 1 95 GLN H . . 5.370 5.034 5.024 5.045 . 0 0 "[ . 1 . 2]" 1
1947 1 92 VAL HA 1 92 VAL MG1 . . 3.700 3.196 3.195 3.198 . 0 0 "[ . 1 . 2]" 1
1948 1 92 VAL HA 1 92 VAL QG . . 3.050 2.282 2.267 2.300 . 0 0 "[ . 1 . 2]" 1
1949 1 92 VAL HA 1 92 VAL MG2 . . 3.700 2.337 2.319 2.358 . 0 0 "[ . 1 . 2]" 1
1950 1 92 VAL HA 1 94 GLN H . . 4.620 4.223 4.209 4.243 . 0 0 "[ . 1 . 2]" 1
1951 1 92 VAL HA 1 95 GLN H . . 3.790 3.763 3.735 3.786 . 0 0 "[ . 1 . 2]" 1
1952 1 92 VAL HA 1 95 GLN HB2 . . 4.150 3.695 3.633 3.748 . 0 0 "[ . 1 . 2]" 1
1953 1 92 VAL HA 1 95 GLN QE . . 4.700 2.715 2.630 2.793 . 0 0 "[ . 1 . 2]" 1
1954 1 92 VAL HA 1 95 GLN HG2 . . 4.500 4.461 4.413 4.494 . 0 0 "[ . 1 . 2]" 1
1955 1 92 VAL HA 1 95 GLN HG3 . . 4.240 2.715 2.665 2.747 . 0 0 "[ . 1 . 2]" 1
1956 1 92 VAL HA 1 96 THR H . . 5.180 5.034 4.991 5.069 . 0 0 "[ . 1 . 2]" 1
1957 1 92 VAL HB 1 93 LEU H . . 4.250 3.911 3.903 3.923 . 0 0 "[ . 1 . 2]" 1
1958 1 92 VAL HB 1 95 GLN QE . . 4.850 4.495 4.386 4.584 . 0 0 "[ . 1 . 2]" 1
1959 1 92 VAL QG 1 93 LEU H . . 3.650 1.946 1.931 1.964 . 0 0 "[ . 1 . 2]" 1
1960 1 92 VAL QG 1 93 LEU HA . . 3.850 3.087 3.050 3.107 . 0 0 "[ . 1 . 2]" 1
1961 1 92 VAL QG 1 94 GLN H . . 4.800 3.788 3.769 3.813 . 0 0 "[ . 1 . 2]" 1
1962 1 92 VAL QG 1 95 GLN H . . 4.580 4.234 4.198 4.267 . 0 0 "[ . 1 . 2]" 1
1963 1 92 VAL QG 1 95 GLN QE . . 3.610 3.601 3.535 3.615 0.005 10 0 "[ . 1 . 2]" 1
1964 1 92 VAL QG 1 95 GLN HG2 . . 6.220 5.386 5.358 5.403 . 0 0 "[ . 1 . 2]" 1
1965 1 92 VAL QG 1 95 GLN HG3 . . 4.090 4.078 4.048 4.093 0.003 12 0 "[ . 1 . 2]" 1
1966 1 92 VAL QG 1 96 THR H . . 4.710 4.453 4.401 4.507 . 0 0 "[ . 1 . 2]" 1
1967 1 92 VAL QG 1 96 THR MG . . 4.430 3.803 3.772 3.832 . 0 0 "[ . 1 . 2]" 1
1968 1 92 VAL MG1 1 93 LEU H . . 4.190 1.957 1.943 1.977 . 0 0 "[ . 1 . 2]" 1
1969 1 92 VAL MG1 1 93 LEU HA . . 4.640 3.428 3.408 3.444 . 0 0 "[ . 1 . 2]" 1
1970 1 92 VAL MG1 1 94 GLN H . . 5.500 3.955 3.934 3.985 . 0 0 "[ . 1 . 2]" 1
1971 1 92 VAL MG2 1 93 LEU H . . 4.190 3.391 3.337 3.444 . 0 0 "[ . 1 . 2]" 1
1972 1 92 VAL MG2 1 93 LEU HA . . 4.640 3.505 3.417 3.577 . 0 0 "[ . 1 . 2]" 1
