NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
435910 |
2jzt   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2jzt
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 1523
_Distance_constraint_stats_list.Viol_count 1350
_Distance_constraint_stats_list.Viol_total 1849.762
_Distance_constraint_stats_list.Viol_max 0.664
_Distance_constraint_stats_list.Viol_rms 0.0212
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0030
_Distance_constraint_stats_list.Viol_average_violations_only 0.0685
_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 11 TRP 2.517 0.135 5 0 "[ . 1 . 2]"
1 12 GLN 2.798 0.156 19 0 "[ . 1 . 2]"
1 13 ARG 0.287 0.123 13 0 "[ . 1 . 2]"
1 14 LEU 0.095 0.047 9 0 "[ . 1 . 2]"
1 15 LEU 0.414 0.037 3 0 "[ . 1 . 2]"
1 16 THR 0.119 0.108 19 0 "[ . 1 . 2]"
1 17 ARG 0.815 0.117 10 0 "[ . 1 . 2]"
1 19 TRP 4.315 0.161 13 0 "[ . 1 . 2]"
1 20 GLN 3.321 0.230 4 0 "[ . 1 . 2]"
1 21 PRO 0.169 0.033 17 0 "[ . 1 . 2]"
1 22 VAL 0.317 0.289 11 0 "[ . 1 . 2]"
1 23 GLU 1.713 0.289 11 0 "[ . 1 . 2]"
1 24 ALA 0.333 0.123 11 0 "[ . 1 . 2]"
1 25 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 THR 0.428 0.066 7 0 "[ . 1 . 2]"
1 27 VAL 1.493 0.140 2 0 "[ . 1 . 2]"
1 28 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 ASP 1.289 0.165 2 0 "[ . 1 . 2]"
1 30 TRP 0.727 0.083 1 0 "[ . 1 . 2]"
1 31 ILE 0.179 0.075 1 0 "[ . 1 . 2]"
1 32 LYS 5.580 0.588 8 1 "[ . + 1 . 2]"
1 33 ARG 6.931 0.588 8 1 "[ . + 1 . 2]"
1 34 VAL 3.279 0.235 17 0 "[ . 1 . 2]"
1 35 GLY 4.220 0.146 19 0 "[ . 1 . 2]"
1 36 ASP 6.459 0.277 5 0 "[ . 1 . 2]"
1 37 GLY 0.080 0.037 18 0 "[ . 1 . 2]"
1 38 VAL 0.229 0.051 7 0 "[ . 1 . 2]"
1 39 ILE 0.835 0.140 2 0 "[ . 1 . 2]"
1 40 LEU 1.665 0.153 20 0 "[ . 1 . 2]"
1 41 LEU 1.873 0.178 13 0 "[ . 1 . 2]"
1 42 SER 1.890 0.253 3 0 "[ . 1 . 2]"
1 55 PRO 0.502 0.082 13 0 "[ . 1 . 2]"
1 56 VAL 5.498 0.664 10 8 "[* - .* * + *. ** 2]"
1 57 MET 5.539 0.664 10 8 "[* - .* * + *. ** 2]"
1 58 ILE 2.082 0.186 6 0 "[ . 1 . 2]"
1 59 ALA 0.589 0.071 4 0 "[ . 1 . 2]"
1 60 GLU 4.448 0.239 11 0 "[ . 1 . 2]"
1 61 LEU 3.050 0.231 19 0 "[ . 1 . 2]"
1 62 LEU 3.521 0.231 19 0 "[ . 1 . 2]"
1 63 ARG 0.507 0.139 10 0 "[ . 1 . 2]"
1 64 GLU 2.826 0.222 12 0 "[ . 1 . 2]"
1 65 PHE 2.184 0.129 13 0 "[ . 1 . 2]"
1 66 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 PHE 2.078 0.174 19 0 "[ . 1 . 2]"
1 69 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 TRP 3.746 0.277 5 0 "[ . 1 . 2]"
1 71 GLN 3.395 0.210 7 0 "[ . 1 . 2]"
1 72 VAL 0.249 0.046 8 0 "[ . 1 . 2]"
1 73 ALA 1.070 0.121 20 0 "[ . 1 . 2]"
1 74 VAL 0.366 0.052 9 0 "[ . 1 . 2]"
1 75 ALA 0.157 0.072 4 0 "[ . 1 . 2]"
1 76 ASP 0.076 0.033 5 0 "[ . 1 . 2]"
1 77 LEU 0.292 0.066 20 0 "[ . 1 . 2]"
1 78 GLU 1.522 0.242 12 0 "[ . 1 . 2]"
1 79 GLN 1.436 0.136 14 0 "[ . 1 . 2]"
1 80 SER 2.982 0.253 3 0 "[ . 1 . 2]"
1 81 GLU 0.536 0.033 6 0 "[ . 1 . 2]"
1 82 ALA 0.035 0.032 16 0 "[ . 1 . 2]"
1 83 ILE 1.039 0.183 3 0 "[ . 1 . 2]"
1 84 GLY 0.235 0.074 14 0 "[ . 1 . 2]"
1 85 ASP 1.885 0.072 11 0 "[ . 1 . 2]"
1 86 ARG 0.675 0.149 8 0 "[ . 1 . 2]"
1 87 PHE 2.118 0.264 11 0 "[ . 1 . 2]"
1 88 ASN 1.870 0.253 20 0 "[ . 1 . 2]"
1 89 VAL 0.931 0.100 11 0 "[ . 1 . 2]"
1 93 PRO 0.598 0.105 5 0 "[ . 1 . 2]"
1 94 ALA 4.277 0.178 13 0 "[ . 1 . 2]"
1 95 THR 0.493 0.112 3 0 "[ . 1 . 2]"
1 96 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 VAL 0.054 0.019 4 0 "[ . 1 . 2]"
1 98 PHE 0.112 0.066 8 0 "[ . 1 . 2]"
1 99 THR 1.636 0.192 4 0 "[ . 1 . 2]"
1 100 ASP 5.276 0.300 7 0 "[ . 1 . 2]"
1 101 GLY 2.489 0.129 20 0 "[ . 1 . 2]"
1 102 LYS 3.973 0.300 7 0 "[ . 1 . 2]"
1 103 LEU 0.339 0.264 11 0 "[ . 1 . 2]"
1 104 ARG 0.550 0.162 13 0 "[ . 1 . 2]"
1 105 GLY 0.242 0.096 2 0 "[ . 1 . 2]"
1 106 ALA 0.047 0.023 18 0 "[ . 1 . 2]"
1 107 LEU 3.489 0.155 17 0 "[ . 1 . 2]"
1 110 ILE 0.012 0.012 12 0 "[ . 1 . 2]"
1 113 TRP 4.261 0.200 7 0 "[ . 1 . 2]"
1 114 ALA 1.461 0.200 7 0 "[ . 1 . 2]"
1 115 GLU 1.793 0.186 20 0 "[ . 1 . 2]"
1 116 LEU 3.227 0.175 14 0 "[ . 1 . 2]"
1 117 LEU 0.994 0.122 6 0 "[ . 1 . 2]"
1 118 THR 0.070 0.034 18 0 "[ . 1 . 2]"
1 119 LEU 0.341 0.067 8 0 "[ . 1 . 2]"
1 120 MET 2.291 0.175 14 0 "[ . 1 . 2]"
1 121 ARG 4.390 0.248 19 0 "[ . 1 . 2]"
1 122 SER 2.853 0.370 13 0 "[ . 1 . 2]"
1 123 ILE 0.268 0.162 13 0 "[ . 1 . 2]"
1 124 VAL 0.303 0.086 4 0 "[ . 1 . 2]"
1 125 ASP 0.027 0.027 2 0 "[ . 1 . 2]"
1 126 THR 0.073 0.030 10 0 "[ . 1 . 2]"
1 127 PRO 0.073 0.030 10 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 11 TRP H 1 11 TRP HB2 2.730 . 3.670 2.767 2.572 2.947 . 0 0 "[ . 1 . 2]" 1
2 1 11 TRP H 1 11 TRP HB3 2.730 . 3.670 2.315 2.213 2.444 . 0 0 "[ . 1 . 2]" 1
3 1 11 TRP H 1 12 GLN H 2.840 . 3.890 2.575 2.353 2.919 . 0 0 "[ . 1 . 2]" 1
4 1 11 TRP HA 1 11 TRP HE3 3.320 . 4.850 2.612 2.227 3.247 . 0 0 "[ . 1 . 2]" 1
5 1 11 TRP HA 1 11 TRP HZ3 3.650 . 5.500 4.865 4.502 5.408 . 0 0 "[ . 1 . 2]" 1
6 1 11 TRP HA 1 14 LEU MD2 3.310 . 4.820 3.356 2.163 4.812 . 0 0 "[ . 1 . 2]" 1
7 1 11 TRP QB 1 11 TRP HZ3 3.860 . 5.920 4.966 4.770 5.082 . 0 0 "[ . 1 . 2]" 1
8 1 11 TRP HB2 1 12 GLN H 2.810 . 3.830 3.841 3.715 3.899 0.069 14 0 "[ . 1 . 2]" 1
9 1 11 TRP HB3 1 12 GLN H 2.810 . 3.830 2.442 2.254 2.546 . 0 0 "[ . 1 . 2]" 1
10 1 11 TRP HD1 1 12 GLN H 3.650 . 5.500 3.395 3.132 3.578 . 0 0 "[ . 1 . 2]" 1
11 1 11 TRP HD1 1 12 GLN QB 4.090 . 6.380 3.858 3.354 4.775 . 0 0 "[ . 1 . 2]" 1
12 1 11 TRP HD1 1 15 LEU MD1 4.160 . 6.530 3.093 2.416 3.508 . 0 0 "[ . 1 . 2]" 1
13 1 11 TRP HE1 1 12 GLN H 3.650 . 5.500 5.584 5.531 5.635 0.135 5 0 "[ . 1 . 2]" 1
14 1 11 TRP HE1 1 15 LEU MD1 2.810 . 3.830 2.153 1.858 2.552 . 0 0 "[ . 1 . 2]" 1
15 1 11 TRP HE1 1 15 LEU MD2 2.830 . 3.860 3.337 2.118 3.876 0.016 14 0 "[ . 1 . 2]" 1
16 1 11 TRP HE1 1 21 PRO QB 4.090 . 6.380 4.055 2.729 5.586 . 0 0 "[ . 1 . 2]" 1
17 1 11 TRP HE3 1 14 LEU MD2 3.900 . 6.000 4.276 2.761 5.768 . 0 0 "[ . 1 . 2]" 1
18 1 11 TRP HH2 1 21 PRO HA 3.650 . 5.500 3.713 2.257 4.812 . 0 0 "[ . 1 . 2]" 1
19 1 11 TRP HH2 1 21 PRO HB2 3.650 . 5.500 4.741 3.425 5.533 0.033 17 0 "[ . 1 . 2]" 1
20 1 11 TRP HH2 1 21 PRO HB3 3.650 . 5.500 3.505 2.225 4.558 . 0 0 "[ . 1 . 2]" 1
21 1 11 TRP HH2 1 21 PRO QG 4.090 . 6.380 5.054 3.690 6.277 . 0 0 "[ . 1 . 2]" 1
22 1 11 TRP HH2 1 74 VAL MG1 3.310 . 4.820 4.345 3.554 4.872 0.052 9 0 "[ . 1 . 2]" 1
23 1 11 TRP HH2 1 74 VAL MG2 3.850 . 5.910 2.595 1.967 4.579 . 0 0 "[ . 1 . 2]" 1
24 1 11 TRP HH2 1 75 ALA HA 3.650 . 5.500 4.076 2.537 5.483 . 0 0 "[ . 1 . 2]" 1
25 1 11 TRP HH2 1 76 ASP H 3.650 . 5.500 3.724 2.277 4.724 . 0 0 "[ . 1 . 2]" 1
26 1 11 TRP HH2 1 76 ASP HA 3.650 . 5.500 3.187 1.866 4.557 . 0 0 "[ . 1 . 2]" 1
27 1 11 TRP HZ2 1 15 LEU MD1 3.630 . 5.470 3.536 2.729 4.828 . 0 0 "[ . 1 . 2]" 1
28 1 11 TRP HZ2 1 21 PRO HA 3.650 . 5.500 3.880 2.454 5.390 . 0 0 "[ . 1 . 2]" 1
29 1 11 TRP HZ2 1 21 PRO HB2 3.590 . 5.380 3.516 2.518 4.924 . 0 0 "[ . 1 . 2]" 1
30 1 11 TRP HZ2 1 21 PRO HB3 3.590 . 5.380 2.337 1.791 3.626 0.009 5 0 "[ . 1 . 2]" 1
31 1 11 TRP HZ2 1 21 PRO HG2 3.650 . 5.500 4.694 3.404 5.510 0.010 13 0 "[ . 1 . 2]" 1
32 1 11 TRP HZ2 1 21 PRO HG3 3.650 . 5.500 3.847 2.383 4.750 . 0 0 "[ . 1 . 2]" 1
33 1 11 TRP HZ2 1 76 ASP H 3.650 . 5.500 4.689 3.671 5.533 0.033 5 0 "[ . 1 . 2]" 1
34 1 11 TRP HZ3 1 74 VAL HB 3.650 . 5.500 3.209 1.855 4.449 . 0 0 "[ . 1 . 2]" 1
35 1 11 TRP HZ3 1 74 VAL MG1 4.160 . 6.530 4.070 2.001 4.959 . 0 0 "[ . 1 . 2]" 1
36 1 11 TRP HZ3 1 74 VAL MG2 3.910 . 6.030 3.512 2.460 4.468 . 0 0 "[ . 1 . 2]" 1
37 1 12 GLN H 1 12 GLN HB2 2.590 . 3.390 2.445 2.344 2.589 . 0 0 "[ . 1 . 2]" 1
38 1 12 GLN H 1 12 GLN QB 2.400 . 3.000 2.232 2.204 2.313 . 0 0 "[ . 1 . 2]" 1
39 1 12 GLN H 1 12 GLN HB3 2.590 . 3.390 2.622 2.422 3.546 0.156 19 0 "[ . 1 . 2]" 1
40 1 12 GLN H 1 12 GLN HG2 3.460 . 5.130 4.426 3.575 4.504 . 0 0 "[ . 1 . 2]" 1
41 1 12 GLN H 1 12 GLN QG 3.200 . 4.610 3.876 2.394 3.967 . 0 0 "[ . 1 . 2]" 1
42 1 12 GLN H 1 12 GLN HG3 3.460 . 5.130 4.310 2.432 4.491 . 0 0 "[ . 1 . 2]" 1
43 1 12 GLN H 1 13 ARG H 2.730 . 3.670 2.859 2.710 2.982 . 0 0 "[ . 1 . 2]" 1
44 1 12 GLN HA 1 12 GLN QE 4.080 . 6.370 4.463 3.971 4.948 . 0 0 "[ . 1 . 2]" 1
45 1 12 GLN HA 1 15 LEU H 2.900 . 4.010 3.318 3.031 3.582 . 0 0 "[ . 1 . 2]" 1
46 1 12 GLN HA 1 15 LEU HB2 3.090 . 4.380 2.870 2.486 3.158 . 0 0 "[ . 1 . 2]" 1
47 1 12 GLN HA 1 15 LEU QB 2.730 . 3.670 2.831 2.465 3.088 . 0 0 "[ . 1 . 2]" 1
48 1 12 GLN HA 1 15 LEU HB3 3.090 . 4.380 4.349 4.040 4.417 0.037 3 0 "[ . 1 . 2]" 1
49 1 12 GLN HA 1 15 LEU MD1 3.420 . 5.040 2.321 1.942 2.630 . 0 0 "[ . 1 . 2]" 1
50 1 12 GLN HA 1 15 LEU HG 3.650 . 5.500 2.788 2.007 3.284 . 0 0 "[ . 1 . 2]" 1
51 1 12 GLN QB 1 13 ARG H 2.700 . 3.600 2.741 2.500 3.018 . 0 0 "[ . 1 . 2]" 1
52 1 12 GLN HB2 1 13 ARG H 3.090 . 4.380 3.947 2.979 4.210 . 0 0 "[ . 1 . 2]" 1
53 1 12 GLN HB3 1 13 ARG H 3.090 . 4.380 2.834 2.532 3.745 . 0 0 "[ . 1 . 2]" 1
54 1 12 GLN QG 1 15 LEU MD1 4.600 . 7.410 3.137 2.147 3.776 . 0 0 "[ . 1 . 2]" 1
55 1 12 GLN QG 1 16 THR HB 4.090 . 6.380 4.760 3.963 6.488 0.108 19 0 "[ . 1 . 2]" 1
56 1 12 GLN HG2 1 15 LEU MD2 4.160 . 6.530 6.213 5.320 6.563 0.033 20 0 "[ . 1 . 2]" 1
57 1 12 GLN HG3 1 15 LEU MD2 4.160 . 6.530 5.727 4.864 6.203 . 0 0 "[ . 1 . 2]" 1
58 1 13 ARG H 1 13 ARG HB2 2.810 . 3.830 3.155 2.327 3.640 . 0 0 "[ . 1 . 2]" 1
59 1 13 ARG H 1 13 ARG QB 2.630 . 3.470 2.453 2.206 2.595 . 0 0 "[ . 1 . 2]" 1
60 1 13 ARG H 1 13 ARG HB3 2.810 . 3.830 2.876 2.310 3.637 . 0 0 "[ . 1 . 2]" 1
61 1 13 ARG H 1 13 ARG HD2 3.650 . 5.500 4.587 2.854 5.623 0.123 13 0 "[ . 1 . 2]" 1
62 1 13 ARG H 1 13 ARG HD3 3.650 . 5.500 4.245 3.285 4.852 . 0 0 "[ . 1 . 2]" 1
63 1 13 ARG H 1 13 ARG HG2 3.650 . 5.500 2.585 2.107 4.575 . 0 0 "[ . 1 . 2]" 1
64 1 13 ARG H 1 13 ARG QG 3.300 . 4.810 2.456 2.082 4.056 . 0 0 "[ . 1 . 2]" 1
65 1 13 ARG H 1 13 ARG HG3 3.650 . 5.500 3.528 2.263 4.531 . 0 0 "[ . 1 . 2]" 1
66 1 13 ARG H 1 14 LEU H 3.000 . 4.200 2.691 2.546 2.829 . 0 0 "[ . 1 . 2]" 1
67 1 13 ARG HA 1 16 THR HB 2.670 . 3.550 2.869 2.358 3.561 0.011 8 0 "[ . 1 . 2]" 1
68 1 13 ARG HA 1 16 THR MG 4.130 . 6.470 3.885 3.081 4.369 . 0 0 "[ . 1 . 2]" 1
69 1 13 ARG QB 1 13 ARG QG 2.140 . 2.480 2.041 1.968 2.086 . 0 0 "[ . 1 . 2]" 1
70 1 13 ARG QG 1 14 LEU HG 3.580 . 5.360 4.690 4.172 5.407 0.047 9 0 "[ . 1 . 2]" 1
71 1 14 LEU H 1 14 LEU HB2 2.890 . 3.980 2.412 2.217 2.607 . 0 0 "[ . 1 . 2]" 1
72 1 14 LEU H 1 14 LEU QB 2.760 . 3.730 2.376 2.194 2.548 . 0 0 "[ . 1 . 2]" 1
73 1 14 LEU H 1 14 LEU HB3 2.890 . 3.980 3.588 3.513 3.629 . 0 0 "[ . 1 . 2]" 1
74 1 14 LEU H 1 14 LEU MD1 3.360 . 4.920 3.471 1.933 3.828 . 0 0 "[ . 1 . 2]" 1