1973 1 92 VAL MG2 1 94 GLN H . . 5.500 4.843 4.827 4.874 . 0 0 "[ . 1 . 2]" 1
1974 1 93 LEU H 1 93 LEU HB2 . . 3.680 3.542 3.529 3.561 . 0 0 "[ . 1 . 2]" 1
1975 1 93 LEU H 1 93 LEU MD1 . . 4.380 4.089 4.029 4.124 . 0 0 "[ . 1 . 2]" 1
1976 1 93 LEU H 1 93 LEU MD2 . . 4.310 3.224 3.208 3.242 . 0 0 "[ . 1 . 2]" 1
1977 1 93 LEU H 1 93 LEU HG . . 3.200 2.860 2.747 2.931 . 0 0 "[ . 1 . 2]" 1
1978 1 93 LEU H 1 94 GLN H . . 3.320 2.462 2.457 2.467 . 0 0 "[ . 1 . 2]" 1
1979 1 93 LEU H 1 94 GLN QB . . 4.550 4.207 4.201 4.211 . 0 0 "[ . 1 . 2]" 1
1980 1 93 LEU H 1 95 GLN H . . 4.450 4.064 4.049 4.072 . 0 0 "[ . 1 . 2]" 1
1981 1 93 LEU HA 1 93 LEU MD1 . . 3.490 3.429 3.400 3.472 . 0 0 "[ . 1 . 2]" 1
1982 1 93 LEU HA 1 93 LEU MD2 . . 4.190 4.127 4.108 4.134 . 0 0 "[ . 1 . 2]" 1
1983 1 93 LEU HA 1 96 THR H . . 3.750 3.247 3.238 3.255 . 0 0 "[ . 1 . 2]" 1
1984 1 93 LEU HA 1 96 THR HB . . 4.280 3.870 3.865 3.881 . 0 0 "[ . 1 . 2]" 1
1985 1 93 LEU HA 1 96 THR MG . . 3.040 1.957 1.953 1.962 . 0 0 "[ . 1 . 2]" 1
1986 1 93 LEU HA 1 97 TYR QD . . 3.640 2.993 2.979 3.032 . 0 0 "[ . 1 . 2]" 1
1987 1 93 LEU HA 1 97 TYR QE . . 4.270 4.040 4.022 4.110 . 0 0 "[ . 1 . 2]" 1
1988 1 93 LEU HB2 1 93 LEU MD1 . . 3.360 2.069 2.034 2.088 . 0 0 "[ . 1 . 2]" 1
1989 1 93 LEU HB3 1 93 LEU MD2 . . 3.320 2.142 2.015 2.192 . 0 0 "[ . 1 . 2]" 1
1990 1 93 LEU HB3 1 94 GLN H . . 3.850 3.776 3.751 3.831 . 0 0 "[ . 1 . 2]" 1
1991 1 93 LEU MD1 1 94 GLN H . . 3.530 3.339 3.243 3.414 . 0 0 "[ . 1 . 2]" 1
1992 1 93 LEU MD1 1 94 GLN HA . . 3.660 2.599 2.517 2.670 . 0 0 "[ . 1 . 2]" 1
1993 1 93 LEU MD1 1 96 THR H . . 4.850 4.656 4.619 4.706 . 0 0 "[ . 1 . 2]" 1
1994 1 93 LEU MD1 1 97 TYR H . . 4.140 3.579 3.509 3.688 . 0 0 "[ . 1 . 2]" 1
1995 1 93 LEU MD1 1 97 TYR HB2 . . 4.700 2.204 2.107 2.357 . 0 0 "[ . 1 . 2]" 1
1996 1 93 LEU MD1 1 97 TYR HB3 . . 4.910 3.309 3.241 3.407 . 0 0 "[ . 1 . 2]" 1
1997 1 93 LEU MD1 1 97 TYR QD . . 3.220 2.040 1.993 2.118 . 0 0 "[ . 1 . 2]" 1
1998 1 93 LEU MD1 1 97 TYR QE . . 3.440 3.209 3.155 3.301 . 0 0 "[ . 1 . 2]" 1
1999 1 93 LEU MD1 1 98 GLY H . . 4.470 3.654 3.607 3.763 . 0 0 "[ . 1 . 2]" 1
2000 1 93 LEU MD1 1 100 THR HA . . 3.930 2.753 2.622 2.965 . 0 0 "[ . 1 . 2]" 1
2001 1 93 LEU MD1 1 101 LEU H . . 4.510 4.010 3.470 4.512 0.002 17 0 "[ . 1 . 2]" 1
2002 1 93 LEU MD2 1 94 GLN H . . 4.140 3.874 3.858 3.910 . 0 0 "[ . 1 . 2]" 1
2003 1 93 LEU MD2 1 97 TYR QD . . 4.250 4.107 4.077 4.197 . 0 0 "[ . 1 . 2]" 1
2004 1 93 LEU MD2 1 97 TYR QE . . 4.770 4.469 4.436 4.555 . 0 0 "[ . 1 . 2]" 1
2005 1 93 LEU MD2 1 100 THR HA . . 4.450 3.176 2.990 3.521 . 0 0 "[ . 1 . 2]" 1
2006 1 93 LEU MD2 1 100 THR HB . . 4.460 4.110 3.867 4.472 0.012 17 0 "[ . 1 . 2]" 1
2007 1 93 LEU MD2 1 101 LEU QB . . 4.060 3.848 2.892 4.063 0.003 3 0 "[ . 1 . 2]" 1
2008 1 93 LEU MD2 1 101 LEU QD . . 3.580 2.572 2.253 2.935 . 0 0 "[ . 1 . 2]" 1
2009 1 93 LEU MD2 1 101 LEU HG . . 4.330 2.956 2.528 4.308 . 0 0 "[ . 1 . 2]" 1
2010 1 93 LEU HG 1 94 GLN H . . 3.340 2.323 2.271 2.358 . 0 0 "[ . 1 . 2]" 1
2011 1 93 LEU HG 1 95 GLN H . . 4.690 4.642 4.621 4.666 . 0 0 "[ . 1 . 2]" 1
2012 1 93 LEU HG 1 96 THR H . . 5.620 5.516 5.489 5.567 . 0 0 "[ . 1 . 2]" 1
2013 1 93 LEU HG 1 97 TYR H . . 5.350 5.214 5.155 5.313 . 0 0 "[ . 1 . 2]" 1
2014 1 93 LEU HG 1 98 GLY H . . 5.720 5.385 5.281 5.537 . 0 0 "[ . 1 . 2]" 1
2015 1 93 LEU HG 1 100 THR HA . . 5.640 3.661 3.506 3.895 . 0 0 "[ . 1 . 2]" 1
2016 1 94 GLN H 1 94 GLN QB . . 3.040 2.212 2.210 2.215 . 0 0 "[ . 1 . 2]" 1
2017 1 94 GLN H 1 94 GLN HG2 . . 4.260 4.298 4.293 4.303 0.043 17 0 "[ . 1 . 2]" 1
2018 1 94 GLN H 1 95 GLN H . . 3.090 2.549 2.540 2.556 . 0 0 "[ . 1 . 2]" 1
2019 1 94 GLN H 1 95 GLN HG2 . . 4.870 4.826 4.779 4.869 . 0 0 "[ . 1 . 2]" 1
2020 1 94 GLN H 1 96 THR H . . 4.310 4.161 4.148 4.171 . 0 0 "[ . 1 . 2]" 1
2021 1 94 GLN H 1 100 THR HA . . 5.460 5.088 4.953 5.203 . 0 0 "[ . 1 . 2]" 1
2022 1 94 GLN H 1 100 THR MG . . 4.370 3.936 3.622 4.271 . 0 0 "[ . 1 . 2]" 1
2023 1 94 GLN HA 1 94 GLN HG2 . . 3.690 3.312 3.282 3.357 . 0 0 "[ . 1 . 2]" 1
2024 1 94 GLN HA 1 94 GLN HG3 . . 4.190 2.695 2.679 2.705 . 0 0 "[ . 1 . 2]" 1
2025 1 94 GLN HA 1 95 GLN H . . 3.530 3.452 3.451 3.453 . 0 0 "[ . 1 . 2]" 1
2026 1 94 GLN HA 1 97 TYR H . . 3.610 3.466 3.455 3.470 . 0 0 "[ . 1 . 2]" 1