75 1 14 LEU H 1 14 LEU MD2 3.590 . 5.380 2.582 1.869 3.938 . 0 0 "[ . 1 . 2]" 1
76 1 14 LEU H 1 14 LEU HG 3.650 . 5.500 3.419 2.090 4.173 . 0 0 "[ . 1 . 2]" 1
77 1 14 LEU H 1 15 LEU H 2.720 . 3.640 2.504 2.420 2.666 . 0 0 "[ . 1 . 2]" 1
78 1 14 LEU HA 1 14 LEU MD1 3.000 . 4.200 2.616 1.812 3.869 . 0 0 "[ . 1 . 2]" 1
79 1 14 LEU HA 1 14 LEU MD2 3.180 . 4.570 2.643 1.982 3.751 . 0 0 "[ . 1 . 2]" 1
80 1 14 LEU QB 1 15 LEU H 2.670 . 3.540 2.624 2.386 2.851 . 0 0 "[ . 1 . 2]" 1
81 1 14 LEU QB 1 74 VAL MG2 4.600 . 7.410 3.333 2.195 4.366 . 0 0 "[ . 1 . 2]" 1
82 1 14 LEU HB2 1 15 LEU H 2.800 . 3.800 2.704 2.423 2.974 . 0 0 "[ . 1 . 2]" 1
83 1 14 LEU HB3 1 15 LEU H 2.800 . 3.800 3.591 3.286 3.821 0.021 9 0 "[ . 1 . 2]" 1
84 1 14 LEU MD1 1 15 LEU H 4.040 . 6.280 4.517 3.895 4.715 . 0 0 "[ . 1 . 2]" 1
85 1 14 LEU MD1 1 19 TRP HE3 3.220 . 4.640 3.486 2.569 4.620 . 0 0 "[ . 1 . 2]" 1
86 1 14 LEU MD1 1 19 TRP HZ3 3.290 . 4.790 2.894 1.915 3.844 . 0 0 "[ . 1 . 2]" 1
87 1 14 LEU MD2 1 15 LEU H 4.160 . 6.530 4.226 3.668 4.782 . 0 0 "[ . 1 . 2]" 1
88 1 14 LEU HG 1 55 PRO QG 4.090 . 6.380 4.389 2.273 5.672 . 0 0 "[ . 1 . 2]" 1
89 1 15 LEU H 1 15 LEU HB2 2.750 . 3.700 2.552 2.466 2.663 . 0 0 "[ . 1 . 2]" 1
90 1 15 LEU H 1 15 LEU QB 2.560 . 3.330 2.500 2.424 2.594 . 0 0 "[ . 1 . 2]" 1
91 1 15 LEU H 1 15 LEU HB3 2.750 . 3.700 3.587 3.574 3.605 . 0 0 "[ . 1 . 2]" 1
92 1 15 LEU H 1 15 LEU MD1 4.150 . 6.500 3.626 3.546 3.683 . 0 0 "[ . 1 . 2]" 1
93 1 15 LEU H 1 15 LEU MD2 2.920 . 4.050 3.090 2.761 3.231 . 0 0 "[ . 1 . 2]" 1
94 1 15 LEU H 1 15 LEU HG 2.810 . 3.830 2.163 1.996 2.292 . 0 0 "[ . 1 . 2]" 1
95 1 15 LEU H 1 16 THR H 2.640 . 3.490 2.574 2.425 2.698 . 0 0 "[ . 1 . 2]" 1
96 1 15 LEU HA 1 15 LEU MD1 3.490 . 5.190 3.858 3.837 3.883 . 0 0 "[ . 1 . 2]" 1
97 1 15 LEU HA 1 15 LEU MD2 2.890 . 3.990 2.053 1.998 2.153 . 0 0 "[ . 1 . 2]" 1
98 1 15 LEU QB 1 16 THR H 3.500 . 5.200 2.644 2.388 2.923 . 0 0 "[ . 1 . 2]" 1
99 1 15 LEU HB2 1 16 THR H 3.620 . 5.440 2.700 2.427 3.007 . 0 0 "[ . 1 . 2]" 1
100 1 15 LEU HB3 1 16 THR H 3.620 . 5.440 3.792 3.552 3.984 . 0 0 "[ . 1 . 2]" 1
101 1 15 LEU MD1 1 21 PRO QG 3.590 . 5.390 3.074 2.134 4.359 . 0 0 "[ . 1 . 2]" 1
102 1 15 LEU MD2 1 20 GLN QE 4.600 . 7.400 5.699 3.802 6.816 . 0 0 "[ . 1 . 2]" 1
103 1 15 LEU MD2 1 21 PRO HD2 4.100 . 6.400 3.849 3.350 4.497 . 0 0 "[ . 1 . 2]" 1
104 1 15 LEU MD2 1 21 PRO HD3 4.100 . 6.400 2.532 1.804 3.679 . 0 0 "[ . 1 . 2]" 1
105 1 15 LEU MD2 1 21 PRO HG2 3.670 . 5.540 3.650 2.679 4.528 . 0 0 "[ . 1 . 2]" 1
106 1 15 LEU MD2 1 21 PRO QG 3.520 . 5.240 2.414 1.784 3.076 0.016 9 0 "[ . 1 . 2]" 1
107 1 15 LEU MD2 1 21 PRO HG3 3.670 . 5.540 2.453 1.799 3.130 0.001 9 0 "[ . 1 . 2]" 1
108 1 15 LEU HG 1 16 THR H 3.650 . 5.500 4.205 3.927 4.400 . 0 0 "[ . 1 . 2]" 1
109 1 16 THR H 1 16 THR HB 2.890 . 3.980 2.588 2.371 2.759 . 0 0 "[ . 1 . 2]" 1
110 1 16 THR H 1 17 ARG H 3.430 . 5.070 2.649 2.550 2.773 . 0 0 "[ . 1 . 2]" 1
111 1 16 THR HA 1 16 THR HB 2.420 . 3.050 2.976 2.516 3.030 . 0 0 "[ . 1 . 2]" 1
112 1 16 THR HB 1 17 ARG H 3.240 . 4.690 3.039 2.555 4.098 . 0 0 "[ . 1 . 2]" 1
113 1 17 ARG QD 1 57 MET H 4.090 . 6.380 6.236 5.314 6.497 0.117 10 0 "[ . 1 . 2]" 1
114 1 19 TRP H 1 19 TRP HD1 3.650 . 5.500 3.014 2.382 3.338 . 0 0 "[ . 1 . 2]" 1
115 1 19 TRP H 1 19 TRP HE1 3.410 . 5.030 5.017 4.617 5.191 0.161 13 0 "[ . 1 . 2]" 1
116 1 19 TRP H 1 19 TRP HE3 3.650 . 5.500 5.246 4.835 5.624 0.124 1 0 "[ . 1 . 2]" 1
117 1 19 TRP HA 1 19 TRP HD1 3.120 . 4.450 2.316 2.115 2.559 . 0 0 "[ . 1 . 2]" 1
118 1 19 TRP HA 1 19 TRP HE1 3.650 . 5.500 4.721 4.591 4.814 . 0 0 "[ . 1 . 2]" 1
119 1 19 TRP HA 1 20 GLN H 2.590 . 3.390 2.205 2.130 2.322 . 0 0 "[ . 1 . 2]" 1
120 1 19 TRP HA 1 72 VAL MG2 3.680 . 5.570 4.789 4.280 5.583 0.013 3 0 "[ . 1 . 2]" 1
121 1 19 TRP HA 1 73 ALA HA 2.840 . 3.890 3.902 3.381 4.011 0.121 20 0 "[ . 1 . 2]" 1
122 1 19 TRP HB2 1 20 GLN H 2.970 . 4.140 4.027 3.623 4.190 0.050 8 0 "[ . 1 . 2]" 1
123 1 19 TRP HB2 1 74 VAL MG1 4.150 . 6.500 3.410 2.425 5.098 . 0 0 "[ . 1 . 2]" 1
124 1 19 TRP HB2 1 74 VAL MG2 4.160 . 6.530 3.154 2.608 3.614 . 0 0 "[ . 1 . 2]" 1
125 1 19 TRP HB3 1 20 GLN H 2.640 . 3.490 2.975 2.506 3.201 . 0 0 "[ . 1 . 2]" 1
126 1 19 TRP HB3 1 74 VAL MG1 4.160 . 6.530 2.645 2.144 4.843 . 0 0 "[ . 1 . 2]" 1
127 1 19 TRP HB3 1 74 VAL MG2 4.160 . 6.530 2.657 2.167 3.469 . 0 0 "[ . 1 . 2]" 1
128 1 19 TRP HD1 1 72 VAL HB 2.750 . 3.700 2.651 2.091 3.282 . 0 0 "[ . 1 . 2]" 1
129 1 19 TRP HD1 1 72 VAL MG1 4.160 . 6.530 3.766 3.388 4.369 . 0 0 "[ . 1 . 2]" 1
130 1 19 TRP HD1 1 72 VAL MG2 4.160 . 6.530 3.743 3.335 4.410 . 0 0 "[ . 1 . 2]" 1
131 1 19 TRP HE1 1 58 ILE MG 3.230 . 4.670 4.222 3.511 4.698 0.028 3 0 "[ . 1 . 2]" 1
132 1 19 TRP HE1 1 59 ALA MB 3.630 . 5.470 3.994 2.805 5.009 . 0 0 "[ . 1 . 2]" 1
133 1 19 TRP HE1 1 72 VAL H 3.650 . 5.500 5.180 4.732 5.546 0.046 8 0 "[ . 1 . 2]" 1
134 1 19 TRP HE1 1 72 VAL MG2 3.280 . 4.760 2.912 2.611 3.339 . 0 0 "[ . 1 . 2]" 1
135 1 19 TRP HE3 1 74 VAL MG1 4.160 . 6.530 1.981 1.739 3.583 0.051 9 0 "[ . 1 . 2]" 1
136 1 19 TRP HH2 1 40 LEU MD1 4.110 . 6.430 3.047 2.806 5.086 . 0 0 "[ . 1 . 2]" 1
137 1 19 TRP HH2 1 40 LEU MD2 3.900 . 6.000 4.992 4.674 5.290 . 0 0 "[ . 1 . 2]" 1
138 1 19 TRP HH2 1 40 LEU HG 3.650 . 5.500 5.508 4.255 5.653 0.153 20 0 "[ . 1 . 2]" 1
139 1 19 TRP HH2 1 55 PRO HB2 3.650 . 5.500 2.753 1.783 4.105 0.017 13 0 "[ . 1 . 2]" 1
140 1 19 TRP HH2 1 55 PRO QG 4.090 . 6.380 3.976 2.555 5.730 . 0 0 "[ . 1 . 2]" 1
141 1 19 TRP HH2 1 56 VAL HA 3.650 . 5.500 3.597 1.765 4.701 0.035 17 0 "[ . 1 . 2]" 1
142 1 19 TRP HH2 1 59 ALA H 3.650 . 5.500 5.056 3.774 5.535 0.035 1 0 "[ . 1 . 2]" 1
143 1 19 TRP HH2 1 59 ALA MB 3.960 . 6.120 4.922 3.693 5.692 . 0 0 "[ . 1 . 2]" 1
144 1 19 TRP HZ2 1 58 ILE HB 3.650 . 5.500 4.916 3.212 5.524 0.024 19 0 "[ . 1 . 2]" 1
145 1 19 TRP HZ2 1 58 ILE MG 4.160 . 6.530 2.535 2.104 3.424 . 0 0 "[ . 1 . 2]" 1
146 1 19 TRP HZ2 1 59 ALA H 3.650 . 5.500 4.050 2.980 4.633 . 0 0 "[ . 1 . 2]" 1
147 1 19 TRP HZ2 1 59 ALA HA 3.650 . 5.500 4.384 2.977 5.313 . 0 0 "[ . 1 . 2]" 1
148 1 19 TRP HZ2 1 59 ALA MB 3.430 . 5.070 3.217 1.944 4.101 . 0 0 "[ . 1 . 2]" 1
149 1 19 TRP HZ2 1 72 VAL MG2 4.160 . 6.530 3.948 3.459 4.262 . 0 0 "[ . 1 . 2]" 1
150 1 19 TRP HZ3 1 40 LEU MD1 3.910 . 6.030 2.787 2.447 5.115 . 0 0 "[ . 1 . 2]" 1
151 1 19 TRP HZ3 1 40 LEU MD2 4.150 . 6.500 5.168 4.813 5.693 . 0 0 "[ . 1 . 2]" 1
152 1 19 TRP HZ3 1 55 PRO HB2 3.650 . 5.500 3.058 2.012 4.474 . 0 0 "[ . 1 . 2]" 1
153 1 19 TRP HZ3 1 55 PRO HB3 3.650 . 5.500 3.757 2.072 5.516 0.016 6 0 "[ . 1 . 2]" 1
154 1 19 TRP HZ3 1 74 VAL MG1 4.160 . 6.530 3.124 2.545 4.094 . 0 0 "[ . 1 . 2]" 1
155 1 20 GLN H 1 20 GLN HB2 2.580 . 3.360 2.325 2.210 2.590 . 0 0 "[ . 1 . 2]" 1
156 1 20 GLN H 1 20 GLN QB 2.470 . 3.150 2.275 2.188 2.375 . 0 0 "[ . 1 . 2]" 1
157 1 20 GLN H 1 20 GLN HB3 2.580 . 3.360 3.447 2.556 3.590 0.230 4 0 "[ . 1 . 2]" 1
158 1 20 GLN H 1 20 GLN HG2 3.650 . 5.500 4.222 4.018 4.748 . 0 0 "[ . 1 . 2]" 1
159 1 20 GLN H 1 20 GLN QG 3.470 . 5.140 3.578 2.866 4.151 . 0 0 "[ . 1 . 2]" 1
160 1 20 GLN H 1 20 GLN HG3 3.650 . 5.500 3.892 2.934 4.580 . 0 0 "[ . 1 . 2]" 1
161 1 20 GLN H 1 73 ALA HA 2.520 . 3.240 2.432 2.074 3.063 . 0 0 "[ . 1 . 2]" 1
162 1 20 GLN HA 1 20 GLN QE 4.080 . 6.370 3.305 2.258 4.184 . 0 0 "[ . 1 . 2]" 1
163 1 20 GLN QB 1 30 TRP HE1 3.520 . 5.250 3.285 2.603 4.539 . 0 0 "[ . 1 . 2]" 1
164 1 20 GLN HB2 1 30 TRP HE1 3.650 . 5.500 3.544 2.697 4.833 . 0 0 "[ . 1 . 2]" 1
165 1 20 GLN HB2 1 73 ALA HA 3.650 . 5.500 3.210 2.501 4.538 . 0 0 "[ . 1 . 2]" 1
166 1 20 GLN HB2 1 73 ALA MB 4.160 . 6.530 3.151 2.558 4.185 . 0 0 "[ . 1 . 2]" 1
167 1 20 GLN HB3 1 30 TRP HE1 3.650 . 5.500 3.945 3.263 5.506 0.006 17 0 "[ . 1 . 2]" 1
168 1 20 GLN HB3 1 73 ALA HA 3.650 . 5.500 4.191 2.752 5.393 . 0 0 "[ . 1 . 2]" 1
169 1 20 GLN HB3 1 73 ALA MB 4.160 . 6.530 3.725 2.647 4.617 . 0 0 "[ . 1 . 2]" 1
170 1 20 GLN QG 1 30 TRP HE1 3.820 . 5.850 3.042 1.922 5.759 . 0 0 "[ . 1 . 2]" 1
171 1 20 GLN HG2 1 22 VAL MG1 4.160 . 6.530 4.616 3.073 5.637 . 0 0 "[ . 1 . 2]" 1
172 1 20 GLN HG3 1 22 VAL MG1 4.160 . 6.530 4.994 2.583 6.002 . 0 0 "[ . 1 . 2]" 1
173 1 21 PRO HA 1 22 VAL H 2.270 . 2.740 2.177 2.138 2.242 . 0 0 "[ . 1 . 2]" 1
174 1 21 PRO HA 1 22 VAL HA 3.210 . 4.630 4.406 4.391 4.420 . 0 0 "[ . 1 . 2]" 1
175 1 21 PRO HA 1 22 VAL MG1 3.840 . 5.880 3.905 3.743 4.098 . 0 0 "[ . 1 . 2]" 1
176 1 21 PRO HA 1 22 VAL MG2 3.880 . 5.970 3.687 3.547 3.845 . 0 0 "[ . 1 . 2]" 1
177 1 21 PRO HA 1 74 VAL H 2.810 . 3.830 3.015 2.878 3.447 . 0 0 "[ . 1 . 2]" 1
178 1 21 PRO HA 1 74 VAL MG2 3.320 . 4.850 2.328 1.941 4.723 . 0 0 "[ . 1 . 2]" 1
179 1 21 PRO QB 1 22 VAL H 2.940 . 4.090 3.507 3.253 3.707 . 0 0 "[ . 1 . 2]" 1
180 1 21 PRO QB 1 74 VAL MG2 4.320 . 6.850 3.074 2.499 5.520 . 0 0 "[ . 1 . 2]" 1
181 1 21 PRO HB2 1 22 VAL H 3.090 . 4.380 3.833 3.458 4.056 . 0 0 "[ . 1 . 2]" 1
182 1 21 PRO HB3 1 22 VAL H 3.090 . 4.380 4.090 3.715 4.377 . 0 0 "[ . 1 . 2]" 1
183 1 21 PRO QD 1 74 VAL MG2 4.600 . 7.410 3.800 3.306 5.708 . 0 0 "[ . 1 . 2]" 1
184 1 22 VAL H 1 22 VAL MG1 3.150 . 4.510 2.801 2.586 3.010 . 0 0 "[ . 1 . 2]" 1
185 1 22 VAL H 1 22 VAL MG2 2.700 . 3.610 1.996 1.808 2.162 . 0 0 "[ . 1 . 2]" 1
186 1 22 VAL H 1 23 GLU H 3.650 . 5.500 4.497 4.401 4.564 . 0 0 "[ . 1 . 2]" 1
187 1 22 VAL H 1 73 ALA MB 3.930 . 6.060 3.696 3.398 4.237 . 0 0 "[ . 1 . 2]" 1
188 1 22 VAL H 1 74 VAL H 2.760 . 3.730 3.362 3.151 3.689 . 0 0 "[ . 1 . 2]" 1
189 1 22 VAL H 1 74 VAL MG2 4.080 . 6.370 3.674 3.185 5.400 . 0 0 "[ . 1 . 2]" 1
190 1 22 VAL H 1 75 ALA HA 3.150 . 4.510 3.157 2.750 3.486 . 0 0 "[ . 1 . 2]" 1
191 1 22 VAL H 1 75 ALA MB 4.070 . 6.340 4.195 3.459 4.847 . 0 0 "[ . 1 . 2]" 1
192 1 22 VAL HA 1 23 GLU H 2.310 . 2.830 2.382 2.270 2.670 . 0 0 "[ . 1 . 2]" 1
193 1 22 VAL HA 1 23 GLU HG2 3.650 . 5.500 4.880 4.587 5.789 0.289 11 0 "[ . 1 . 2]" 1
194 1 22 VAL HA 1 23 GLU HG3 3.650 . 5.500 3.604 3.233 5.484 . 0 0 "[ . 1 . 2]" 1
195 1 22 VAL HB 1 23 GLU H 2.270 . 2.740 2.335 1.861 2.559 . 0 0 "[ . 1 . 2]" 1
196 1 22 VAL HB 1 27 VAL HA 3.650 . 5.500 2.767 2.351 3.387 . 0 0 "[ . 1 . 2]" 1
197 1 22 VAL HB 1 27 VAL HB 3.650 . 5.500 2.774 2.250 3.701 . 0 0 "[ . 1 . 2]" 1
198 1 22 VAL HB 1 73 ALA MB 4.160 . 6.530 4.115 3.765 4.310 . 0 0 "[ . 1 . 2]" 1
199 1 22 VAL MG1 1 23 GLU H 3.260 . 4.730 3.530 3.404 3.615 . 0 0 "[ . 1 . 2]" 1
200 1 22 VAL MG1 1 27 VAL HA 3.800 . 5.810 3.133 2.794 4.018 . 0 0 "[ . 1 . 2]" 1
201 1 22 VAL MG1 1 30 TRP H 4.160 . 6.530 4.883 4.472 5.723 . 0 0 "[ . 1 . 2]" 1