2027 1 94 GLN HA 1 98 GLY H . . 3.420 2.378 2.353 2.426 . 0 0 "[ . 1 . 2]" 1
2028 1 94 GLN HA 1 99 SER H . . 4.330 2.986 2.877 3.224 . 0 0 "[ . 1 . 2]" 1
2029 1 94 GLN QB 1 95 GLN H . . 3.260 2.989 2.985 2.993 . 0 0 "[ . 1 . 2]" 1
2030 1 94 GLN QB 1 97 TYR H . . 5.080 5.069 5.063 5.071 . 0 0 "[ . 1 . 2]" 1
2031 1 94 GLN QB 1 98 GLY H . . 4.230 4.245 4.234 4.268 0.038 13 0 "[ . 1 . 2]" 1
2032 1 94 GLN QB 1 100 THR MG . . 4.070 1.920 1.873 2.045 . 0 0 "[ . 1 . 2]" 1
2033 1 94 GLN QE 1 94 GLN HG2 . . 3.140 2.650 2.625 2.676 . 0 0 "[ . 1 . 2]" 1
2034 1 94 GLN HE22 1 94 GLN HG2 . . 3.870 3.686 3.672 3.699 . 0 0 "[ . 1 . 2]" 1
2035 1 94 GLN HG2 1 98 GLY H . . 4.850 4.234 4.191 4.304 . 0 0 "[ . 1 . 2]" 1
2036 1 94 GLN HG2 1 100 THR MG . . 4.570 3.995 3.772 4.157 . 0 0 "[ . 1 . 2]" 1
2037 1 94 GLN HG3 1 98 GLY QA . . 4.320 3.498 3.457 3.576 . 0 0 "[ . 1 . 2]" 1
2038 1 95 GLN H 1 95 GLN HB2 . . 2.830 2.567 2.556 2.578 . 0 0 "[ . 1 . 2]" 1
2039 1 95 GLN H 1 95 GLN QE . . 4.650 4.293 4.267 4.319 . 0 0 "[ . 1 . 2]" 1
2040 1 95 GLN H 1 95 GLN HG2 . . 3.090 2.929 2.892 2.964 . 0 0 "[ . 1 . 2]" 1
2041 1 95 GLN H 1 95 GLN HG3 . . 3.170 2.448 2.433 2.473 . 0 0 "[ . 1 . 2]" 1
2042 1 95 GLN H 1 96 THR H . . 3.130 2.409 2.405 2.413 . 0 0 "[ . 1 . 2]" 1
2043 1 95 GLN H 1 96 THR HA . . 5.230 5.089 5.086 5.092 . 0 0 "[ . 1 . 2]" 1
2044 1 95 GLN H 1 96 THR HB . . 4.940 4.794 4.785 4.803 . 0 0 "[ . 1 . 2]" 1
2045 1 95 GLN H 1 96 THR MG . . 4.210 3.789 3.785 3.793 . 0 0 "[ . 1 . 2]" 1
2046 1 95 GLN H 1 97 TYR H . . 4.110 3.773 3.768 3.777 . 0 0 "[ . 1 . 2]" 1
2047 1 95 GLN HA 1 95 GLN HG2 . . 3.690 2.486 2.474 2.498 . 0 0 "[ . 1 . 2]" 1
2048 1 95 GLN HA 1 95 GLN HG3 . . 3.730 3.515 3.497 3.533 . 0 0 "[ . 1 . 2]" 1
2049 1 95 GLN HA 1 97 TYR H . . 4.850 4.495 4.476 4.501 . 0 0 "[ . 1 . 2]" 1
2050 1 95 GLN HB2 1 95 GLN QE . . 4.120 2.898 2.847 2.976 . 0 0 "[ . 1 . 2]" 1
2051 1 95 GLN HB2 1 95 GLN HE22 . . 4.850 4.152 4.118 4.200 . 0 0 "[ . 1 . 2]" 1
2052 1 95 GLN HB2 1 96 THR H . . 3.320 2.754 2.747 2.761 . 0 0 "[ . 1 . 2]" 1
2053 1 95 GLN HB2 1 96 THR HB . . 4.820 4.008 4.001 4.020 . 0 0 "[ . 1 . 2]" 1