202 1 22 VAL MG1 1 30 TRP HB2 3.730 . 5.660 3.178 2.801 3.973 . 0 0 "[ . 1 . 2]" 1
203 1 22 VAL MG1 1 39 ILE MD 4.260 . 6.720 4.570 3.465 5.352 . 0 0 "[ . 1 . 2]" 1
204 1 22 VAL MG1 1 39 ILE QG 3.980 . 6.170 3.757 2.617 4.612 . 0 0 "[ . 1 . 2]" 1
205 1 22 VAL MG1 1 39 ILE MG 4.160 . 6.530 4.324 3.587 5.068 . 0 0 "[ . 1 . 2]" 1
206 1 22 VAL MG1 1 73 ALA MB 3.590 . 5.390 2.025 1.771 2.479 0.019 15 0 "[ . 1 . 2]" 1
207 1 22 VAL MG1 1 74 VAL H 3.740 . 5.690 3.598 3.355 3.858 . 0 0 "[ . 1 . 2]" 1
208 1 22 VAL MG1 1 75 ALA MB 4.680 . 7.560 5.104 4.619 5.774 . 0 0 "[ . 1 . 2]" 1
209 1 22 VAL MG1 1 83 ILE MD 4.680 . 7.560 4.535 4.097 5.224 . 0 0 "[ . 1 . 2]" 1
210 1 22 VAL MG2 1 23 GLU H 2.830 . 3.860 3.462 2.914 3.682 . 0 0 "[ . 1 . 2]" 1
211 1 22 VAL MG2 1 27 VAL H 4.160 . 6.530 4.778 4.113 6.018 . 0 0 "[ . 1 . 2]" 1
212 1 22 VAL MG2 1 27 VAL HA 3.740 . 5.690 3.644 3.137 4.431 . 0 0 "[ . 1 . 2]" 1
213 1 22 VAL MG2 1 27 VAL HB 3.230 . 4.670 2.976 2.367 4.088 . 0 0 "[ . 1 . 2]" 1
214 1 22 VAL MG2 1 30 TRP HB3 4.160 . 6.530 4.731 4.165 5.407 . 0 0 "[ . 1 . 2]" 1
215 1 22 VAL MG2 1 39 ILE HA 4.160 . 6.530 4.528 4.008 5.048 . 0 0 "[ . 1 . 2]" 1
216 1 22 VAL MG2 1 39 ILE QG 3.330 . 4.870 2.991 2.429 3.468 . 0 0 "[ . 1 . 2]" 1
217 1 22 VAL MG2 1 73 ALA MB 4.010 . 6.220 2.398 2.155 2.712 . 0 0 "[ . 1 . 2]" 1
218 1 22 VAL MG2 1 74 VAL H 3.320 . 4.850 3.230 2.879 3.438 . 0 0 "[ . 1 . 2]" 1
219 1 22 VAL MG2 1 75 ALA HA 4.160 . 6.530 3.054 2.454 3.926 . 0 0 "[ . 1 . 2]" 1
220 1 22 VAL MG2 1 75 ALA MB 4.680 . 7.560 2.904 2.311 3.681 . 0 0 "[ . 1 . 2]" 1
221 1 23 GLU H 1 23 GLU HB2 2.870 . 3.950 2.592 2.452 2.777 . 0 0 "[ . 1 . 2]" 1
222 1 23 GLU H 1 23 GLU QB 2.680 . 3.570 2.541 2.398 2.717 . 0 0 "[ . 1 . 2]" 1
223 1 23 GLU H 1 23 GLU HB3 2.870 . 3.950 3.688 2.942 3.848 . 0 0 "[ . 1 . 2]" 1
224 1 23 GLU H 1 23 GLU HG2 3.290 . 4.790 3.923 3.600 4.404 . 0 0 "[ . 1 . 2]" 1
225 1 23 GLU H 1 23 GLU QG 2.990 . 4.180 2.779 2.430 3.974 . 0 0 "[ . 1 . 2]" 1
226 1 23 GLU H 1 23 GLU HG3 3.290 . 4.790 2.862 2.471 4.524 . 0 0 "[ . 1 . 2]" 1
227 1 23 GLU H 1 24 ALA H 3.180 . 4.570 4.443 4.258 4.509 . 0 0 "[ . 1 . 2]" 1
228 1 23 GLU H 1 26 THR MG 3.620 . 5.440 2.721 1.765 4.520 0.035 2 0 "[ . 1 . 2]" 1
229 1 23 GLU H 1 27 VAL HB 2.700 . 3.610 3.609 3.148 3.680 0.070 19 0 "[ . 1 . 2]" 1
230 1 23 GLU H 1 27 VAL MG1 4.160 . 6.530 4.636 4.281 5.018 . 0 0 "[ . 1 . 2]" 1
231 1 23 GLU H 1 83 ILE MD 4.160 . 6.530 4.263 3.659 5.043 . 0 0 "[ . 1 . 2]" 1
232 1 23 GLU HA 1 24 ALA H 2.330 . 2.870 2.549 2.441 2.786 . 0 0 "[ . 1 . 2]" 1
233 1 23 GLU HA 1 79 GLN HG2 3.650 . 5.500 3.019 1.774 4.822 0.026 20 0 "[ . 1 . 2]" 1
234 1 23 GLU HA 1 79 GLN HG3 3.650 . 5.500 3.055 1.904 4.305 . 0 0 "[ . 1 . 2]" 1
235 1 23 GLU HA 1 83 ILE MD 4.160 . 6.530 3.461 2.577 4.339 . 0 0 "[ . 1 . 2]" 1
236 1 23 GLU QB 1 26 THR H 2.680 . 3.560 2.424 2.061 3.004 . 0 0 "[ . 1 . 2]" 1
237 1 23 GLU QB 1 26 THR MG 3.270 . 4.750 2.492 1.764 3.664 0.026 6 0 "[ . 1 . 2]" 1
238 1 23 GLU QB 1 79 GLN QG 4.520 . 7.250 3.513 2.177 5.179 . 0 0 "[ . 1 . 2]" 1
239 1 23 GLU HB2 1 24 ALA H 2.620 . 3.450 3.353 3.051 3.573 0.123 11 0 "[ . 1 . 2]" 1
240 1 23 GLU HB2 1 26 THR H 2.810 . 3.830 2.534 2.073 3.466 . 0 0 "[ . 1 . 2]" 1
241 1 23 GLU HB2 1 26 THR MG 3.540 . 5.290 2.547 1.770 3.751 0.020 6 0 "[ . 1 . 2]" 1
242 1 23 GLU HB3 1 24 ALA H 2.620 . 3.450 2.232 1.897 2.473 . 0 0 "[ . 1 . 2]" 1
243 1 23 GLU HB3 1 26 THR H 2.810 . 3.830 3.538 2.216 3.885 0.055 20 0 "[ . 1 . 2]" 1
244 1 23 GLU HB3 1 26 THR MG 3.540 . 5.290 3.954 3.185 5.141 . 0 0 "[ . 1 . 2]" 1
245 1 23 GLU QG 1 24 ALA H 3.300 . 4.800 3.802 2.275 4.049 . 0 0 "[ . 1 . 2]" 1
246 1 23 GLU QG 1 26 THR MG 4.170 . 6.540 3.211 2.245 4.418 . 0 0 "[ . 1 . 2]" 1
247 1 23 GLU QG 1 75 ALA MB 4.600 . 7.410 5.788 4.828 6.508 . 0 0 "[ . 1 . 2]" 1
248 1 23 GLU QG 1 79 GLN QG 4.060 . 6.320 3.110 1.944 5.041 . 0 0 "[ . 1 . 2]" 1
249 1 23 GLU HG2 1 24 ALA H 3.650 . 5.500 4.015 2.301 4.298 . 0 0 "[ . 1 . 2]" 1
250 1 23 GLU HG2 1 79 GLN HG2 4.520 . 7.250 3.772 1.964 6.053 . 0 0 "[ . 1 . 2]" 1
251 1 23 GLU HG2 1 79 GLN HG3 4.520 . 7.250 3.900 1.971 5.896 . 0 0 "[ . 1 . 2]" 1
252 1 23 GLU HG3 1 24 ALA H 3.650 . 5.500 4.733 3.584 4.948 . 0 0 "[ . 1 . 2]" 1
253 1 23 GLU HG3 1 79 GLN HG2 4.520 . 7.250 5.054 3.231 7.272 0.022 14 0 "[ . 1 . 2]" 1
254 1 23 GLU HG3 1 79 GLN HG3 4.520 . 7.250 5.222 3.723 6.810 . 0 0 "[ . 1 . 2]" 1
255 1 24 ALA H 1 24 ALA MB 2.610 . 3.430 2.251 2.224 2.311 . 0 0 "[ . 1 . 2]" 1
256 1 24 ALA H 1 79 GLN QG 4.090 . 6.380 3.282 2.137 5.055 . 0 0 "[ . 1 . 2]" 1
257 1 24 ALA H 1 83 ILE MD 3.420 . 5.040 3.981 3.128 4.897 . 0 0 "[ . 1 . 2]" 1
258 1 24 ALA H 1 83 ILE QG 3.890 . 5.980 3.922 3.200 4.688 . 0 0 "[ . 1 . 2]" 1
259 1 24 ALA HA 1 27 VAL H 3.180 . 4.570 3.971 3.221 4.304 . 0 0 "[ . 1 . 2]" 1
260 1 24 ALA HA 1 27 VAL HB 3.030 . 4.260 3.664 2.709 4.271 0.011 4 0 "[ . 1 . 2]" 1
261 1 24 ALA HA 1 27 VAL MG1 3.600 . 5.410 2.672 2.056 3.367 . 0 0 "[ . 1 . 2]" 1
262 1 24 ALA HA 1 27 VAL MG2 3.790 . 5.780 4.544 3.818 5.121 . 0 0 "[ . 1 . 2]" 1
263 1 24 ALA HA 1 83 ILE MD 3.400 . 5.010 3.128 2.206 4.108 . 0 0 "[ . 1 . 2]" 1
264 1 24 ALA HA 1 83 ILE QG 3.500 . 5.200 2.253 1.789 3.152 0.011 14 0 "[ . 1 . 2]" 1
265 1 24 ALA MB 1 79 GLN HA 3.050 . 4.300 3.420 2.295 4.105 . 0 0 "[ . 1 . 2]" 1
266 1 24 ALA MB 1 79 GLN QB 4.310 . 6.820 3.554 1.779 4.211 0.021 8 0 "[ . 1 . 2]" 1
267 1 24 ALA MB 1 83 ILE H 3.760 . 5.720 3.603 3.122 4.198 . 0 0 "[ . 1 . 2]" 1
268 1 24 ALA MB 1 83 ILE HA 4.160 . 6.530 3.723 2.961 4.453 . 0 0 "[ . 1 . 2]" 1
269 1 24 ALA MB 1 83 ILE MD 4.680 . 7.560 3.798 3.142 4.416 . 0 0 "[ . 1 . 2]" 1
270 1 24 ALA MB 1 83 ILE HG12 3.680 . 5.570 3.336 2.525 4.134 . 0 0 "[ . 1 . 2]" 1
271 1 24 ALA MB 1 83 ILE QG 3.520 . 5.250 2.771 2.171 3.393 . 0 0 "[ . 1 . 2]" 1
272 1 24 ALA MB 1 83 ILE HG13 3.680 . 5.570 2.985 2.350 3.679 . 0 0 "[ . 1 . 2]" 1
273 1 24 ALA MB 1 83 ILE MG 4.680 . 7.560 4.677 4.026 5.309 . 0 0 "[ . 1 . 2]" 1
274 1 25 SER HA 1 27 VAL H 3.540 . 5.280 4.195 3.916 4.477 . 0 0 "[ . 1 . 2]" 1
275 1 26 THR H 1 26 THR MG 2.910 . 4.020 2.685 1.956 3.939 . 0 0 "[ . 1 . 2]" 1
276 1 26 THR HA 1 27 VAL H 2.660 . 3.520 3.370 3.061 3.508 . 0 0 "[ . 1 . 2]" 1
277 1 26 THR HA 1 29 ASP H 2.760 . 3.730 3.380 3.137 3.733 0.003 17 0 "[ . 1 . 2]" 1
278 1 26 THR HA 1 29 ASP QB 3.760 . 5.730 3.087 2.560 3.682 . 0 0 "[ . 1 . 2]" 1
279 1 26 THR HB 1 29 ASP QB 3.730 . 5.670 4.690 3.657 5.736 0.066 7 0 "[ . 1 . 2]" 1
280 1 27 VAL H 1 27 VAL HB 2.330 . 2.870 2.541 2.470 2.639 . 0 0 "[ . 1 . 2]" 1
281 1 27 VAL H 1 27 VAL MG1 2.610 . 3.430 2.140 1.988 2.291 . 0 0 "[ . 1 . 2]" 1
282 1 27 VAL H 1 27 VAL MG2 3.280 . 4.760 3.778 3.763 3.788 . 0 0 "[ . 1 . 2]" 1
283 1 27 VAL H 1 28 ASP H 2.520 . 3.240 2.665 2.517 2.827 . 0 0 "[ . 1 . 2]" 1
284 1 27 VAL H 1 30 TRP H 3.460 . 5.130 4.797 4.570 5.107 . 0 0 "[ . 1 . 2]" 1
285 1 27 VAL HA 1 30 TRP H 2.750 . 3.700 3.425 3.153 3.691 . 0 0 "[ . 1 . 2]" 1
286 1 27 VAL HA 1 30 TRP HB3 2.800 . 3.800 2.654 2.215 3.417 . 0 0 "[ . 1 . 2]" 1
287 1 27 VAL HA 1 31 ILE H 3.230 . 4.660 4.032 3.754 4.561 . 0 0 "[ . 1 . 2]" 1
288 1 27 VAL HA 1 39 ILE QG 3.390 . 4.990 4.992 4.756 5.130 0.140 2 0 "[ . 1 . 2]" 1
289 1 27 VAL HB 1 28 ASP H 2.970 . 4.140 3.983 3.925 4.035 . 0 0 "[ . 1 . 2]" 1
290 1 27 VAL MG1 1 28 ASP H 3.320 . 4.850 2.207 1.857 2.429 . 0 0 "[ . 1 . 2]" 1
291 1 27 VAL MG1 1 28 ASP HA 3.790 . 5.780 3.194 3.083 3.479 . 0 0 "[ . 1 . 2]" 1
292 1 27 VAL MG1 1 29 ASP H 4.160 . 6.530 4.366 3.944 4.692 . 0 0 "[ . 1 . 2]" 1
293 1 27 VAL MG1 1 30 TRP HE3 4.160 . 6.530 5.572 5.044 6.055 . 0 0 "[ . 1 . 2]" 1
294 1 27 VAL MG1 1 31 ILE MD 4.680 . 7.560 3.174 2.851 3.613 . 0 0 "[ . 1 . 2]" 1
295 1 27 VAL MG1 1 39 ILE MD 4.640 . 7.490 5.007 3.800 5.433 . 0 0 "[ . 1 . 2]" 1
296 1 27 VAL MG1 1 39 ILE MG 4.660 . 7.520 4.647 4.097 5.270 . 0 0 "[ . 1 . 2]" 1
297 1 27 VAL MG1 1 83 ILE HA 4.160 . 6.530 3.858 3.457 4.199 . 0 0 "[ . 1 . 2]" 1
298 1 27 VAL MG1 1 83 ILE QG 4.600 . 7.410 2.616 1.826 3.513 . 0 0 "[ . 1 . 2]" 1
299 1 27 VAL MG1 1 87 PHE HE2 3.280 . 4.760 3.568 2.346 4.829 0.069 18 0 "[ . 1 . 2]" 1
300 1 27 VAL MG2 1 28 ASP H 3.930 . 6.060 3.734 3.341 3.961 . 0 0 "[ . 1 . 2]" 1
301 1 27 VAL MG2 1 28 ASP HA 4.160 . 6.530 3.746 3.380 4.047 . 0 0 "[ . 1 . 2]" 1
302 1 27 VAL MG2 1 30 TRP HB2 4.160 . 6.530 4.558 4.006 5.138 . 0 0 "[ . 1 . 2]" 1
303 1 27 VAL MG2 1 30 TRP HB3 4.160 . 6.530 3.440 2.968 3.947 . 0 0 "[ . 1 . 2]" 1
304 1 27 VAL MG2 1 31 ILE H 3.680 . 5.570 3.851 3.633 4.251 . 0 0 "[ . 1 . 2]" 1
305 1 27 VAL MG2 1 31 ILE MD 4.570 . 7.340 2.212 1.893 2.545 . 0 0 "[ . 1 . 2]" 1
306 1 27 VAL MG2 1 31 ILE QG 4.600 . 7.410 2.544 2.166 2.981 . 0 0 "[ . 1 . 2]" 1
307 1 27 VAL MG2 1 39 ILE HB 3.620 . 5.440 4.381 4.075 4.676 . 0 0 "[ . 1 . 2]" 1
308 1 27 VAL MG2 1 39 ILE MD 4.490 . 7.180 3.171 2.009 3.523 . 0 0 "[ . 1 . 2]" 1
309 1 27 VAL MG2 1 39 ILE QG 3.980 . 6.170 2.493 2.161 3.023 . 0 0 "[ . 1 . 2]" 1
310 1 27 VAL MG2 1 39 ILE MG 3.980 . 6.160 3.054 2.618 3.410 . 0 0 "[ . 1 . 2]" 1
311 1 27 VAL MG2 1 87 PHE HE2 3.770 . 5.750 3.118 2.397 4.089 . 0 0 "[ . 1 . 2]" 1
312 1 28 ASP H 1 28 ASP HB2 2.800 . 3.800 2.943 2.367 3.632 . 0 0 "[ . 1 . 2]" 1
313 1 28 ASP H 1 28 ASP QB 2.470 . 3.140 2.368 2.222 2.724 . 0 0 "[ . 1 . 2]" 1
314 1 28 ASP H 1 28 ASP HB3 2.800 . 3.800 2.576 2.446 2.815 . 0 0 "[ . 1 . 2]" 1
315 1 28 ASP H 1 29 ASP H 2.440 . 3.080 2.632 2.433 2.807 . 0 0 "[ . 1 . 2]" 1
316 1 28 ASP HA 1 31 ILE H 3.120 . 4.450 3.562 3.047 3.926 . 0 0 "[ . 1 . 2]" 1
317 1 28 ASP HA 1 31 ILE HB 2.640 . 3.490 2.950 2.261 3.442 . 0 0 "[ . 1 . 2]" 1
318 1 28 ASP HA 1 31 ILE MD 3.180 . 4.570 2.426 1.832 3.079 . 0 0 "[ . 1 . 2]" 1
319 1 28 ASP QB 1 29 ASP H 3.060 . 4.320 2.862 2.255 3.680 . 0 0 "[ . 1 . 2]" 1
320 1 28 ASP HB2 1 29 ASP H 3.340 . 4.880 3.818 3.453 4.127 . 0 0 "[ . 1 . 2]" 1
321 1 28 ASP HB3 1 29 ASP H 3.340 . 4.880 3.086 2.276 4.284 . 0 0 "[ . 1 . 2]" 1
322 1 29 ASP H 1 29 ASP HB2 2.520 . 3.240 2.565 2.404 2.670 . 0 0 "[ . 1 . 2]" 1
323 1 29 ASP H 1 29 ASP QB 2.270 . 2.740 2.264 2.229 2.298 . 0 0 "[ . 1 . 2]" 1
324 1 29 ASP H 1 29 ASP HB3 2.520 . 3.240 2.528 2.398 2.699 . 0 0 "[ . 1 . 2]" 1
325 1 29 ASP H 1 30 TRP H 2.350 . 2.900 2.551 2.435 2.723 . 0 0 "[ . 1 . 2]" 1
326 1 29 ASP H 1 31 ILE H 3.290 . 4.790 4.161 3.877 4.372 . 0 0 "[ . 1 . 2]" 1
327 1 29 ASP HA 1 32 LYS H 2.800 . 3.800 3.450 2.939 3.719 . 0 0 "[ . 1 . 2]" 1
328 1 29 ASP HA 1 32 LYS QB 2.920 . 4.050 2.894 2.252 4.215 0.165 2 0 "[ . 1 . 2]" 1
329 1 29 ASP HA 1 32 LYS QD 4.090 . 6.380 3.843 2.166 5.649 . 0 0 "[ . 1 . 2]" 1
330 1 29 ASP HA 1 32 LYS QE 4.090 . 6.380 3.609 1.783 6.416 0.036 3 0 "[ . 1 . 2]" 1
331 1 29 ASP HA 1 32 LYS HG2 3.650 . 5.500 4.504 2.447 5.573 0.073 8 0 "[ . 1 . 2]" 1
332 1 29 ASP QB 1 30 TRP H 2.710 . 3.620 2.571 2.463 2.807 . 0 0 "[ . 1 . 2]" 1
333 1 29 ASP HB2 1 30 TRP H 2.810 . 3.830 3.859 3.747 3.913 0.083 1 0 "[ . 1 . 2]" 1
334 1 29 ASP HB3 1 30 TRP H 2.810 . 3.830 2.612 2.492 2.878 . 0 0 "[ . 1 . 2]" 1
335 1 30 TRP H 1 30 TRP HB2 2.300 . 2.800 2.491 2.368 2.621 . 0 0 "[ . 1 . 2]" 1
336 1 30 TRP H 1 30 TRP HB3 2.310 . 2.830 2.563 2.408 2.697 . 0 0 "[ . 1 . 2]" 1
337 1 30 TRP H 1 30 TRP HD1 3.650 . 5.500 4.888 4.708 5.046 . 0 0 "[ . 1 . 2]" 1
338 1 30 TRP H 1 30 TRP HE3 3.650 . 5.500 4.780 4.514 4.999 . 0 0 "[ . 1 . 2]" 1
339 1 30 TRP H 1 31 ILE H 2.390 . 2.990 2.743 2.556 2.835 . 0 0 "[ . 1 . 2]" 1
340 1 30 TRP H 1 31 ILE HB 3.480 . 5.160 4.882 4.673 4.995 . 0 0 "[ . 1 . 2]" 1
341 1 30 TRP H 1 32 LYS H 3.200 . 4.600 4.194 3.981 4.438 . 0 0 "[ . 1 . 2]" 1
342 1 30 TRP HA 1 30 TRP HD1 3.650 . 5.500 3.068 2.951 3.151 . 0 0 "[ . 1 . 2]" 1
343 1 30 TRP HA 1 30 TRP HE1 3.650 . 5.500 5.025 4.911 5.120 . 0 0 "[ . 1 . 2]" 1
344 1 30 TRP HA 1 33 ARG HB3 2.670 . 3.550 2.920 2.449 3.560 0.010 13 0 "[ . 1 . 2]" 1
345 1 30 TRP HB2 1 31 ILE H 3.140 . 4.480 3.781 3.677 3.882 . 0 0 "[ . 1 . 2]" 1
346 1 30 TRP HB3 1 31 ILE H 2.750 . 3.700 2.453 2.345 2.607 . 0 0 "[ . 1 . 2]" 1
347 1 30 TRP HD1 1 34 VAL MG1 4.160 . 6.530 3.934 3.592 4.395 . 0 0 "[ . 1 . 2]" 1
348 1 30 TRP HE1 1 34 VAL MG1 2.720 . 3.640 3.207 2.849 3.657 0.017 5 0 "[ . 1 . 2]" 1
349 1 30 TRP HE1 1 34 VAL MG2 4.160 . 6.530 4.717 4.385 4.995 . 0 0 "[ . 1 . 2]" 1
350 1 30 TRP HE1 1 71 GLN HB2 3.650 . 5.500 4.925 4.414 5.516 0.016 7 0 "[ . 1 . 2]" 1
351 1 30 TRP HE1 1 71 GLN HB3 3.650 . 5.500 4.354 3.667 5.008 . 0 0 "[ . 1 . 2]" 1
352 1 30 TRP HE3 1 31 ILE H 3.040 . 4.290 3.013 2.750 3.256 . 0 0 "[ . 1 . 2]" 1
353 1 30 TRP HE3 1 31 ILE HA 3.550 . 5.310 2.906 2.680 3.134 . 0 0 "[ . 1 . 2]" 1
354 1 30 TRP HE3 1 31 ILE HB 3.650 . 5.500 4.478 4.212 4.860 . 0 0 "[ . 1 . 2]" 1
355 1 30 TRP HE3 1 31 ILE MD 3.590 . 5.380 3.806 3.469 4.235 . 0 0 "[ . 1 . 2]" 1
356 1 30 TRP HE3 1 31 ILE HG12 3.650 . 5.500 2.755 2.471 3.220 . 0 0 "[ . 1 . 2]" 1
357 1 30 TRP HE3 1 31 ILE QG 3.460 . 5.120 2.258 1.936 2.672 . 0 0 "[ . 1 . 2]" 1
358 1 30 TRP HE3 1 31 ILE HG13 3.650 . 5.500 2.407 2.007 2.926 . 0 0 "[ . 1 . 2]" 1
359 1 30 TRP HE3 1 37 GLY QA 4.090 . 6.380 5.582 5.073 6.079 . 0 0 "[ . 1 . 2]" 1
360 1 30 TRP HE3 1 39 ILE MD 4.160 . 6.530 3.039 2.781 3.275 . 0 0 "[ . 1 . 2]" 1
361 1 30 TRP HE3 1 39 ILE QG 4.090 . 6.380 3.734 3.450 3.955 . 0 0 "[ . 1 . 2]" 1
362 1 30 TRP HH2 1 34 VAL MG1 3.820 . 5.850 3.944 3.444 4.423 . 0 0 "[ . 1 . 2]" 1
363 1 30 TRP HH2 1 34 VAL MG2 4.160 . 6.530 3.344 3.237 3.537 . 0 0 "[ . 1 . 2]" 1
364 1 30 TRP HH2 1 38 VAL H 3.060 . 4.320 3.227 2.469 3.959 . 0 0 "[ . 1 . 2]" 1
365 1 30 TRP HH2 1 71 GLN QB 4.090 . 6.380 2.728 2.132 3.257 . 0 0 "[ . 1 . 2]" 1
366 1 30 TRP HH2 1 72 VAL HA 3.650 . 5.500 3.609 3.167 4.388 . 0 0 "[ . 1 . 2]" 1
367 1 30 TRP HH2 1 73 ALA H 3.310 . 4.820 3.536 3.246 3.926 . 0 0 "[ . 1 . 2]" 1
368 1 30 TRP HZ2 1 34 VAL MG1 3.510 . 5.230 3.056 2.746 3.316 . 0 0 "[ . 1 . 2]" 1
369 1 30 TRP HZ2 1 71 GLN HB2 3.650 . 5.500 2.722 2.212 3.284 . 0 0 "[ . 1 . 2]" 1
370 1 30 TRP HZ2 1 71 GLN QB 3.510 . 5.230 2.111 1.778 2.369 0.012 16 0 "[ . 1 . 2]" 1
371 1 30 TRP HZ2 1 71 GLN HB3 3.650 . 5.500 2.258 1.863 2.638 . 0 0 "[ . 1 . 2]" 1
372 1 30 TRP HZ2 1 73 ALA MB 3.480 . 5.160 3.051 2.504 3.758 . 0 0 "[ . 1 . 2]" 1
373 1 30 TRP HZ3 1 31 ILE MD 4.160 . 6.530 4.475 3.821 5.180 . 0 0 "[ . 1 . 2]" 1
374 1 30 TRP HZ3 1 39 ILE MD 3.510 . 5.230 2.098 1.796 3.433 . 0 0 "[ . 1 . 2]" 1
375 1 30 TRP HZ3 1 39 ILE QG 4.090 . 6.380 3.035 2.531 3.510 . 0 0 "[ . 1 . 2]" 1
376 1 30 TRP HZ3 1 73 ALA MB 4.160 . 6.530 3.273 2.854 4.053 . 0 0 "[ . 1 . 2]" 1
377 1 31 ILE H 1 31 ILE HB 2.240 . 2.680 2.518 2.469 2.561 . 0 0 "[ . 1 . 2]" 1
378 1 31 ILE H 1 31 ILE MD 2.920 . 4.050 3.458 3.344 3.551 . 0 0 "[ . 1 . 2]" 1
379 1 31 ILE H 1 31 ILE HG12 3.210 . 4.630 3.446 3.350 3.553 . 0 0 "[ . 1 . 2]" 1
380 1 31 ILE H 1 31 ILE QG 2.880 . 3.960 2.076 1.966 2.183 . 0 0 "[ . 1 . 2]" 1
381 1 31 ILE H 1 31 ILE HG13 3.210 . 4.630 2.093 1.979 2.204 . 0 0 "[ . 1 . 2]" 1
382 1 31 ILE H 1 31 ILE MG 3.250 . 4.700 3.763 3.748 3.774 . 0 0 "[ . 1 . 2]" 1
383 1 31 ILE H 1 32 LYS H 2.500 . 3.210 2.755 2.675 2.866 . 0 0 "[ . 1 . 2]" 1
384 1 31 ILE H 1 33 ARG H 3.000 . 4.200 3.992 3.868 4.221 0.021 16 0 "[ . 1 . 2]" 1
385 1 31 ILE HA 1 31 ILE MD 3.220 . 4.640 3.843 3.811 3.876 . 0 0 "[ . 1 . 2]" 1
386 1 31 ILE HA 1 34 VAL MG2 3.010 . 4.230 2.150 1.800 2.457 . 0 0 "[ . 1 . 2]" 1
387 1 31 ILE HA 1 35 GLY H 2.980 . 4.170 3.472 3.271 3.702 . 0 0 "[ . 1 . 2]" 1
388 1 31 ILE HB 1 32 LYS H 2.620 . 3.450 2.541 2.455 2.640 . 0 0 "[ . 1 . 2]" 1
389 1 31 ILE HB 1 98 PHE QE 3.650 . 5.500 5.031 4.839 5.293 . 0 0 "[ . 1 . 2]" 1
390 1 31 ILE MD 1 32 LYS H 4.160 . 6.530 4.466 4.350 4.579 . 0 0 "[ . 1 . 2]" 1
391 1 31 ILE MD 1 34 VAL MG2 4.680 . 7.560 4.879 4.567 5.197 . 0 0 "[ . 1 . 2]" 1
392 1 31 ILE MD 1 39 ILE MD 4.680 . 7.560 2.751 2.191 3.454 . 0 0 "[ . 1 . 2]" 1
393 1 31 ILE MD 1 39 ILE QG 3.800 . 5.800 3.406 2.633 4.265 . 0 0 "[ . 1 . 2]" 1
394 1 31 ILE MD 1 98 PHE H 4.160 . 6.530 6.128 5.711 6.555 0.025 3 0 "[ . 1 . 2]" 1
395 1 31 ILE MD 1 98 PHE QD 4.160 . 6.530 3.245 3.033 3.554 . 0 0 "[ . 1 . 2]" 1
396 1 31 ILE MD 1 98 PHE QE 4.160 . 6.530 2.695 2.499 2.833 . 0 0 "[ . 1 . 2]" 1
397 1 31 ILE MD 1 98 PHE HZ 4.160 . 6.530 2.877 2.580 3.192 . 0 0 "[ . 1 . 2]" 1
398 1 31 ILE QG 1 32 LYS H 3.460 . 5.120 4.023 3.945 4.083 . 0 0 "[ . 1 . 2]" 1
399 1 31 ILE QG 1 39 ILE MD 4.600 . 7.410 2.440 2.145 2.883 . 0 0 "[ . 1 . 2]" 1
400 1 31 ILE HG12 1 32 LYS H 3.650 . 5.500 4.988 4.934 5.020 . 0 0 "[ . 1 . 2]" 1
401 1 31 ILE HG13 1 32 LYS H 3.650 . 5.500 4.245 4.137 4.335 . 0 0 "[ . 1 . 2]" 1
402 1 31 ILE MG 1 32 LYS H 3.170 . 4.540 3.313 3.097 3.444 . 0 0 "[ . 1 . 2]" 1
403 1 31 ILE MG 1 32 LYS HA 3.700 . 5.600 3.344 3.055 3.605 . 0 0 "[ . 1 . 2]" 1
404 1 31 ILE MG 1 34 VAL MG2 4.680 . 7.560 3.372 3.039 3.735 . 0 0 "[ . 1 . 2]" 1
405 1 31 ILE MG 1 98 PHE HA 4.160 . 6.530 4.526 4.158 4.835 . 0 0 "[ . 1 . 2]" 1
406 1 31 ILE MG 1 98 PHE HB3 4.160 . 6.530 2.659 2.231 2.993 . 0 0 "[ . 1 . 2]" 1
407 1 31 ILE MG 1 98 PHE QD 4.160 . 6.530 2.601 2.309 2.869 . 0 0 "[ . 1 . 2]" 1
408 1 31 ILE MG 1 98 PHE QE 4.160 . 6.530 3.057 2.765 3.315 . 0 0 "[ . 1 . 2]" 1
409 1 31 ILE MG 1 101 GLY H 3.170 . 4.540 4.165 3.783 4.615 0.075 1 0 "[ . 1 . 2]" 1
410 1 31 ILE MG 1 101 GLY HA2 3.430 . 5.070 2.610 2.121 3.114 . 0 0 "[ . 1 . 2]" 1
411 1 31 ILE MG 1 101 GLY QA 3.300 . 4.810 2.566 2.086 3.050 . 0 0 "[ . 1 . 2]" 1
412 1 31 ILE MG 1 101 GLY HA3 3.430 . 5.070 3.809 3.085 4.367 . 0 0 "[ . 1 . 2]" 1
413 1 31 ILE MG 1 102 LYS H 3.570 . 5.350 4.540 4.014 5.304 . 0 0 "[ . 1 . 2]" 1
414 1 32 LYS H 1 32 LYS HA 2.360 . 2.930 2.814 2.757 2.847 . 0 0 "[ . 1 . 2]" 1
415 1 32 LYS H 1 32 LYS QB 2.570 . 3.340 2.269 2.047 2.663 . 0 0 "[ . 1 . 2]" 1
416 1 32 LYS H 1 32 LYS QD 3.840 . 5.880 4.039 3.140 4.642 . 0 0 "[ . 1 . 2]" 1
417 1 32 LYS H 1 32 LYS QE 4.090 . 6.380 4.756 3.618 6.076 . 0 0 "[ . 1 . 2]" 1
418 1 32 LYS H 1 32 LYS HG2 3.650 . 5.500 4.150 3.307 4.600 . 0 0 "[ . 1 . 2]" 1
419 1 32 LYS H 1 32 LYS HG3 3.650 . 5.500 3.929 1.957 4.604 . 0 0 "[ . 1 . 2]" 1
420 1 32 LYS H 1 33 ARG H 2.620 . 3.450 2.621 2.519 2.798 . 0 0 "[ . 1 . 2]" 1
421 1 32 LYS HA 1 32 LYS HD2 3.650 . 5.500 3.977 1.962 4.742 . 0 0 "[ . 1 . 2]" 1
422 1 32 LYS HA 1 32 LYS HD3 3.650 . 5.500 4.301 2.934 5.009 . 0 0 "[ . 1 . 2]" 1
423 1 32 LYS HA 1 32 LYS QE 4.090 . 6.380 4.775 3.978 5.365 . 0 0 "[ . 1 . 2]" 1
424 1 32 LYS HA 1 35 GLY QA 3.700 . 5.600 3.917 3.229 4.281 . 0 0 "[ . 1 . 2]" 1
425 1 32 LYS QB 1 32 LYS QE 4.350 . 6.910 3.026 1.730 3.796 0.060 10 0 "[ . 1 . 2]" 1
426 1 32 LYS QB 1 33 ARG H 2.960 . 4.120 3.073 2.611 3.713 . 0 0 "[ . 1 . 2]" 1
427 1 32 LYS QD 1 33 ARG H 3.020 . 4.240 3.228 2.247 4.378 0.138 3 0 "[ . 1 . 2]" 1
428 1 32 LYS HD2 1 32 LYS HG3 2.360 . 2.930 2.667 2.343 3.013 0.083 16 0 "[ . 1 . 2]" 1
429 1 32 LYS HD3 1 32 LYS HG3 2.360 . 2.930 2.788 2.383 3.011 0.081 20 0 "[ . 1 . 2]" 1
430 1 32 LYS QE 1 33 ARG H 4.090 . 6.380 4.272 2.597 5.912 . 0 0 "[ . 1 . 2]" 1
431 1 32 LYS HG2 1 33 ARG H 3.550 . 5.310 4.347 3.668 4.931 . 0 0 "[ . 1 . 2]" 1
432 1 32 LYS HG3 1 33 ARG H 3.290 . 4.790 4.389 2.484 5.378 0.588 8 1 "[ . + 1 . 2]" 1
433 1 33 ARG H 1 33 ARG HB2 2.190 . 2.590 2.462 2.013 2.638 0.048 14 0 "[ . 1 . 2]" 1
434 1 33 ARG H 1 33 ARG HB3 2.390 . 2.990 2.586 2.308 3.126 0.136 13 0 "[ . 1 . 2]" 1
435 1 33 ARG H 1 33 ARG QD 4.090 . 6.380 4.345 3.898 4.625 . 0 0 "[ . 1 . 2]" 1
436 1 33 ARG H 1 33 ARG QG 3.160 . 4.520 3.944 3.560 4.055 . 0 0 "[ . 1 . 2]" 1
437 1 33 ARG H 1 34 VAL H 2.310 . 2.830 2.490 2.426 2.637 . 0 0 "[ . 1 . 2]" 1
438 1 33 ARG H 1 34 VAL MG2 4.160 . 6.530 3.731 3.564 3.998 . 0 0 "[ . 1 . 2]" 1
439 1 33 ARG H 1 35 GLY H 2.870 . 3.950 3.927 3.762 4.016 0.066 17 0 "[ . 1 . 2]" 1
440 1 33 ARG HA 1 33 ARG HB2 2.420 . 3.050 2.529 2.393 2.829 . 0 0 "[ . 1 . 2]" 1
441 1 33 ARG HA 1 33 ARG HB3 2.420 . 3.050 3.006 2.857 3.022 . 0 0 "[ . 1 . 2]" 1
442 1 33 ARG HA 1 33 ARG QD 4.090 . 6.380 3.671 1.850 4.101 . 0 0 "[ . 1 . 2]" 1
443 1 33 ARG HA 1 33 ARG HG2 3.030 . 4.260 2.853 2.233 3.700 . 0 0 "[ . 1 . 2]" 1
444 1 33 ARG HA 1 33 ARG HG3 3.030 . 4.260 2.898 2.272 3.665 . 0 0 "[ . 1 . 2]" 1
445 1 33 ARG HB2 1 33 ARG QG 2.250 . 2.710 2.276 2.129 2.424 . 0 0 "[ . 1 . 2]" 1
446 1 33 ARG HB2 1 34 VAL H 2.670 . 3.550 3.662 3.229 3.785 0.235 17 0 "[ . 1 . 2]" 1
447 1 33 ARG HB3 1 34 VAL H 2.750 . 3.700 2.471 2.383 2.985 . 0 0 "[ . 1 . 2]" 1
448 1 33 ARG HD2 1 34 VAL H 3.650 . 5.500 5.146 3.942 5.574 0.074 13 0 "[ . 1 . 2]" 1
449 1 33 ARG HD3 1 34 VAL H 3.650 . 5.500 4.502 3.610 5.541 0.041 7 0 "[ . 1 . 2]" 1
450 1 33 ARG QG 1 34 VAL H 3.360 . 4.930 3.841 3.262 4.440 . 0 0 "[ . 1 . 2]" 1
451 1 33 ARG HG2 1 34 VAL H 3.650 . 5.500 4.127 3.344 4.955 . 0 0 "[ . 1 . 2]" 1
452 1 33 ARG HG3 1 34 VAL H 3.650 . 5.500 4.753 3.825 5.070 . 0 0 "[ . 1 . 2]" 1
453 1 34 VAL H 1 34 VAL MG1 2.610 . 3.430 2.357 2.204 2.497 . 0 0 "[ . 1 . 2]" 1
454 1 34 VAL H 1 34 VAL MG2 2.610 . 3.430 2.021 1.895 2.115 . 0 0 "[ . 1 . 2]" 1
455 1 34 VAL H 1 35 GLY H 2.500 . 3.210 2.464 2.331 2.624 . 0 0 "[ . 1 . 2]" 1