2054 1 95 GLN HB2 1 96 THR MG . . 4.760 4.315 4.304 4.327 . 0 0 "[ . 1 . 2]" 1
2055 1 95 GLN HB2 1 97 TYR H . . 4.940 4.948 4.941 4.956 0.016 10 0 "[ . 1 . 2]" 1
2056 1 95 GLN HB3 1 95 GLN QE . . 4.490 3.289 3.256 3.341 . 0 0 "[ . 1 . 2]" 1
2057 1 95 GLN HB3 1 96 THR H . . 4.180 3.876 3.864 3.888 . 0 0 "[ . 1 . 2]" 1
2058 1 95 GLN HB3 1 96 THR HB . . 5.330 5.151 5.135 5.170 . 0 0 "[ . 1 . 2]" 1
2059 1 95 GLN QE 1 95 GLN HG2 . . 3.420 3.291 3.275 3.300 . 0 0 "[ . 1 . 2]" 1
2060 1 95 GLN HE21 1 95 GLN HG3 . . 3.670 2.260 2.229 2.279 . 0 0 "[ . 1 . 2]" 1
2061 1 95 GLN HE22 1 95 GLN HG3 . . 3.670 3.493 3.480 3.500 . 0 0 "[ . 1 . 2]" 1
2062 1 95 GLN HG2 1 96 THR H . . 4.940 4.687 4.665 4.707 . 0 0 "[ . 1 . 2]" 1
2063 1 95 GLN HG3 1 96 THR H . . 4.260 4.216 4.198 4.238 . 0 0 "[ . 1 . 2]" 1
2064 1 96 THR H 1 96 THR HA . . 2.930 2.901 2.900 2.902 . 0 0 "[ . 1 . 2]" 1
2065 1 96 THR H 1 96 THR HB . . 2.950 2.623 2.620 2.625 . 0 0 "[ . 1 . 2]" 1
2066 1 96 THR H 1 96 THR MG . . 3.180 2.134 2.130 2.138 . 0 0 "[ . 1 . 2]" 1
2067 1 96 THR H 1 97 TYR H . . 2.960 2.313 2.310 2.316 . 0 0 "[ . 1 . 2]" 1
2068 1 96 THR H 1 97 TYR HA . . 5.040 5.015 5.013 5.018 . 0 0 "[ . 1 . 2]" 1
2069 1 96 THR H 1 97 TYR HB2 . . 4.460 4.402 4.386 4.412 . 0 0 "[ . 1 . 2]" 1
2070 1 96 THR H 1 97 TYR QD . . 4.400 4.266 4.252 4.287 . 0 0 "[ . 1 . 2]" 1
2071 1 96 THR HA 1 96 THR MG . . 3.230 3.200 3.199 3.200 . 0 0 "[ . 1 . 2]" 1
2072 1 96 THR HB 1 97 TYR H . . 3.910 3.918 3.912 3.927 0.017 13 0 "[ . 1 . 2]" 1
2073 1 96 THR HB 1 97 TYR QD . . 4.860 4.903 4.883 4.914 0.054 10 0 "[ . 1 . 2]" 1
2074 1 96 THR HB 1 97 TYR QE . . 5.570 5.619 5.605 5.653 0.083 13 0 "[ . 1 . 2]" 1
2075 1 96 THR MG 1 97 TYR H . . 3.420 2.207 2.199 2.217 . 0 0 "[ . 1 . 2]" 1
2076 1 96 THR MG 1 97 TYR HA . . 4.570 3.259 3.255 3.264 . 0 0 "[ . 1 . 2]" 1
2077 1 96 THR MG 1 97 TYR QD . . 3.400 2.233 2.201 2.248 . 0 0 "[ . 1 . 2]" 1
2078 1 96 THR MG 1 97 TYR QE . . 3.270 2.905 2.897 2.922 . 0 0 "[ . 1 . 2]" 1
2079 1 96 THR MG 1 98 GLY H . . 4.240 4.148 4.134 4.162 . 0 0 "[ . 1 . 2]" 1
2080 1 97 TYR H 1 97 TYR HB2 . . 3.240 2.334 2.319 2.343 . 0 0 "[ . 1 . 2]" 1