456 1 34 VAL HA 1 34 VAL HB 2.380 . 2.960 2.449 2.412 2.493 . 0 0 "[ . 1 . 2]" 1
457 1 34 VAL HA 1 71 GLN HE21 3.650 . 5.500 5.105 3.205 5.552 0.052 18 0 "[ . 1 . 2]" 1
458 1 34 VAL HA 1 71 GLN HE22 3.650 . 5.500 4.567 3.140 5.549 0.049 3 0 "[ . 1 . 2]" 1
459 1 34 VAL HB 1 35 GLY H 2.900 . 4.010 3.774 3.616 3.907 . 0 0 "[ . 1 . 2]" 1
460 1 34 VAL HB 1 36 ASP H 3.340 . 4.880 3.254 2.656 3.604 . 0 0 "[ . 1 . 2]" 1
461 1 34 VAL HB 1 36 ASP QB 3.500 . 5.200 4.709 3.907 5.187 . 0 0 "[ . 1 . 2]" 1
462 1 34 VAL HB 1 71 GLN HE21 3.650 . 5.500 3.983 2.498 5.159 . 0 0 "[ . 1 . 2]" 1
463 1 34 VAL HB 1 71 GLN HE22 3.650 . 5.500 3.882 1.882 5.444 . 0 0 "[ . 1 . 2]" 1
464 1 34 VAL HB 1 71 GLN HG2 3.650 . 5.500 4.430 2.344 5.561 0.061 6 0 "[ . 1 . 2]" 1
465 1 34 VAL HB 1 71 GLN QG 3.410 . 5.020 3.580 1.796 4.726 0.004 3 0 "[ . 1 . 2]" 1
466 1 34 VAL HB 1 71 GLN HG3 3.650 . 5.500 4.129 1.865 5.163 . 0 0 "[ . 1 . 2]" 1
467 1 34 VAL MG1 1 35 GLY H 3.590 . 5.380 3.938 3.888 3.976 . 0 0 "[ . 1 . 2]" 1
468 1 34 VAL MG1 1 36 ASP H 3.490 . 5.190 4.678 4.174 4.933 . 0 0 "[ . 1 . 2]" 1
469 1 34 VAL MG1 1 71 GLN H 4.160 . 6.530 4.801 4.278 5.463 . 0 0 "[ . 1 . 2]" 1
470 1 34 VAL MG1 1 71 GLN HB2 3.090 . 4.390 2.875 2.497 3.608 . 0 0 "[ . 1 . 2]" 1
471 1 34 VAL MG1 1 71 GLN HB3 3.090 . 4.390 3.505 2.912 4.241 . 0 0 "[ . 1 . 2]" 1
472 1 34 VAL MG1 1 71 GLN HE21 3.570 . 5.350 3.536 2.046 4.461 . 0 0 "[ . 1 . 2]" 1
473 1 34 VAL MG1 1 71 GLN QE 3.450 . 5.110 2.992 1.991 4.029 . 0 0 "[ . 1 . 2]" 1
474 1 34 VAL MG1 1 71 GLN HE22 3.570 . 5.350 3.407 2.142 4.812 . 0 0 "[ . 1 . 2]" 1
475 1 34 VAL MG1 1 71 GLN QG 3.690 . 5.580 3.045 1.983 4.090 . 0 0 "[ . 1 . 2]" 1
476 1 34 VAL MG2 1 35 GLY H 2.660 . 3.520 2.127 1.973 2.289 . 0 0 "[ . 1 . 2]" 1
477 1 34 VAL MG2 1 35 GLY QA 4.600 . 7.410 3.396 3.347 3.478 . 0 0 "[ . 1 . 2]" 1
478 1 34 VAL MG2 1 36 ASP H 2.920 . 4.050 2.837 2.163 3.102 . 0 0 "[ . 1 . 2]" 1
479 1 34 VAL MG2 1 37 GLY HA2 4.160 . 6.530 4.511 4.075 5.095 . 0 0 "[ . 1 . 2]" 1
480 1 34 VAL MG2 1 37 GLY QA 3.940 . 6.080 3.136 2.830 3.641 . 0 0 "[ . 1 . 2]" 1
481 1 34 VAL MG2 1 37 GLY HA3 4.160 . 6.530 3.200 2.887 3.729 . 0 0 "[ . 1 . 2]" 1
482 1 34 VAL MG2 1 71 GLN HB2 3.590 . 5.380 3.289 2.817 3.709 . 0 0 "[ . 1 . 2]" 1
483 1 34 VAL MG2 1 71 GLN QB 3.450 . 5.110 3.210 2.763 3.619 . 0 0 "[ . 1 . 2]" 1
484 1 34 VAL MG2 1 71 GLN HB3 3.590 . 5.380 4.499 3.980 5.043 . 0 0 "[ . 1 . 2]" 1
485 1 34 VAL MG2 1 71 GLN QE 4.600 . 7.400 4.334 3.070 5.564 . 0 0 "[ . 1 . 2]" 1
486 1 35 GLY H 1 36 ASP H 2.550 . 3.300 3.368 2.779 3.446 0.146 19 0 "[ . 1 . 2]" 1
487 1 35 GLY H 1 101 GLY H 3.280 . 4.760 4.806 4.616 4.889 0.129 20 0 "[ . 1 . 2]" 1
488 1 35 GLY QA 1 101 GLY H 2.670 . 3.540 2.717 2.493 2.993 . 0 0 "[ . 1 . 2]" 1
489 1 35 GLY QA 1 101 GLY QA 3.790 . 5.790 2.430 1.828 2.969 . 0 0 "[ . 1 . 2]" 1
490 1 35 GLY HA2 1 36 ASP H 2.640 . 3.490 3.526 3.413 3.539 0.049 15 0 "[ . 1 . 2]" 1
491 1 35 GLY HA2 1 101 GLY H 2.900 . 4.010 2.806 2.578 3.088 . 0 0 "[ . 1 . 2]" 1
492 1 35 GLY HA3 1 36 ASP H 2.640 . 3.490 2.654 2.554 3.096 . 0 0 "[ . 1 . 2]" 1
493 1 35 GLY HA3 1 101 GLY H 2.900 . 4.010 3.647 3.309 4.034 0.024 5 0 "[ . 1 . 2]" 1
494 1 36 ASP H 1 36 ASP HB2 2.690 . 3.580 2.733 2.608 3.153 . 0 0 "[ . 1 . 2]" 1
495 1 36 ASP H 1 36 ASP HB3 2.690 . 3.580 3.653 2.570 3.782 0.202 10 0 "[ . 1 . 2]" 1
496 1 36 ASP H 1 37 GLY H 3.340 . 4.880 4.340 4.096 4.460 . 0 0 "[ . 1 . 2]" 1
497 1 36 ASP HA 1 37 GLY H 2.300 . 2.800 2.203 2.157 2.330 . 0 0 "[ . 1 . 2]" 1
498 1 36 ASP HA 1 37 GLY QA 3.310 . 4.830 3.929 3.907 3.999 . 0 0 "[ . 1 . 2]" 1
499 1 36 ASP HA 1 99 THR MG 3.930 . 6.060 3.382 2.913 3.938 . 0 0 "[ . 1 . 2]" 1
500 1 36 ASP HA 1 100 ASP H 2.920 . 4.040 3.456 2.874 4.037 . 0 0 "[ . 1 . 2]" 1
501 1 36 ASP QB 1 37 GLY H 3.050 . 4.310 3.189 2.864 3.783 . 0 0 "[ . 1 . 2]" 1
502 1 36 ASP QB 1 70 TRP H 4.090 . 6.380 4.865 4.373 6.038 . 0 0 "[ . 1 . 2]" 1
503 1 36 ASP QB 1 70 TRP HA 4.090 . 6.380 3.263 2.805 3.826 . 0 0 "[ . 1 . 2]" 1
504 1 36 ASP QB 1 70 TRP QB 3.840 . 5.880 4.524 3.967 4.892 . 0 0 "[ . 1 . 2]" 1
505 1 36 ASP HB2 1 37 GLY H 3.320 . 4.850 4.081 3.739 4.336 . 0 0 "[ . 1 . 2]" 1
506 1 36 ASP HB2 1 70 TRP HB2 4.240 . 6.690 6.283 5.767 6.967 0.277 5 0 "[ . 1 . 2]" 1
507 1 36 ASP HB2 1 70 TRP HB3 4.240 . 6.690 5.581 4.890 6.164 . 0 0 "[ . 1 . 2]" 1
508 1 36 ASP HB3 1 37 GLY H 3.320 . 4.850 3.343 2.974 4.262 . 0 0 "[ . 1 . 2]" 1
509 1 36 ASP HB3 1 70 TRP HB2 4.240 . 6.690 6.151 5.535 6.710 0.020 16 0 "[ . 1 . 2]" 1
510 1 36 ASP HB3 1 70 TRP HB3 4.240 . 6.690 5.280 4.493 5.829 . 0 0 "[ . 1 . 2]" 1
511 1 37 GLY H 1 38 VAL H 3.370 . 4.940 4.384 4.364 4.457 . 0 0 "[ . 1 . 2]" 1
512 1 37 GLY H 1 70 TRP HE3 3.100 . 4.410 3.443 2.691 4.012 . 0 0 "[ . 1 . 2]" 1
513 1 37 GLY H 1 98 PHE H 2.830 . 3.860 3.385 3.214 3.659 . 0 0 "[ . 1 . 2]" 1
514 1 37 GLY H 1 98 PHE HB2 2.980 . 4.170 3.228 2.780 4.161 . 0 0 "[ . 1 . 2]" 1
515 1 37 GLY H 1 98 PHE HB3 3.380 . 4.970 3.685 3.242 4.645 . 0 0 "[ . 1 . 2]" 1
516 1 37 GLY H 1 99 THR MG 3.460 . 5.130 3.803 3.147 4.903 . 0 0 "[ . 1 . 2]" 1
517 1 37 GLY QA 1 38 VAL H 2.500 . 3.210 2.269 2.234 2.290 . 0 0 "[ . 1 . 2]" 1
518 1 37 GLY QA 1 38 VAL QG 5.380 . 8.970 2.997 2.964 3.019 . 0 0 "[ . 1 . 2]" 1
519 1 37 GLY QA 1 70 TRP H 4.090 . 6.380 5.203 4.861 5.792 . 0 0 "[ . 1 . 2]" 1
520 1 37 GLY QA 1 70 TRP HA 3.480 . 5.170 2.785 2.326 3.405 . 0 0 "[ . 1 . 2]" 1
521 1 37 GLY QA 1 70 TRP QB 4.060 . 6.320 2.622 1.763 3.194 0.037 18 0 "[ . 1 . 2]" 1
522 1 37 GLY QA 1 70 TRP HE3 3.450 . 5.100 2.466 2.081 2.975 . 0 0 "[ . 1 . 2]" 1
523 1 37 GLY QA 1 71 GLN H 2.470 . 3.150 2.110 1.772 2.403 0.018 14 0 "[ . 1 . 2]" 1
524 1 37 GLY HA2 1 38 VAL H 2.620 . 3.450 2.551 2.388 2.694 . 0 0 "[ . 1 . 2]" 1
525 1 37 GLY HA2 1 70 TRP HB2 4.520 . 7.250 4.280 2.933 4.950 . 0 0 "[ . 1 . 2]" 1
526 1 37 GLY HA2 1 70 TRP HB3 4.520 . 7.250 2.679 1.784 3.295 0.006 18 0 "[ . 1 . 2]" 1
527 1 37 GLY HA2 1 70 TRP HE3 3.650 . 5.500 2.489 2.094 3.021 . 0 0 "[ . 1 . 2]" 1
528 1 37 GLY HA2 1 71 GLN H 2.610 . 3.420 2.236 1.798 2.615 0.002 14 0 "[ . 1 . 2]" 1
529 1 37 GLY HA3 1 38 VAL H 2.620 . 3.450 2.555 2.437 2.688 . 0 0 "[ . 1 . 2]" 1
530 1 37 GLY HA3 1 70 TRP HB2 4.520 . 7.250 5.846 4.613 6.591 . 0 0 "[ . 1 . 2]" 1
531 1 37 GLY HA3 1 70 TRP HB3 4.520 . 7.250 4.318 3.405 4.996 . 0 0 "[ . 1 . 2]" 1
532 1 37 GLY HA3 1 70 TRP HE3 3.650 . 5.500 4.043 3.644 4.484 . 0 0 "[ . 1 . 2]" 1
533 1 37 GLY HA3 1 71 GLN H 2.610 . 3.420 2.718 2.299 3.225 . 0 0 "[ . 1 . 2]" 1
534 1 38 VAL H 1 38 VAL QG 2.940 . 4.090 2.175 2.137 2.235 . 0 0 "[ . 1 . 2]" 1
535 1 38 VAL H 1 71 GLN H 3.520 . 5.250 3.669 3.200 4.120 . 0 0 "[ . 1 . 2]" 1
536 1 38 VAL H 1 72 VAL HA 2.810 . 3.830 2.850 2.549 3.061 . 0 0 "[ . 1 . 2]" 1
537 1 38 VAL H 1 72 VAL MG2 4.160 . 6.530 3.815 3.283 4.369 . 0 0 "[ . 1 . 2]" 1
538 1 38 VAL H 1 73 ALA H 2.870 . 3.950 3.827 3.465 3.967 0.017 3 0 "[ . 1 . 2]" 1
539 1 38 VAL H 1 98 PHE HB2 3.650 . 5.500 5.065 4.814 5.336 . 0 0 "[ . 1 . 2]" 1
540 1 38 VAL HA 1 39 ILE H 2.310 . 2.830 2.170 2.135 2.214 . 0 0 "[ . 1 . 2]" 1
541 1 38 VAL HA 1 39 ILE MD 4.160 . 6.530 2.951 2.667 4.811 . 0 0 "[ . 1 . 2]" 1
542 1 38 VAL HA 1 97 VAL HA 2.860 . 3.920 3.180 2.799 3.617 . 0 0 "[ . 1 . 2]" 1
543 1 38 VAL HA 1 98 PHE H 3.040 . 4.290 3.097 2.894 3.504 . 0 0 "[ . 1 . 2]" 1
544 1 38 VAL HB 1 39 ILE H 2.720 . 3.640 3.018 2.855 3.253 . 0 0 "[ . 1 . 2]" 1
545 1 38 VAL HB 1 95 THR MG 3.140 . 4.480 2.043 1.855 2.269 . 0 0 "[ . 1 . 2]" 1
546 1 38 VAL HB 1 97 VAL MG2 4.160 . 6.530 4.387 3.910 4.872 . 0 0 "[ . 1 . 2]" 1
547 1 38 VAL QG 1 39 ILE H 3.580 . 5.370 3.412 3.357 3.490 . 0 0 "[ . 1 . 2]" 1
548 1 38 VAL QG 1 40 LEU HG 4.940 . 8.090 3.622 3.265 4.888 . 0 0 "[ . 1 . 2]" 1
549 1 38 VAL QG 1 62 LEU QD 5.130 . 8.470 2.169 1.739 3.314 0.051 7 0 "[ . 1 . 2]" 1
550 1 38 VAL QG 1 72 VAL H 4.940 . 8.090 4.377 4.008 4.750 . 0 0 "[ . 1 . 2]" 1
551 1 38 VAL QG 1 72 VAL HA 3.810 . 5.830 2.426 2.039 2.742 . 0 0 "[ . 1 . 2]" 1
552 1 38 VAL QG 1 72 VAL MG1 4.280 . 6.760 2.134 1.832 2.458 . 0 0 "[ . 1 . 2]" 1
553 1 38 VAL QG 1 72 VAL MG2 3.900 . 6.000 2.174 1.895 2.784 . 0 0 "[ . 1 . 2]" 1
554 1 38 VAL QG 1 73 ALA H 4.940 . 8.090 3.412 3.069 3.677 . 0 0 "[ . 1 . 2]" 1
555 1 38 VAL QG 1 95 THR MG 4.070 . 6.350 2.401 2.271 2.563 . 0 0 "[ . 1 . 2]" 1
556 1 38 VAL QG 1 97 VAL HA 4.310 . 6.820 2.193 1.930 2.502 . 0 0 "[ . 1 . 2]" 1
557 1 38 VAL QG 1 98 PHE H 4.340 . 6.880 3.113 2.894 3.318 . 0 0 "[ . 1 . 2]" 1
558 1 38 VAL MG1 1 39 ILE H 4.110 . 6.430 3.732 3.647 3.783 . 0 0 "[ . 1 . 2]" 1
559 1 38 VAL MG1 1 62 LEU MD1 6.160 . 10.520 3.167 2.020 5.659 . 0 0 "[ . 1 . 2]" 1
560 1 38 VAL MG1 1 62 LEU MD2 6.160 . 10.520 3.452 1.861 6.206 . 0 0 "[ . 1 . 2]" 1
561 1 38 VAL MG1 1 70 TRP HE3 4.040 . 6.280 2.177 1.950 2.460 . 0 0 "[ . 1 . 2]" 1
562 1 38 VAL MG1 1 72 VAL HA 4.160 . 6.530 4.805 4.667 4.921 . 0 0 "[ . 1 . 2]" 1
563 1 38 VAL MG1 1 72 VAL MG1 4.680 . 7.560 4.622 4.424 4.869 . 0 0 "[ . 1 . 2]" 1
564 1 38 VAL MG1 1 72 VAL MG2 4.150 . 6.500 4.183 3.986 4.645 . 0 0 "[ . 1 . 2]" 1
565 1 38 VAL MG1 1 95 THR MG 4.400 . 7.000 2.555 2.412 2.808 . 0 0 "[ . 1 . 2]" 1
566 1 38 VAL MG2 1 39 ILE H 4.110 . 6.430 3.953 3.825 4.108 . 0 0 "[ . 1 . 2]" 1
567 1 38 VAL MG2 1 62 LEU MD1 6.160 . 10.520 2.770 1.906 4.691 . 0 0 "[ . 1 . 2]" 1
568 1 38 VAL MG2 1 62 LEU MD2 6.160 . 10.520 2.886 1.957 5.386 . 0 0 "[ . 1 . 2]" 1
569 1 38 VAL MG2 1 70 TRP HE3 4.040 . 6.280 3.315 2.910 4.045 . 0 0 "[ . 1 . 2]" 1
570 1 38 VAL MG2 1 72 VAL HA 4.160 . 6.530 2.434 2.042 2.756 . 0 0 "[ . 1 . 2]" 1
571 1 38 VAL MG2 1 72 VAL MG1 4.680 . 7.560 2.138 1.834 2.466 . 0 0 "[ . 1 . 2]" 1
572 1 38 VAL MG2 1 72 VAL MG2 4.150 . 6.500 2.182 1.898 2.806 . 0 0 "[ . 1 . 2]" 1
573 1 38 VAL MG2 1 95 THR MG 4.400 . 7.000 2.931 2.764 3.155 . 0 0 "[ . 1 . 2]" 1
574 1 39 ILE H 1 39 ILE HB 2.480 . 3.170 2.538 2.466 2.626 . 0 0 "[ . 1 . 2]" 1
575 1 39 ILE H 1 39 ILE MD 3.460 . 5.130 2.409 2.122 3.716 . 0 0 "[ . 1 . 2]" 1
576 1 39 ILE H 1 39 ILE HG12 3.650 . 5.500 4.316 4.059 4.413 . 0 0 "[ . 1 . 2]" 1
577 1 39 ILE H 1 39 ILE HG13 3.650 . 5.500 3.765 2.764 4.075 . 0 0 "[ . 1 . 2]" 1
578 1 39 ILE H 1 40 LEU H 3.400 . 5.000 4.377 4.314 4.429 . 0 0 "[ . 1 . 2]" 1
579 1 39 ILE H 1 95 THR MG 3.180 . 4.570 3.376 3.192 3.703 . 0 0 "[ . 1 . 2]" 1
580 1 39 ILE H 1 96 LEU H 2.750 . 3.700 2.820 2.536 3.058 . 0 0 "[ . 1 . 2]" 1
581 1 39 ILE H 1 98 PHE QE 3.650 . 5.500 4.745 3.997 5.260 . 0 0 "[ . 1 . 2]" 1
582 1 39 ILE HA 1 40 LEU H 2.270 . 2.740 2.152 2.134 2.195 . 0 0 "[ . 1 . 2]" 1