2081 1 97 TYR H 1 97 TYR HB3 . . 3.710 3.591 3.581 3.598 . 0 0 "[ . 1 . 2]" 1
2082 1 97 TYR H 1 97 TYR QD . . 3.350 3.011 2.998 3.028 . 0 0 "[ . 1 . 2]" 1
2083 1 97 TYR H 1 97 TYR QE . . 5.220 4.992 4.985 5.015 . 0 0 "[ . 1 . 2]" 1
2084 1 97 TYR H 1 98 GLY H . . 2.960 2.378 2.375 2.380 . 0 0 "[ . 1 . 2]" 1
2085 1 97 TYR H 1 98 GLY QA . . 4.450 4.147 4.140 4.156 . 0 0 "[ . 1 . 2]" 1
2086 1 97 TYR HA 1 97 TYR QD . . 3.230 2.679 2.658 2.713 . 0 0 "[ . 1 . 2]" 1
2087 1 97 TYR HA 1 97 TYR QE . . 4.550 4.463 4.460 4.467 . 0 0 "[ . 1 . 2]" 1
2088 1 97 TYR HB2 1 98 GLY H . . 3.850 2.460 2.449 2.482 . 0 0 "[ . 1 . 2]" 1
2089 1 97 TYR HB2 1 99 SER H . . 4.720 2.953 2.917 3.123 . 0 0 "[ . 1 . 2]" 1
2090 1 97 TYR HB3 1 98 GLY H . . 4.010 3.193 3.177 3.200 . 0 0 "[ . 1 . 2]" 1
2091 1 97 TYR QD 1 98 GLY H . . 4.290 4.258 4.248 4.283 . 0 0 "[ . 1 . 2]" 1
2092 1 98 GLY H 1 99 SER H . . 3.810 2.323 2.274 2.474 . 0 0 "[ . 1 . 2]" 1
2093 1 99 SER HA 1 100 THR H . . 3.040 2.670 2.619 2.715 . 0 0 "[ . 1 . 2]" 1
2094 1 99 SER HA 1 100 THR MG . . 4.590 3.299 3.110 3.618 . 0 0 "[ . 1 . 2]" 1
2095 1 99 SER QB 1 100 THR H . . 3.310 2.223 1.936 2.815 . 0 0 "[ . 1 . 2]" 1
2096 1 99 SER HB2 1 100 THR H . . 3.830 2.972 1.971 3.669 . 0 0 "[ . 1 . 2]" 1
2097 1 99 SER HB3 1 100 THR H . . 3.830 2.580 1.954 3.632 . 0 0 "[ . 1 . 2]" 1
2098 1 100 THR H 1 100 THR HB . . 3.960 3.860 3.748 3.907 . 0 0 "[ . 1 . 2]" 1
2099 1 100 THR H 1 100 THR MG . . 3.590 2.922 2.702 3.264 . 0 0 "[ . 1 . 2]" 1
2100 1 100 THR H 1 101 LEU H . . 4.650 4.431 4.389 4.494 . 0 0 "[ . 1 . 2]" 1
2101 1 100 THR HA 1 100 THR HB . . 2.850 2.437 2.381 2.534 . 0 0 "[ . 1 . 2]" 1
2102 1 100 THR HA 1 100 THR MG . . 3.080 2.375 2.156 2.467 . 0 0 "[ . 1 . 2]" 1
2103 1 100 THR HB 1 101 LEU H . . 3.680 2.234 1.981 2.660 . 0 0 "[ . 1 . 2]" 1
2104 1 100 THR MG 1 101 LEU H . . 3.980 3.676 3.447 3.937 . 0 0 "[ . 1 . 2]" 1
2105 1 101 LEU H 1 101 LEU QB . . 3.380 2.429 2.154 2.568 . 0 0 "[ . 1 . 2]" 1
2106 1 101 LEU H 1 101 LEU MD1 . . 4.790 3.630 3.320 4.105 . 0 0 "[ . 1 . 2]" 1
2107 1 101 LEU H 1 101 LEU QD . . 4.100 3.232 2.662 3.497 . 0 0 "[ . 1 . 2]" 1
2108 1 101 LEU H 1 101 LEU MD2 . . 4.790 3.700 2.697 4.099 . 0 0 "[ . 1 . 2]" 1
2109 1 101 LEU H 1 101 LEU HG . . 4.350 2.677 2.249 4.349 . 0 0 "[ . 1 . 2]" 1
2110 1 101 LEU H 1 102 LYS H . . 4.800 4.575 4.494 4.627 . 0 0 "[ . 1 . 2]" 1
2111 1 101 LEU HA 1 101 LEU MD1 . . 4.280 3.789 2.040 3.974 . 0 0 "[ . 1 . 2]" 1
2112 1 101 LEU HA 1 101 LEU QD . . 3.020 2.248 1.941 3.127 0.107 13 0 "[ . 1 . 2]" 1
2113 1 101 LEU HA 1 101 LEU MD2 . . 4.280 2.335 1.985 4.130 . 0 0 "[ . 1 . 2]" 1
2114 1 101 LEU HA 1 101 LEU HG . . 3.560 3.048 2.799 3.656 0.096 13 0 "[ . 1 . 2]" 1
2115 1 101 LEU HA 1 102 LYS H . . 2.690 2.333 2.232 2.340 . 0 0 "[ . 1 . 2]" 1
2116 1 101 LEU QB 1 101 LEU QD . . 2.790 1.890 1.830 2.056 . 0 0 "[ . 1 . 2]" 1
2117 1 101 LEU QB 1 102 LYS H . . 3.250 2.560 2.519 3.009 . 0 0 "[ . 1 . 2]" 1
2118 1 101 LEU QD 1 102 LYS H . . 3.480 3.130 2.095 3.485 0.005 8 0 "[ . 1 . 2]" 1
2119 1 101 LEU HG 1 102 LYS H . . 4.960 4.777 4.031 4.922 . 0 0 "[ . 1 . 2]" 1
2120 1 102 LYS H 1 102 LYS HB2 . . 3.680 2.683 2.357 2.886 . 0 0 "[ . 1 . 2]" 1
2121 1 102 LYS H 1 102 LYS HB3 . . 3.410 2.542 2.354 2.898 . 0 0 "[ . 1 . 2]" 1
2122 1 102 LYS H 1 102 LYS QG . . 4.430 4.040 3.932 4.109 . 0 0 "[ . 1 . 2]" 1
2123 1 102 LYS H 1 103 VAL H . . 4.590 4.487 4.282 4.593 0.003 8 0 "[ . 1 . 2]" 1
2124 1 102 LYS HA 1 102 LYS QD . . 3.730 2.274 1.953 3.744 0.014 8 0 "[ . 1 . 2]" 1
2125 1 102 LYS HA 1 102 LYS QG . . 3.350 2.846 2.284 3.152 . 0 0 "[ . 1 . 2]" 1
2126 1 102 LYS HA 1 103 VAL H . . 2.460 2.175 2.141 2.266 . 0 0 "[ . 1 . 2]" 1
2127 1 102 LYS HA 1 103 VAL QG . . 4.220 3.651 3.611 3.772 . 0 0 "[ . 1 . 2]" 1
2128 1 102 LYS HB2 1 103 VAL H . . 4.580 4.239 3.895 4.538 . 0 0 "[ . 1 . 2]" 1
2129 1 102 LYS HB2 1 103 VAL HB . . 7.000 6.780 6.622 6.881 . 0 0 "[ . 1 . 2]" 1
2130 1 102 LYS HB3 1 103 VAL H . . 4.270 4.118 3.945 4.412 0.142 14 0 "[ . 1 . 2]" 1
2131 1 102 LYS HB3 1 104 THR H . . 4.260 4.261 3.571 4.378 0.118 14 0 "[ . 1 . 2]" 1
2132 1 102 LYS QD 1 103 VAL H . . 4.210 2.575 1.894 4.227 0.017 3 0 "[ . 1 . 2]" 1
2133 1 102 LYS QD 1 104 THR H . . 4.730 4.324 1.845 4.757 0.027 20 0 "[ . 1 . 2]" 1
2134 1 102 LYS QE 1 102 LYS QG . . 3.410 2.262 2.084 2.895 . 0 0 "[ . 1 . 2]" 1