583 1 39 ILE HA 1 73 ALA MB 3.370 . 4.950 2.803 2.547 3.183 . 0 0 "[ . 1 . 2]" 1
584 1 39 ILE HB 1 39 ILE MD 2.720 . 3.640 2.341 2.310 2.386 . 0 0 "[ . 1 . 2]" 1
585 1 39 ILE HB 1 40 LEU H 3.180 . 4.570 4.263 4.127 4.364 . 0 0 "[ . 1 . 2]" 1
586 1 39 ILE MD 1 73 ALA H 3.990 . 6.190 4.210 3.554 5.504 . 0 0 "[ . 1 . 2]" 1
587 1 39 ILE MD 1 73 ALA MB 4.540 . 7.280 3.304 2.813 3.934 . 0 0 "[ . 1 . 2]" 1
588 1 39 ILE MD 1 87 PHE HE2 3.590 . 5.380 4.187 2.397 5.419 0.039 20 0 "[ . 1 . 2]" 1
589 1 39 ILE MD 1 98 PHE QD 3.840 . 5.880 2.127 1.904 2.711 . 0 0 "[ . 1 . 2]" 1
590 1 39 ILE MD 1 98 PHE QE 4.080 . 6.370 2.587 1.975 2.850 . 0 0 "[ . 1 . 2]" 1
591 1 39 ILE MD 1 98 PHE HZ 3.770 . 5.750 4.459 3.737 4.798 . 0 0 "[ . 1 . 2]" 1
592 1 39 ILE QG 1 40 LEU H 4.090 . 6.380 4.067 3.881 4.210 . 0 0 "[ . 1 . 2]" 1
593 1 39 ILE QG 1 73 ALA MB 4.600 . 7.410 2.028 1.767 2.739 0.023 7 0 "[ . 1 . 2]" 1
594 1 39 ILE QG 1 87 PHE HE2 4.090 . 6.380 4.097 3.295 5.104 . 0 0 "[ . 1 . 2]" 1
595 1 39 ILE MG 1 40 LEU H 2.840 . 3.890 2.717 2.531 2.974 . 0 0 "[ . 1 . 2]" 1
596 1 39 ILE MG 1 40 LEU HA 4.160 . 6.530 3.725 3.606 3.877 . 0 0 "[ . 1 . 2]" 1
597 1 39 ILE MG 1 41 LEU HA 3.790 . 5.780 3.736 3.448 4.040 . 0 0 "[ . 1 . 2]" 1
598 1 39 ILE MG 1 41 LEU MD2 4.160 . 6.530 2.778 2.401 3.410 . 0 0 "[ . 1 . 2]" 1
599 1 39 ILE MG 1 41 LEU HG 3.630 . 5.470 3.649 3.293 4.233 . 0 0 "[ . 1 . 2]" 1
600 1 39 ILE MG 1 73 ALA MB 4.680 . 7.560 3.091 2.642 3.600 . 0 0 "[ . 1 . 2]" 1
601 1 39 ILE MG 1 75 ALA MB 4.680 . 7.560 3.145 2.273 3.685 . 0 0 "[ . 1 . 2]" 1
602 1 39 ILE MG 1 96 LEU QB 4.160 . 6.530 3.434 3.107 3.823 . 0 0 "[ . 1 . 2]" 1
603 1 39 ILE MG 1 96 LEU HG 3.320 . 4.850 4.037 3.575 4.593 . 0 0 "[ . 1 . 2]" 1
604 1 40 LEU H 1 40 LEU HB2 2.810 . 3.830 2.467 2.352 2.538 . 0 0 "[ . 1 . 2]" 1
605 1 40 LEU H 1 40 LEU QB 2.690 . 3.590 2.430 2.322 2.494 . 0 0 "[ . 1 . 2]" 1
606 1 40 LEU H 1 40 LEU HB3 2.810 . 3.830 3.648 3.584 3.692 . 0 0 "[ . 1 . 2]" 1
607 1 40 LEU H 1 40 LEU MD1 3.820 . 5.850 3.921 3.804 4.067 . 0 0 "[ . 1 . 2]" 1
608 1 40 LEU H 1 40 LEU MD2 3.260 . 4.730 3.477 2.612 3.845 . 0 0 "[ . 1 . 2]" 1
609 1 40 LEU H 1 40 LEU HG 3.150 . 4.510 2.823 2.529 4.338 . 0 0 "[ . 1 . 2]" 1
610 1 40 LEU H 1 41 LEU H 3.180 . 4.570 4.435 4.320 4.519 . 0 0 "[ . 1 . 2]" 1
611 1 40 LEU H 1 74 VAL HA 2.580 . 3.360 2.780 2.350 3.122 . 0 0 "[ . 1 . 2]" 1
612 1 40 LEU H 1 74 VAL MG1 3.490 . 5.190 3.409 2.951 3.866 . 0 0 "[ . 1 . 2]" 1
613 1 40 LEU H 1 95 THR MG 4.100 . 6.400 4.511 3.936 5.020 . 0 0 "[ . 1 . 2]" 1
614 1 40 LEU HA 1 40 LEU MD1 3.540 . 5.290 3.734 1.862 3.861 . 0 0 "[ . 1 . 2]" 1
615 1 40 LEU HA 1 40 LEU MD2 4.040 . 6.280 2.019 1.854 2.687 . 0 0 "[ . 1 . 2]" 1
616 1 40 LEU HA 1 41 LEU H 2.530 . 3.270 2.161 2.139 2.189 . 0 0 "[ . 1 . 2]" 1
617 1 40 LEU HA 1 95 THR HA 2.640 . 3.490 2.821 2.555 3.108 . 0 0 "[ . 1 . 2]" 1
618 1 40 LEU QB 1 41 LEU H 3.040 . 4.280 3.226 3.053 3.435 . 0 0 "[ . 1 . 2]" 1
619 1 40 LEU QB 1 74 VAL MG1 3.310 . 4.820 1.980 1.772 2.461 0.028 17 0 "[ . 1 . 2]" 1
620 1 40 LEU QB 1 74 VAL MG2 4.460 . 7.130 4.393 1.982 4.815 . 0 0 "[ . 1 . 2]" 1
621 1 40 LEU HB2 1 41 LEU H 3.260 . 4.720 4.245 4.135 4.370 . 0 0 "[ . 1 . 2]" 1
622 1 40 LEU HB2 1 74 VAL MG1 3.590 . 5.380 2.000 1.784 2.500 0.016 15 0 "[ . 1 . 2]" 1
623 1 40 LEU HB3 1 41 LEU H 3.260 . 4.720 3.345 3.145 3.598 . 0 0 "[ . 1 . 2]" 1
624 1 40 LEU HB3 1 74 VAL MG1 3.590 . 5.380 3.250 2.792 3.669 . 0 0 "[ . 1 . 2]" 1
625 1 40 LEU MD1 1 41 LEU H 4.160 . 6.530 4.945 3.142 5.200 . 0 0 "[ . 1 . 2]" 1
626 1 40 LEU MD1 1 55 PRO HA 3.540 . 5.290 3.683 1.816 4.701 . 0 0 "[ . 1 . 2]" 1
627 1 40 LEU MD1 1 55 PRO HB2 3.630 . 5.470 3.102 2.213 5.288 . 0 0 "[ . 1 . 2]" 1
628 1 40 LEU MD1 1 55 PRO HB3 4.050 . 6.310 2.781 1.747 4.221 0.043 3 0 "[ . 1 . 2]" 1
629 1 40 LEU MD1 1 55 PRO HG2 3.800 . 5.810 4.135 2.032 5.837 0.027 11 0 "[ . 1 . 2]" 1
630 1 40 LEU MD1 1 55 PRO HG3 3.800 . 5.810 3.839 2.250 5.470 . 0 0 "[ . 1 . 2]" 1
631 1 40 LEU MD1 1 58 ILE HB 3.180 . 4.570 3.533 2.595 4.553 . 0 0 "[ . 1 . 2]" 1
632 1 40 LEU MD1 1 58 ILE MD 4.500 . 7.210 3.626 2.005 4.827 . 0 0 "[ . 1 . 2]" 1
633 1 40 LEU MD1 1 72 VAL MG1 4.680 . 7.560 2.656 2.269 4.222 . 0 0 "[ . 1 . 2]" 1
634 1 40 LEU MD1 1 74 VAL HA 4.160 . 6.530 4.469 3.723 5.368 . 0 0 "[ . 1 . 2]" 1
635 1 40 LEU MD1 1 74 VAL MG1 4.680 . 7.560 2.630 1.767 4.212 0.033 8 0 "[ . 1 . 2]" 1
636 1 40 LEU MD2 1 41 LEU H 4.160 . 6.530 3.631 3.249 4.570 . 0 0 "[ . 1 . 2]" 1
637 1 40 LEU MD2 1 55 PRO HA 4.160 . 6.530 4.626 2.534 5.631 . 0 0 "[ . 1 . 2]" 1
638 1 40 LEU MD2 1 58 ILE HB 3.490 . 5.190 3.718 2.922 4.283 . 0 0 "[ . 1 . 2]" 1
639 1 40 LEU MD2 1 58 ILE QG 3.530 . 5.270 2.432 1.786 3.848 0.004 16 0 "[ . 1 . 2]" 1
640 1 40 LEU MD2 1 72 VAL MG1 4.020 . 6.250 3.358 1.948 3.779 . 0 0 "[ . 1 . 2]" 1
641 1 40 LEU MD2 1 74 VAL HA 4.160 . 6.530 5.250 4.273 5.584 . 0 0 "[ . 1 . 2]" 1
642 1 40 LEU MD2 1 94 ALA HA 4.160 . 6.530 5.347 4.940 6.204 . 0 0 "[ . 1 . 2]" 1
643 1 40 LEU MD2 1 95 THR H 3.820 . 5.850 4.422 4.078 5.258 . 0 0 "[ . 1 . 2]" 1
644 1 40 LEU MD2 1 95 THR HA 3.990 . 6.190 2.666 2.231 3.175 . 0 0 "[ . 1 . 2]" 1
645 1 40 LEU MD2 1 95 THR HB 3.490 . 5.190 3.948 3.794 4.564 . 0 0 "[ . 1 . 2]" 1
646 1 40 LEU HG 1 72 VAL MG1 4.160 . 6.530 2.619 2.254 3.648 . 0 0 "[ . 1 . 2]" 1
647 1 40 LEU HG 1 74 VAL MG1 4.160 . 6.530 3.525 2.936 4.177 . 0 0 "[ . 1 . 2]" 1
648 1 41 LEU H 1 41 LEU HB3 2.830 . 3.860 3.616 3.556 3.657 . 0 0 "[ . 1 . 2]" 1
649 1 41 LEU H 1 41 LEU MD1 4.100 . 6.400 3.764 3.622 3.925 . 0 0 "[ . 1 . 2]" 1
650 1 41 LEU H 1 41 LEU MD2 3.760 . 5.720 3.464 3.182 3.722 . 0 0 "[ . 1 . 2]" 1
651 1 41 LEU H 1 41 LEU HG 3.200 . 4.600 2.540 2.226 2.879 . 0 0 "[ . 1 . 2]" 1
652 1 41 LEU H 1 94 ALA H 2.700 . 3.610 3.591 3.064 3.788 0.178 13 0 "[ . 1 . 2]" 1
653 1 41 LEU H 1 95 THR HA 2.870 . 3.950 3.650 3.111 3.995 0.045 6 0 "[ . 1 . 2]" 1
654 1 41 LEU HA 1 41 LEU MD1 4.160 . 6.530 3.846 3.795 3.892 . 0 0 "[ . 1 . 2]" 1
655 1 41 LEU HA 1 41 LEU MD2 3.200 . 4.610 1.988 1.830 2.098 . 0 0 "[ . 1 . 2]" 1
656 1 41 LEU HA 1 42 SER H 2.350 . 2.900 2.409 2.250 2.811 . 0 0 "[ . 1 . 2]" 1
657 1 41 LEU HB2 1 42 SER H 2.730 . 3.670 3.596 2.985 3.781 0.111 14 0 "[ . 1 . 2]" 1
658 1 41 LEU HB2 1 42 SER QB 3.850 . 5.910 5.124 4.668 5.790 . 0 0 "[ . 1 . 2]" 1
659 1 41 LEU HB2 1 80 SER QB 4.090 . 6.380 4.419 3.655 5.613 . 0 0 "[ . 1 . 2]" 1
660 1 41 LEU HB2 1 89 VAL QG 4.890 . 7.990 5.158 4.114 6.867 . 0 0 "[ . 1 . 2]" 1
661 1 41 LEU HB3 1 80 SER HA 3.650 . 5.500 4.396 3.576 5.517 0.017 4 0 "[ . 1 . 2]" 1
662 1 41 LEU HB3 1 94 ALA H 3.170 . 4.540 4.006 3.164 4.593 0.053 17 0 "[ . 1 . 2]" 1
663 1 41 LEU MD1 1 83 ILE HB 4.160 . 6.530 4.597 3.853 5.585 . 0 0 "[ . 1 . 2]" 1
664 1 41 LEU MD1 1 84 GLY H 3.230 . 4.670 3.975 3.419 4.702 0.032 4 0 "[ . 1 . 2]" 1
665 1 41 LEU MD1 1 84 GLY HA2 3.730 . 5.660 3.056 2.582 3.672 . 0 0 "[ . 1 . 2]" 1
666 1 41 LEU MD1 1 84 GLY HA3 3.710 . 5.630 3.191 2.683 3.865 . 0 0 "[ . 1 . 2]" 1
667 1 41 LEU MD1 1 89 VAL HB 4.160 . 6.530 3.548 2.408 5.090 . 0 0 "[ . 1 . 2]" 1
668 1 41 LEU MD1 1 89 VAL QG 5.350 . 8.900 2.621 1.802 3.965 . 0 0 "[ . 1 . 2]" 1
669 1 41 LEU MD1 1 94 ALA H 3.790 . 5.780 2.487 1.777 3.915 0.023 2 0 "[ . 1 . 2]" 1
670 1 41 LEU MD1 1 94 ALA MB 4.680 . 7.560 2.878 1.928 4.329 . 0 0 "[ . 1 . 2]" 1
671 1 41 LEU MD1 1 96 LEU QD 4.510 . 7.230 2.376 2.031 2.999 . 0 0 "[ . 1 . 2]" 1
672 1 41 LEU MD2 1 42 SER H 3.450 . 5.100 3.355 2.891 3.604 . 0 0 "[ . 1 . 2]" 1
673 1 41 LEU MD2 1 75 ALA MB 4.680 . 7.560 2.907 1.984 4.136 . 0 0 "[ . 1 . 2]" 1
674 1 41 LEU MD2 1 80 SER HA 3.400 . 5.010 2.640 1.807 3.633 . 0 0 "[ . 1 . 2]" 1
675 1 41 LEU MD2 1 83 ILE HB 4.010 . 6.220 2.759 2.324 3.411 . 0 0 "[ . 1 . 2]" 1
676 1 41 LEU MD2 1 84 GLY HA3 3.090 . 4.390 3.645 2.604 4.377 . 0 0 "[ . 1 . 2]" 1
677 1 41 LEU MD2 1 89 VAL QG 5.460 . 9.120 4.003 2.825 4.856 . 0 0 "[ . 1 . 2]" 1
678 1 41 LEU MD2 1 96 LEU QD 4.580 . 7.360 2.504 2.001 3.006 . 0 0 "[ . 1 . 2]" 1
679 1 42 SER H 1 42 SER HB2 2.900 . 4.010 2.632 2.359 3.546 . 0 0 "[ . 1 . 2]" 1
680 1 42 SER H 1 42 SER QB 2.670 . 3.550 2.269 2.002 2.536 . 0 0 "[ . 1 . 2]" 1
681 1 42 SER H 1 42 SER HB3 2.900 . 4.010 2.597 2.020 3.652 . 0 0 "[ . 1 . 2]" 1
682 1 42 SER H 1 75 ALA MB 4.160 . 6.530 3.487 2.713 5.256 . 0 0 "[ . 1 . 2]" 1
683 1 42 SER H 1 80 SER QB 4.090 . 6.380 2.318 1.985 2.694 . 0 0 "[ . 1 . 2]" 1
684 1 42 SER HA 1 75 ALA MB 3.900 . 6.000 4.829 3.328 5.377 . 0 0 "[ . 1 . 2]" 1
685 1 42 SER QB 1 77 LEU MD2 4.600 . 7.410 4.267 2.131 6.889 . 0 0 "[ . 1 . 2]" 1
686 1 42 SER QB 1 80 SER H 4.090 . 6.380 4.164 3.725 4.679 . 0 0 "[ . 1 . 2]" 1
687 1 42 SER QB 1 80 SER QB 4.520 . 7.250 2.461 1.731 2.955 0.059 3 0 "[ . 1 . 2]" 1
688 1 42 SER HB2 1 80 SER HA 3.650 . 5.500 5.230 4.190 5.753 0.253 3 0 "[ . 1 . 2]" 1
689 1 42 SER HB3 1 80 SER HA 3.650 . 5.500 5.291 4.105 5.720 0.220 7 0 "[ . 1 . 2]" 1
690 1 55 PRO HA 1 58 ILE H 3.340 . 4.880 4.171 3.332 4.955 0.075 19 0 "[ . 1 . 2]" 1
691 1 55 PRO HA 1 58 ILE HB 3.120 . 4.450 3.750 2.508 4.532 0.082 13 0 "[ . 1 . 2]" 1
692 1 55 PRO HA 1 58 ILE MG 4.160 . 6.530 3.857 2.676 5.471 . 0 0 "[ . 1 . 2]" 1
693 1 55 PRO HB3 1 58 ILE MG 4.160 . 6.530 4.195 2.804 5.550 . 0 0 "[ . 1 . 2]" 1
694 1 55 PRO QG 1 56 VAL QG 4.660 . 7.530 4.132 2.616 5.344 . 0 0 "[ . 1 . 2]" 1
695 1 55 PRO QG 1 58 ILE MG 4.600 . 7.410 4.883 3.853 6.607 . 0 0 "[ . 1 . 2]" 1
696 1 55 PRO HG2 1 56 VAL MG1 5.720 . 9.650 5.236 3.302 7.550 . 0 0 "[ . 1 . 2]" 1
697 1 55 PRO HG2 1 56 VAL MG2 5.720 . 9.650 5.274 2.652 6.931 . 0 0 "[ . 1 . 2]" 1
698 1 55 PRO HG3 1 56 VAL MG1 5.720 . 9.650 6.144 4.682 7.792 . 0 0 "[ . 1 . 2]" 1
699 1 55 PRO HG3 1 56 VAL MG2 5.720 . 9.650 6.028 4.175 7.480 . 0 0 "[ . 1 . 2]" 1
700 1 56 VAL H 1 56 VAL HB 2.900 . 4.010 3.211 2.492 3.831 . 0 0 "[ . 1 . 2]" 1
701 1 56 VAL H 1 57 MET H 3.310 . 4.820 3.132 1.763 4.599 0.037 1 0 "[ . 1 . 2]" 1
702 1 56 VAL H 1 58 ILE HB 3.520 . 5.250 5.133 4.693 5.436 0.186 6 0 "[ . 1 . 2]" 1
703 1 56 VAL HA 1 59 ALA MB 3.490 . 5.190 4.517 3.526 5.248 0.058 6 0 "[ . 1 . 2]" 1
704 1 56 VAL HB 1 57 MET H 2.640 . 3.490 3.185 2.231 4.154 0.664 10 8 "[* - .* * + *. ** 2]" 1
705 1 56 VAL QG 1 59 ALA MB 5.460 . 9.120 4.535 3.490 5.552 . 0 0 "[ . 1 . 2]" 1
706 1 56 VAL MG1 1 57 MET H 4.160 . 6.530 3.532 2.512 4.143 . 0 0 "[ . 1 . 2]" 1
707 1 56 VAL MG2 1 57 MET H 4.160 . 6.530 3.645 2.524 4.246 . 0 0 "[ . 1 . 2]" 1
708 1 57 MET H 1 57 MET HG2 3.650 . 5.500 3.764 2.283 4.919 . 0 0 "[ . 1 . 2]" 1
709 1 57 MET H 1 57 MET HG3 3.650 . 5.500 3.503 2.506 4.638 . 0 0 "[ . 1 . 2]" 1