2135 1 102 LYS QE 1 103 VAL HA . . 6.500 5.308 3.717 5.783 . 0 0 "[ . 1 . 2]" 1
2136 1 102 LYS QE 1 103 VAL QG . . 4.500 3.853 3.068 4.652 0.152 18 0 "[ . 1 . 2]" 1
2137 1 102 LYS QE 1 104 THR H . . 4.480 4.365 2.694 4.630 0.150 14 0 "[ . 1 . 2]" 1
2138 1 102 LYS QG 1 103 VAL H . . 3.900 2.971 2.046 3.821 . 0 0 "[ . 1 . 2]" 1
2139 1 102 LYS QG 1 104 THR H . . 3.750 3.097 2.345 4.061 0.311 15 0 "[ . 1 . 2]" 1
2140 1 103 VAL H 1 103 VAL HB . . 3.130 3.053 2.964 3.105 . 0 0 "[ . 1 . 2]" 1
2141 1 103 VAL H 1 103 VAL MG1 . . 3.970 2.008 1.923 2.135 . 0 0 "[ . 1 . 2]" 1
2142 1 103 VAL H 1 103 VAL QG . . 2.870 2.001 1.918 2.124 . 0 0 "[ . 1 . 2]" 1
2143 1 103 VAL H 1 103 VAL MG2 . . 3.970 3.811 3.792 3.852 . 0 0 "[ . 1 . 2]" 1
2144 1 103 VAL H 1 104 THR H . . 3.780 3.693 3.347 3.798 0.018 13 0 "[ . 1 . 2]" 1
2145 1 103 VAL H 1 104 THR MG . . 4.360 4.300 4.128 4.399 0.039 18 0 "[ . 1 . 2]" 1
2146 1 103 VAL HA 1 103 VAL MG1 . . 3.280 3.185 3.182 3.188 . 0 0 "[ . 1 . 2]" 1
2147 1 103 VAL HA 1 103 VAL QG . . 2.800 2.276 2.216 2.298 . 0 0 "[ . 1 . 2]" 1
2148 1 103 VAL HA 1 103 VAL MG2 . . 3.280 2.332 2.260 2.357 . 0 0 "[ . 1 . 2]" 1
2149 1 103 VAL HA 1 104 THR H . . 2.610 2.375 2.322 2.547 . 0 0 "[ . 1 . 2]" 1
2150 1 103 VAL QG 1 104 THR H . . 3.610 3.385 3.317 3.469 . 0 0 "[ . 1 . 2]" 1
2151 1 103 VAL QG 1 104 THR HA . . 3.870 3.702 3.510 3.868 . 0 0 "[ . 1 . 2]" 1
2152 1 103 VAL MG1 1 104 THR H . . 4.280 4.096 3.916 4.145 . 0 0 "[ . 1 . 2]" 1
2153 1 103 VAL MG1 1 104 THR HA . . 4.710 4.191 3.920 4.278 . 0 0 "[ . 1 . 2]" 1
2154 1 103 VAL MG2 1 104 THR H . . 4.280 3.616 3.490 3.872 . 0 0 "[ . 1 . 2]" 1
2155 1 103 VAL MG2 1 104 THR HA . . 4.710 4.140 3.751 4.444 . 0 0 "[ . 1 . 2]" 1
2156 1 104 THR H 1 104 THR HB . . 3.630 3.440 2.909 3.632 0.002 10 0 "[ . 1 . 2]" 1
2157 1 104 THR H 1 104 THR MG . . 3.310 2.282 1.897 2.879 . 0 0 "[ . 1 . 2]" 1
2158 1 104 THR HA 1 104 THR HB . . 2.850 2.464 2.383 2.680 . 0 0 "[ . 1 . 2]" 1
2159 1 104 THR HA 1 104 THR MG . . 3.290 2.605 2.119 3.203 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, May 29, 2024 8:55:44 AM GMT (wattos1)