710 1 57 MET HA 1 60 GLU H 3.480 . 5.160 3.630 2.957 4.102 . 0 0 "[ . 1 . 2]" 1
711 1 57 MET QB 1 58 ILE HB 3.730 . 5.670 4.807 4.282 5.446 . 0 0 "[ . 1 . 2]" 1
712 1 57 MET QB 1 59 ALA H 3.680 . 5.570 4.700 4.449 5.057 . 0 0 "[ . 1 . 2]" 1
713 1 57 MET HB2 1 58 ILE H 3.650 . 5.500 3.741 2.885 4.374 . 0 0 "[ . 1 . 2]" 1
714 1 57 MET HB3 1 58 ILE H 3.650 . 5.500 3.992 2.932 4.375 . 0 0 "[ . 1 . 2]" 1
715 1 58 ILE H 1 58 ILE HB 2.760 . 3.730 2.458 2.247 2.608 . 0 0 "[ . 1 . 2]" 1
716 1 58 ILE H 1 58 ILE MD 4.010 . 6.220 3.890 1.907 4.457 . 0 0 "[ . 1 . 2]" 1
717 1 58 ILE H 1 58 ILE HG12 3.650 . 5.500 4.593 3.883 4.742 . 0 0 "[ . 1 . 2]" 1
718 1 58 ILE H 1 58 ILE HG13 3.650 . 5.500 4.415 3.569 4.559 . 0 0 "[ . 1 . 2]" 1
719 1 58 ILE H 1 59 ALA H 2.860 . 3.920 2.517 2.356 2.745 . 0 0 "[ . 1 . 2]" 1
720 1 58 ILE HA 1 58 ILE MD 3.010 . 4.230 2.312 1.853 3.756 . 0 0 "[ . 1 . 2]" 1
721 1 58 ILE HA 1 61 LEU HB2 2.800 . 3.800 2.805 2.277 3.626 . 0 0 "[ . 1 . 2]" 1
722 1 58 ILE HA 1 61 LEU HB3 3.000 . 4.200 3.235 2.301 4.241 0.041 13 0 "[ . 1 . 2]" 1
723 1 58 ILE HA 1 61 LEU MD1 4.130 . 6.470 4.426 2.633 5.486 . 0 0 "[ . 1 . 2]" 1
724 1 58 ILE HA 1 61 LEU QD 3.880 . 5.960 3.857 2.294 4.916 . 0 0 "[ . 1 . 2]" 1
725 1 58 ILE HA 1 61 LEU MD2 4.130 . 6.470 4.518 2.299 5.551 . 0 0 "[ . 1 . 2]" 1
726 1 58 ILE HB 1 59 ALA H 2.930 . 4.070 3.956 2.962 4.141 0.071 4 0 "[ . 1 . 2]" 1
727 1 58 ILE MD 1 59 ALA H 4.160 . 6.530 4.738 4.031 5.221 . 0 0 "[ . 1 . 2]" 1
728 1 58 ILE MD 1 61 LEU HB2 4.070 . 6.340 3.556 2.143 4.776 . 0 0 "[ . 1 . 2]" 1
729 1 58 ILE MD 1 61 LEU HB3 4.160 . 6.530 3.379 2.531 5.157 . 0 0 "[ . 1 . 2]" 1
730 1 58 ILE MD 1 94 ALA HA 4.160 . 6.530 6.488 6.127 6.622 0.092 1 0 "[ . 1 . 2]" 1
731 1 58 ILE QG 1 59 ALA H 3.980 . 6.160 4.244 3.895 4.686 . 0 0 "[ . 1 . 2]" 1
732 1 58 ILE MG 1 59 ALA H 3.180 . 4.570 2.618 2.299 3.369 . 0 0 "[ . 1 . 2]" 1
733 1 58 ILE MG 1 59 ALA HA 4.160 . 6.530 3.113 2.946 3.342 . 0 0 "[ . 1 . 2]" 1
734 1 58 ILE MG 1 59 ALA MB 4.260 . 6.720 3.273 2.820 4.032 . 0 0 "[ . 1 . 2]" 1
735 1 58 ILE MG 1 72 VAL MG1 4.680 . 7.560 3.016 2.388 3.707 . 0 0 "[ . 1 . 2]" 1
736 1 59 ALA H 1 59 ALA MB 2.610 . 3.430 2.241 2.222 2.262 . 0 0 "[ . 1 . 2]" 1
737 1 59 ALA H 1 60 GLU H 2.450 . 3.110 2.665 2.414 2.842 . 0 0 "[ . 1 . 2]" 1
738 1 59 ALA H 1 61 LEU H 3.040 . 4.290 3.918 3.586 4.291 0.001 19 0 "[ . 1 . 2]" 1
739 1 59 ALA HA 1 62 LEU MD1 4.160 . 6.530 4.231 2.182 6.064 . 0 0 "[ . 1 . 2]" 1
740 1 59 ALA HA 1 62 LEU QD 3.950 . 6.100 3.152 1.960 4.711 . 0 0 "[ . 1 . 2]" 1
741 1 59 ALA HA 1 62 LEU MD2 4.160 . 6.530 3.859 1.977 5.504 . 0 0 "[ . 1 . 2]" 1
742 1 59 ALA MB 1 60 GLU H 2.840 . 3.890 2.480 2.228 2.871 . 0 0 "[ . 1 . 2]" 1
743 1 60 GLU H 1 60 GLU HB2 2.930 . 4.070 3.363 2.361 3.629 . 0 0 "[ . 1 . 2]" 1
744 1 60 GLU H 1 60 GLU HB3 2.350 . 2.900 2.720 2.496 2.967 0.067 20 0 "[ . 1 . 2]" 1
745 1 60 GLU H 1 60 GLU HG2 3.650 . 5.500 2.667 1.855 4.609 . 0 0 "[ . 1 . 2]" 1
746 1 60 GLU H 1 60 GLU QG 3.400 . 5.010 2.461 1.774 4.048 0.016 19 0 "[ . 1 . 2]" 1
747 1 60 GLU H 1 60 GLU HG3 3.650 . 5.500 3.501 1.780 4.489 0.020 19 0 "[ . 1 . 2]" 1
748 1 60 GLU H 1 61 LEU H 2.350 . 2.900 2.551 2.465 2.678 . 0 0 "[ . 1 . 2]" 1
749 1 60 GLU HA 1 60 GLU HB2 2.420 . 3.050 2.513 2.414 2.647 . 0 0 "[ . 1 . 2]" 1
750 1 60 GLU HA 1 60 GLU HG2 2.980 . 4.170 3.698 3.114 4.195 0.025 19 0 "[ . 1 . 2]" 1
751 1 60 GLU HA 1 60 GLU QG 2.850 . 3.910 3.249 2.437 3.464 . 0 0 "[ . 1 . 2]" 1
752 1 60 GLU HA 1 60 GLU HG3 2.980 . 4.170 3.707 2.545 4.238 0.068 15 0 "[ . 1 . 2]" 1
753 1 60 GLU HA 1 63 ARG H 3.100 . 4.410 3.506 3.109 3.848 . 0 0 "[ . 1 . 2]" 1
754 1 60 GLU HA 1 63 ARG QD 3.900 . 6.010 2.591 1.819 4.562 . 0 0 "[ . 1 . 2]" 1
755 1 60 GLU HB2 1 60 GLU HG2 2.280 . 2.770 2.808 2.464 3.009 0.239 11 0 "[ . 1 . 2]" 1
756 1 60 GLU HB2 1 60 GLU HG3 2.280 . 2.770 2.483 2.253 3.008 0.238 7 0 "[ . 1 . 2]" 1
757 1 60 GLU HB2 1 61 LEU H 3.180 . 4.570 3.828 3.594 3.992 . 0 0 "[ . 1 . 2]" 1
758 1 60 GLU HB2 1 113 TRP HZ2 3.650 . 5.500 5.172 4.234 5.558 0.058 16 0 "[ . 1 . 2]" 1
759 1 60 GLU HB3 1 61 LEU H 3.340 . 4.880 3.862 2.654 4.272 . 0 0 "[ . 1 . 2]" 1
760 1 60 GLU QG 1 63 ARG QD 4.520 . 7.250 4.855 3.696 5.812 . 0 0 "[ . 1 . 2]" 1
761 1 60 GLU HG2 1 61 LEU HA 3.650 . 5.500 4.702 3.831 5.656 0.156 19 0 "[ . 1 . 2]" 1
762 1 60 GLU HG3 1 61 LEU HA 3.650 . 5.500 4.246 3.410 5.497 . 0 0 "[ . 1 . 2]" 1
763 1 61 LEU H 1 61 LEU HB2 2.590 . 3.390 2.232 2.083 2.324 . 0 0 "[ . 1 . 2]" 1
764 1 61 LEU H 1 61 LEU HB3 2.920 . 4.040 2.783 2.630 3.501 . 0 0 "[ . 1 . 2]" 1
765 1 61 LEU H 1 61 LEU MD1 4.160 . 6.530 4.228 3.657 4.322 . 0 0 "[ . 1 . 2]" 1
766 1 61 LEU H 1 61 LEU QD 3.900 . 6.010 3.519 2.225 3.723 . 0 0 "[ . 1 . 2]" 1
767 1 61 LEU H 1 61 LEU MD2 4.160 . 6.530 3.800 2.245 4.301 . 0 0 "[ . 1 . 2]" 1
768 1 61 LEU H 1 61 LEU HG 3.650 . 5.500 4.441 4.044 4.547 . 0 0 "[ . 1 . 2]" 1
769 1 61 LEU H 1 62 LEU H 2.660 . 3.520 2.731 2.599 2.862 . 0 0 "[ . 1 . 2]" 1
770 1 61 LEU H 1 63 ARG H 3.200 . 4.600 4.061 3.805 4.455 . 0 0 "[ . 1 . 2]" 1
771 1 61 LEU H 1 113 TRP HH2 3.650 . 5.500 3.356 2.429 4.134 . 0 0 "[ . 1 . 2]" 1
772 1 61 LEU HA 1 61 LEU MD1 3.420 . 5.040 2.992 1.806 3.759 . 0 0 "[ . 1 . 2]" 1
773 1 61 LEU HA 1 61 LEU QD 3.110 . 4.430 1.974 1.780 2.941 0.010 4 0 "[ . 1 . 2]" 1
774 1 61 LEU HA 1 61 LEU MD2 3.420 . 5.040 2.052 1.815 3.101 . 0 0 "[ . 1 . 2]" 1
775 1 61 LEU HA 1 64 GLU QB 3.100 . 4.400 3.395 2.782 4.133 . 0 0 "[ . 1 . 2]" 1
776 1 61 LEU HA 1 64 GLU QG 4.090 . 6.380 3.967 2.791 5.281 . 0 0 "[ . 1 . 2]" 1
777 1 61 LEU HA 1 113 TRP HH2 3.030 . 4.260 2.634 1.820 3.523 . 0 0 "[ . 1 . 2]" 1
778 1 61 LEU HA 1 113 TRP HZ2 3.650 . 5.500 3.634 2.521 4.524 . 0 0 "[ . 1 . 2]" 1
779 1 61 LEU HB2 1 62 LEU H 2.560 . 3.330 3.417 2.469 3.561 0.231 19 0 "[ . 1 . 2]" 1
780 1 61 LEU HB2 1 113 TRP HH2 3.650 . 5.500 3.123 2.417 5.058 . 0 0 "[ . 1 . 2]" 1
781 1 61 LEU HB3 1 62 LEU H 2.310 . 2.830 2.319 2.159 2.978 0.148 4 0 "[ . 1 . 2]" 1
782 1 61 LEU HB3 1 113 TRP HH2 3.650 . 5.500 4.497 3.834 5.414 . 0 0 "[ . 1 . 2]" 1
783 1 61 LEU QD 1 62 LEU H 4.190 . 6.580 3.297 3.070 3.786 . 0 0 "[ . 1 . 2]" 1
784 1 61 LEU QD 1 64 GLU QB 4.880 . 7.970 3.132 2.585 4.192 . 0 0 "[ . 1 . 2]" 1
785 1 61 LEU QD 1 64 GLU QG 4.000 . 6.210 3.509 2.688 4.619 . 0 0 "[ . 1 . 2]" 1
786 1 61 LEU QD 1 113 TRP HD1 4.540 . 7.290 5.821 5.243 6.598 . 0 0 "[ . 1 . 2]" 1
787 1 61 LEU QD 1 113 TRP HE3 4.950 . 8.100 4.175 3.168 4.754 . 0 0 "[ . 1 . 2]" 1
788 1 61 LEU QD 1 113 TRP HH2 3.960 . 6.130 2.610 2.011 3.400 . 0 0 "[ . 1 . 2]" 1
789 1 61 LEU QD 1 113 TRP HZ2 4.250 . 6.700 3.226 2.555 4.492 . 0 0 "[ . 1 . 2]" 1
790 1 61 LEU QD 1 113 TRP HZ3 3.630 . 5.460 3.118 2.197 3.689 . 0 0 "[ . 1 . 2]" 1
791 1 61 LEU QD 1 117 LEU H 4.760 . 7.730 4.798 4.110 5.805 . 0 0 "[ . 1 . 2]" 1
792 1 61 LEU MD1 1 64 GLU HB2 5.730 . 9.670 4.405 2.981 7.492 . 0 0 "[ . 1 . 2]" 1
793 1 61 LEU MD1 1 64 GLU HB3 5.730 . 9.670 4.591 3.339 7.228 . 0 0 "[ . 1 . 2]" 1
794 1 61 LEU MD1 1 64 GLU HG2 4.160 . 6.530 5.287 3.007 6.337 . 0 0 "[ . 1 . 2]" 1
795 1 61 LEU MD1 1 64 GLU HG3 4.160 . 6.530 5.191 3.981 6.573 0.043 3 0 "[ . 1 . 2]" 1
796 1 61 LEU MD1 1 113 TRP HH2 4.160 . 6.530 4.430 2.661 4.933 . 0 0 "[ . 1 . 2]" 1
797 1 61 LEU MD2 1 64 GLU HB2 5.730 . 9.670 3.827 2.852 5.473 . 0 0 "[ . 1 . 2]" 1
798 1 61 LEU MD2 1 64 GLU HB3 5.730 . 9.670 4.251 3.067 6.178 . 0 0 "[ . 1 . 2]" 1
799 1 61 LEU MD2 1 64 GLU HG2 4.160 . 6.530 4.361 3.046 6.404 . 0 0 "[ . 1 . 2]" 1
800 1 61 LEU MD2 1 64 GLU HG3 4.160 . 6.530 4.322 2.870 6.117 . 0 0 "[ . 1 . 2]" 1
801 1 61 LEU MD2 1 113 TRP HH2 4.160 . 6.530 2.768 2.013 4.798 . 0 0 "[ . 1 . 2]" 1
802 1 61 LEU HG 1 62 LEU H 3.650 . 5.500 4.739 4.550 4.970 . 0 0 "[ . 1 . 2]" 1
803 1 62 LEU H 1 62 LEU HB2 2.870 . 3.950 2.419 2.106 3.597 . 0 0 "[ . 1 . 2]" 1
804 1 62 LEU H 1 62 LEU QB 2.620 . 3.450 2.298 2.060 2.510 . 0 0 "[ . 1 . 2]" 1
805 1 62 LEU H 1 62 LEU HB3 2.870 . 3.950 3.250 2.502 3.598 . 0 0 "[ . 1 . 2]" 1
806 1 62 LEU H 1 62 LEU MD1 4.160 . 6.530 3.510 1.942 4.344 . 0 0 "[ . 1 . 2]" 1
807 1 62 LEU H 1 62 LEU QD 3.710 . 5.630 2.759 1.791 3.753 . 0 0 "[ . 1 . 2]" 1
808 1 62 LEU H 1 62 LEU MD2 4.160 . 6.530 3.215 1.800 4.300 . 0 0 "[ . 1 . 2]" 1
809 1 62 LEU H 1 62 LEU HG 3.650 . 5.500 3.654 2.092 4.539 . 0 0 "[ . 1 . 2]" 1
810 1 62 LEU H 1 63 ARG H 2.580 . 3.360 2.752 2.583 2.959 . 0 0 "[ . 1 . 2]" 1
811 1 62 LEU HA 1 62 LEU MD1 4.160 . 6.530 2.774 1.780 3.848 0.010 5 0 "[ . 1 . 2]" 1
812 1 62 LEU HA 1 62 LEU MD2 4.160 . 6.530 2.944 1.764 4.064 0.026 3 0 "[ . 1 . 2]" 1
813 1 62 LEU QB 1 63 ARG H 2.680 . 3.570 2.881 2.482 3.493 . 0 0 "[ . 1 . 2]" 1
814 1 62 LEU QB 1 70 TRP QB 3.830 . 5.860 3.320 2.371 4.323 . 0 0 "[ . 1 . 2]" 1
815 1 62 LEU QB 1 70 TRP HD1 4.090 . 6.380 4.642 3.640 6.421 0.041 3 0 "[ . 1 . 2]" 1
816 1 62 LEU HB2 1 63 ARG H 2.810 . 3.830 3.339 2.659 3.892 0.062 15 0 "[ . 1 . 2]" 1
817 1 62 LEU HB2 1 70 TRP HB2 4.520 . 7.250 4.582 3.228 6.236 . 0 0 "[ . 1 . 2]" 1
818 1 62 LEU HB2 1 70 TRP HB3 4.520 . 7.250 5.279 3.652 6.999 . 0 0 "[ . 1 . 2]" 1
819 1 62 LEU HB2 1 72 VAL MG2 4.160 . 6.530 4.187 3.484 5.188 . 0 0 "[ . 1 . 2]" 1
820 1 62 LEU HB3 1 63 ARG H 2.810 . 3.830 3.477 2.519 3.969 0.139 10 0 "[ . 1 . 2]" 1
821 1 62 LEU HB3 1 70 TRP HB2 4.520 . 7.250 3.790 2.544 5.390 . 0 0 "[ . 1 . 2]" 1
822 1 62 LEU HB3 1 70 TRP HB3 4.520 . 7.250 4.652 2.990 6.465 . 0 0 "[ . 1 . 2]" 1
823 1 62 LEU HB3 1 72 VAL MG2 4.160 . 6.530 4.510 3.198 5.386 . 0 0 "[ . 1 . 2]" 1
824 1 62 LEU QD 1 63 ARG H 4.950 . 8.100 3.827 2.578 4.231 . 0 0 "[ . 1 . 2]" 1
825 1 62 LEU QD 1 63 ARG QG 4.470 . 7.150 4.740 3.825 5.360 . 0 0 "[ . 1 . 2]" 1
826 1 62 LEU QD 1 70 TRP QB 4.920 . 8.050 2.333 1.830 3.229 . 0 0 "[ . 1 . 2]" 1
827 1 62 LEU QD 1 70 TRP HD1 4.950 . 8.100 3.986 2.739 4.563 . 0 0 "[ . 1 . 2]" 1
828 1 62 LEU QD 1 70 TRP HE3 4.950 . 8.100 3.289 2.267 5.010 . 0 0 "[ . 1 . 2]" 1
829 1 62 LEU QD 1 70 TRP HZ3 4.950 . 8.100 4.354 3.108 6.440 . 0 0 "[ . 1 . 2]" 1
830 1 62 LEU QD 1 71 GLN HA 4.950 . 8.100 4.732 3.622 6.332 . 0 0 "[ . 1 . 2]" 1
831 1 62 LEU QD 1 72 VAL H 4.950 . 8.100 4.824 3.757 6.372 . 0 0 "[ . 1 . 2]" 1
832 1 62 LEU QD 1 72 VAL MG1 5.240 . 8.690 3.778 3.162 4.520 . 0 0 "[ . 1 . 2]" 1
833 1 62 LEU QD 1 72 VAL MG2 5.120 . 8.440 2.394 1.889 3.520 . 0 0 "[ . 1 . 2]" 1
834 1 62 LEU MD1 1 70 TRP HB2 5.730 . 9.670 3.171 2.346 4.845 . 0 0 "[ . 1 . 2]" 1
835 1 62 LEU MD1 1 70 TRP HB3 5.730 . 9.670 3.211 2.164 4.606 . 0 0 "[ . 1 . 2]" 1
836 1 62 LEU MD2 1 70 TRP HB2 5.730 . 9.670 3.537 2.029 5.365 . 0 0 "[ . 1 . 2]" 1
837 1 62 LEU MD2 1 70 TRP HB3 5.730 . 9.670 3.744 2.153 5.861 . 0 0 "[ . 1 . 2]" 1
838 1 63 ARG H 1 63 ARG QB 2.600 . 3.400 2.515 2.306 2.787 . 0 0 "[ . 1 . 2]" 1
839 1 63 ARG H 1 63 ARG HD2 3.650 . 5.500 4.500 3.919 5.037 . 0 0 "[ . 1 . 2]" 1
840 1 63 ARG H 1 63 ARG HD3 3.650 . 5.500 4.551 3.655 4.880 . 0 0 "[ . 1 . 2]" 1
841 1 63 ARG H 1 63 ARG HG2 2.870 . 3.950 2.678 2.016 3.713 . 0 0 "[ . 1 . 2]" 1
842 1 63 ARG H 1 63 ARG HG3 2.870 . 3.950 3.001 2.182 3.721 . 0 0 "[ . 1 . 2]" 1
843 1 63 ARG H 1 64 GLU H 2.450 . 3.110 2.628 2.458 2.852 . 0 0 "[ . 1 . 2]" 1
844 1 63 ARG HA 1 63 ARG QD 4.090 . 6.380 4.212 2.192 4.557 . 0 0 "[ . 1 . 2]" 1
845 1 63 ARG HA 1 63 ARG QG 2.910 . 4.020 2.998 2.278 3.362 . 0 0 "[ . 1 . 2]" 1
846 1 63 ARG QG 1 64 GLU H 4.090 . 6.380 3.650 2.925 4.564 . 0 0 "[ . 1 . 2]" 1
847 1 64 GLU H 1 64 GLU HB2 2.610 . 3.420 2.466 2.145 3.642 0.222 12 0 "[ . 1 . 2]" 1
848 1 64 GLU H 1 64 GLU QB 2.430 . 3.060 2.262 2.114 2.577 . 0 0 "[ . 1 . 2]" 1
849 1 64 GLU H 1 64 GLU HB3 2.610 . 3.420 3.031 2.555 3.575 0.155 13 0 "[ . 1 . 2]" 1
850 1 64 GLU H 1 64 GLU QG 3.130 . 4.460 3.405 2.330 4.100 . 0 0 "[ . 1 . 2]" 1
851 1 64 GLU H 1 65 PHE H 2.410 . 3.020 2.315 2.169 2.448 . 0 0 "[ . 1 . 2]" 1
852 1 64 GLU H 1 65 PHE HD1 3.650 . 5.500 5.577 5.534 5.629 0.129 13 0 "[ . 1 . 2]" 1
853 1 64 GLU H 1 65 PHE HD2 3.650 . 5.500 4.738 3.961 5.531 0.031 13 0 "[ . 1 . 2]" 1
854 1 64 GLU QB 1 65 PHE H 3.120 . 4.440 3.198 2.799 3.841 . 0 0 "[ . 1 . 2]" 1
855 1 64 GLU QB 1 113 TRP HH2 4.090 . 6.380 5.195 3.574 6.416 0.036 8 0 "[ . 1 . 2]" 1
856 1 64 GLU HB2 1 65 PHE H 3.450 . 5.100 3.756 2.870 4.400 . 0 0 "[ . 1 . 2]" 1
857 1 64 GLU HB3 1 65 PHE H 3.450 . 5.100 3.600 3.116 4.234 . 0 0 "[ . 1 . 2]" 1
858 1 64 GLU QG 1 113 TRP HH2 4.090 . 6.380 5.161 3.903 6.362 . 0 0 "[ . 1 . 2]" 1
859 1 64 GLU QG 1 113 TRP HZ2 3.810 . 5.820 4.026 2.358 5.872 0.052 10 0 "[ . 1 . 2]" 1
860 1 65 PHE H 1 65 PHE QB 2.920 . 4.040 2.683 2.600 2.832 . 0 0 "[ . 1 . 2]" 1
861 1 65 PHE H 1 65 PHE HD1 3.480 . 5.160 4.086 3.908 4.238 . 0 0 "[ . 1 . 2]" 1
862 1 65 PHE H 1 66 PRO HD2 3.650 . 5.500 4.505 3.989 4.809 . 0 0 "[ . 1 . 2]" 1
863 1 65 PHE H 1 66 PRO HD3 3.650 . 5.500 3.342 2.729 3.846 . 0 0 "[ . 1 . 2]" 1
864 1 65 PHE HA 1 65 PHE HD1 3.620 . 5.440 2.329 2.033 2.636 . 0 0 "[ . 1 . 2]" 1
865 1 65 PHE HA 1 65 PHE HD2 3.650 . 5.500 4.628 4.542 4.677 . 0 0 "[ . 1 . 2]" 1
866 1 65 PHE HA 1 67 GLN H 3.240 . 4.690 3.590 3.090 4.019 . 0 0 "[ . 1 . 2]" 1
867 1 65 PHE QB 1 67 GLN H 3.290 . 4.790 3.374 3.116 3.590 . 0 0 "[ . 1 . 2]" 1
868 1 65 PHE QB 1 68 PHE QD 3.650 . 5.500 3.714 2.641 4.894 . 0 0 "[ . 1 . 2]" 1
869 1 65 PHE QB 1 68 PHE QE 3.320 . 4.820 3.732 2.651 4.237 . 0 0 "[ . 1 . 2]" 1
870 1 65 PHE QB 1 70 TRP HD1 3.650 . 5.500 4.106 3.360 4.497 . 0 0 "[ . 1 . 2]" 1
871 1 65 PHE QB 1 70 TRP HE1 2.870 . 3.950 2.462 1.981 2.939 . 0 0 "[ . 1 . 2]" 1
872 1 65 PHE QB 1 70 TRP HH2 3.650 . 5.500 4.716 4.308 4.946 . 0 0 "[ . 1 . 2]" 1
873 1 65 PHE QB 1 70 TRP HZ2 3.650 . 5.500 2.896 2.460 3.217 . 0 0 "[ . 1 . 2]" 1
874 1 65 PHE HZ 1 116 LEU MD2 3.170 . 4.540 4.109 3.198 4.613 0.073 11 0 "[ . 1 . 2]" 1
875 1 65 PHE HZ 1 120 MET QG 4.090 . 6.380 3.095 1.768 4.743 0.032 11 0 "[ . 1 . 2]" 1
876 1 65 PHE HZ 1 121 ARG HA 3.510 . 5.220 3.997 3.152 5.113 . 0 0 "[ . 1 . 2]" 1
877 1 65 PHE HZ 1 121 ARG QB 4.090 . 6.380 4.724 2.868 5.817 . 0 0 "[ . 1 . 2]" 1
878 1 65 PHE HZ 1 121 ARG HG2 3.650 . 5.500 4.625 3.062 5.555 0.055 11 0 "[ . 1 . 2]" 1
879 1 65 PHE HZ 1 121 ARG QG 3.520 . 5.250 3.628 2.838 4.323 . 0 0 "[ . 1 . 2]" 1
880 1 65 PHE HZ 1 121 ARG HG3 3.650 . 5.500 3.940 2.973 5.539 0.039 10 0 "[ . 1 . 2]" 1
881 1 65 PHE HZ 1 124 VAL MG1 3.620 . 5.440 4.521 3.221 5.484 0.044 1 0 "[ . 1 . 2]" 1
882 1 65 PHE HZ 1 124 VAL MG2 3.620 . 5.440 3.865 3.255 5.003 . 0 0 "[ . 1 . 2]" 1
883 1 67 GLN H 1 67 GLN HB2 2.760 . 3.730 2.535 2.169 2.869 . 0 0 "[ . 1 . 2]" 1
884 1 67 GLN H 1 67 GLN HB3 2.860 . 3.920 3.518 2.445 3.746 . 0 0 "[ . 1 . 2]" 1
885 1 67 GLN H 1 67 GLN HG2 3.650 . 5.500 3.442 2.127 4.723 . 0 0 "[ . 1 . 2]" 1
886 1 67 GLN H 1 67 GLN QG 3.560 . 5.330 2.642 1.829 4.043 . 0 0 "[ . 1 . 2]" 1
887 1 67 GLN H 1 67 GLN HG3 3.650 . 5.500 3.109 1.842 4.395 . 0 0 "[ . 1 . 2]" 1
888 1 67 GLN H 1 68 PHE H 2.590 . 3.390 2.355 1.883 3.108 . 0 0 "[ . 1 . 2]" 1
889 1 67 GLN HA 1 68 PHE H 2.720 . 3.640 3.523 3.444 3.552 . 0 0 "[ . 1 . 2]" 1
890 1 67 GLN HB2 1 67 GLN HE21 3.650 . 5.500 3.894 2.858 4.553 . 0 0 "[ . 1 . 2]" 1
891 1 67 GLN HB2 1 67 GLN HE22 3.650 . 5.500 4.565 3.849 5.350 . 0 0 "[ . 1 . 2]" 1
892 1 67 GLN HB2 1 68 PHE H 3.010 . 4.230 2.651 2.000 3.854 . 0 0 "[ . 1 . 2]" 1
893 1 67 GLN HB2 1 68 PHE QD 3.650 . 5.500 3.683 3.205 5.009 . 0 0 "[ . 1 . 2]" 1
894 1 67 GLN HB3 1 67 GLN HE21 3.650 . 5.500 3.597 2.769 4.508 . 0 0 "[ . 1 . 2]" 1
895 1 67 GLN HB3 1 67 GLN HE22 3.650 . 5.500 4.311 3.791 5.337 . 0 0 "[ . 1 . 2]" 1
896 1 67 GLN HB3 1 68 PHE H 2.900 . 4.010 3.431 2.492 3.950 . 0 0 "[ . 1 . 2]" 1
897 1 67 GLN HB3 1 68 PHE QD 3.650 . 5.500 3.706 2.163 4.578 . 0 0 "[ . 1 . 2]" 1
898 1 67 GLN QG 1 68 PHE H 3.450 . 5.110 3.932 3.506 4.378 . 0 0 "[ . 1 . 2]" 1
899 1 68 PHE H 1 68 PHE HB2 2.810 . 3.830 2.948 2.652 3.727 . 0 0 "[ . 1 . 2]" 1
900 1 68 PHE H 1 68 PHE QB 2.710 . 3.630 2.819 2.591 3.338 . 0 0 "[ . 1 . 2]" 1
901 1 68 PHE H 1 68 PHE HB3 2.810 . 3.830 3.703 3.527 3.805 . 0 0 "[ . 1 . 2]" 1
902 1 68 PHE H 1 68 PHE QE 3.650 . 5.500 4.301 3.907 4.441 . 0 0 "[ . 1 . 2]" 1
903 1 68 PHE H 1 68 PHE HZ 3.650 . 5.500 5.470 4.865 5.674 0.174 19 0 "[ . 1 . 2]" 1
904 1 68 PHE H 1 69 ASP H 3.430 . 5.070 4.366 2.256 4.563 . 0 0 "[ . 1 . 2]" 1
905 1 68 PHE H 1 69 ASP HA 3.620 . 5.440 4.970 4.493 5.201 . 0 0 "[ . 1 . 2]" 1
906 1 68 PHE HA 1 68 PHE QD 3.650 . 5.500 2.855 2.469 3.670 . 0 0 "[ . 1 . 2]" 1
907 1 68 PHE HA 1 69 ASP HB2 3.650 . 5.500 4.574 4.281 4.991 . 0 0 "[ . 1 . 2]" 1
908 1 68 PHE HA 1 69 ASP QB 3.530 . 5.260 4.182 4.038 4.341 . 0 0 "[ . 1 . 2]" 1
909 1 68 PHE HA 1 69 ASP HB3 3.650 . 5.500 4.868 4.629 5.137 . 0 0 "[ . 1 . 2]" 1
910 1 68 PHE QB 1 70 TRP H 4.090 . 6.380 4.024 3.612 5.211 . 0 0 "[ . 1 . 2]" 1
911 1 68 PHE HB2 1 69 ASP H 3.290 . 4.790 3.029 2.089 3.817 . 0 0 "[ . 1 . 2]" 1
912 1 68 PHE HB3 1 69 ASP H 3.290 . 4.790 2.759 2.265 3.974 . 0 0 "[ . 1 . 2]" 1
913 1 68 PHE QD 1 70 TRP HE1 3.650 . 5.500 2.288 1.797 3.397 0.003 19 0 "[ . 1 . 2]" 1
914 1 68 PHE QD 1 99 THR MG 3.870 . 5.940 3.490 3.003 4.215 . 0 0 "[ . 1 . 2]" 1
915 1 68 PHE QE 1 70 TRP HH2 2.750 . 3.700 3.730 3.363 3.824 0.124 19 0 "[ . 1 . 2]" 1
916 1 68 PHE HZ 1 99 THR HB 3.650 . 5.500 4.950 3.582 5.574 0.074 13 0 "[ . 1 . 2]" 1
917 1 68 PHE HZ 1 99 THR MG 4.160 . 6.530 3.614 2.354 4.630 . 0 0 "[ . 1 . 2]" 1
918 1 68 PHE HZ 1 124 VAL HB 3.510 . 5.220 3.907 2.664 5.231 0.011 5 0 "[ . 1 . 2]" 1
919 1 68 PHE HZ 1 124 VAL MG2 3.560 . 5.320 4.819 3.956 5.360 0.040 17 0 "[ . 1 . 2]" 1
920 1 69 ASP H 1 69 ASP HB2 2.870 . 3.950 2.871 2.611 3.108 . 0 0 "[ . 1 . 2]" 1
921 1 69 ASP H 1 69 ASP QB 2.790 . 3.780 2.418 2.284 2.952 . 0 0 "[ . 1 . 2]" 1
922 1 69 ASP H 1 69 ASP HB3 2.870 . 3.950 2.630 2.462 3.679 . 0 0 "[ . 1 . 2]" 1
923 1 69 ASP H 1 70 TRP H 3.430 . 5.070 4.028 3.488 4.369 . 0 0 "[ . 1 . 2]" 1
924 1 69 ASP HA 1 70 TRP H 2.450 . 3.110 2.189 2.137 2.339 . 0 0 "[ . 1 . 2]" 1
925 1 70 TRP H 1 70 TRP HB2 2.750 . 3.700 2.527 2.402 2.726 . 0 0 "[ . 1 . 2]" 1
926 1 70 TRP H 1 70 TRP QB 2.560 . 3.320 2.481 2.368 2.655 . 0 0 "[ . 1 . 2]" 1
927 1 70 TRP H 1 70 TRP HB3 2.750 . 3.700 3.624 3.596 3.666 . 0 0 "[ . 1 . 2]" 1
928 1 70 TRP H 1 70 TRP HD1 2.690 . 3.580 2.099 1.751 2.462 0.049 18 0 "[ . 1 . 2]" 1
929 1 70 TRP H 1 70 TRP HE1 3.230 . 4.660 4.502 4.262 4.696 0.036 12 0 "[ . 1 . 2]" 1
930 1 70 TRP H 1 71 GLN H 3.260 . 4.720 4.547 4.476 4.596 . 0 0 "[ . 1 . 2]" 1
931 1 70 TRP HA 1 70 TRP HD1 3.650 . 5.500 3.874 3.369 4.182 . 0 0 "[ . 1 . 2]" 1
932 1 70 TRP HA 1 70 TRP HE3 3.650 . 5.500 3.769 3.217 4.711 . 0 0 "[ . 1 . 2]" 1
933 1 70 TRP HA 1 71 GLN H 2.270 . 2.740 2.179 2.069 2.369 . 0 0 "[ . 1 . 2]" 1
934 1 70 TRP HA 1 71 GLN HA 3.490 . 5.190 4.399 4.366 4.439 . 0 0 "[ . 1 . 2]" 1
935 1 70 TRP QB 1 70 TRP HZ3 3.860 . 5.920 4.684 4.624 4.792 . 0 0 "[ . 1 . 2]" 1
936 1 70 TRP QB 1 72 VAL MG2 4.600 . 7.410 3.681 3.240 4.033 . 0 0 "[ . 1 . 2]" 1
937 1 70 TRP HB2 1 71 GLN H 2.830 . 3.860 3.931 3.470 4.070 0.210 7 0 "[ . 1 . 2]" 1
938 1 70 TRP HB3 1 71 GLN H 2.830 . 3.860 2.942 2.660 3.143 . 0 0 "[ . 1 . 2]" 1
939 1 70 TRP HE3 1 71 GLN H 3.400 . 5.000 4.213 3.537 4.931 . 0 0 "[ . 1 . 2]" 1
940 1 70 TRP HH2 1 97 VAL MG1 3.480 . 5.160 2.716 2.196 3.124 . 0 0 "[ . 1 . 2]" 1
941 1 70 TRP HH2 1 99 THR MG 3.800 . 5.810 2.898 2.108 4.259 . 0 0 "[ . 1 . 2]" 1
942 1 70 TRP HH2 1 124 VAL MG1 3.680 . 5.570 2.300 1.773 3.220 0.017 19 0 "[ . 1 . 2]" 1
943 1 70 TRP HH2 1 124 VAL MG2 4.160 . 6.530 4.372 3.513 5.745 . 0 0 "[ . 1 . 2]" 1
944 1 70 TRP HZ2 1 124 VAL MG1 4.050 . 6.310 3.017 2.056 4.381 . 0 0 "[ . 1 . 2]" 1
945 1 70 TRP HZ2 1 124 VAL MG2 4.160 . 6.530 4.056 3.176 5.445 . 0 0 "[ . 1 . 2]" 1
946 1 70 TRP HZ3 1 97 VAL MG1 3.310 . 4.820 2.351 1.784 2.782 0.016 5 0 "[ . 1 . 2]" 1
947 1 70 TRP HZ3 1 98 PHE H 3.280 . 4.760 3.398 2.700 4.082 . 0 0 "[ . 1 . 2]" 1
948 1 70 TRP HZ3 1 99 THR MG 3.390 . 4.980 3.551 2.506 4.982 0.002 13 0 "[ . 1 . 2]" 1
949 1 71 GLN H 1 71 GLN QB 2.730 . 3.660 2.555 2.344 2.756 . 0 0 "[ . 1 . 2]" 1
950 1 71 GLN H 1 71 GLN QE 4.080 . 6.370 4.111 2.412 5.183 . 0 0 "[ . 1 . 2]" 1
951 1 71 GLN H 1 71 GLN QG 3.110 . 4.430 3.227 2.467 4.040 . 0 0 "[ . 1 . 2]" 1
952 1 71 GLN HA 1 71 GLN HE21 3.650 . 5.500 4.349 3.882 5.072 . 0 0 "[ . 1 . 2]" 1
953 1 71 GLN HA 1 71 GLN HE22 3.650 . 5.500 5.292 4.307 5.673 0.173 17 0 "[ . 1 . 2]" 1
954 1 71 GLN HA 1 72 VAL H 2.300 . 2.800 2.253 2.153 2.460 . 0 0 "[ . 1 . 2]" 1
955 1 71 GLN QB 1 72 VAL H 3.040 . 4.290 2.907 2.315 3.263 . 0 0 "[ . 1 . 2]" 1
956 1 71 GLN HB2 1 72 VAL H 3.380 . 4.970 4.022 3.606 4.346 . 0 0 "[ . 1 . 2]" 1
957 1 71 GLN HB3 1 72 VAL H 3.380 . 4.970 2.988 2.344 3.372 . 0 0 "[ . 1 . 2]" 1
958 1 71 GLN QG 1 72 VAL H 3.250 . 4.710 4.019 3.497 4.737 0.027 3 0 "[ . 1 . 2]" 1
959 1 72 VAL H 1 72 VAL HB 2.550 . 3.300 2.677 2.593 2.800 . 0 0 "[ . 1 . 2]" 1
960 1 72 VAL H 1 72 VAL MG2 2.860 . 3.920 2.417 2.232 2.761 . 0 0 "[ . 1 . 2]" 1
961 1 72 VAL H 1 73 ALA H 3.230 . 4.660 4.387 4.253 4.494 . 0 0 "[ . 1 . 2]" 1
962 1 72 VAL HA 1 73 ALA H 2.190 . 2.590 2.141 2.123 2.183 . 0 0 "[ . 1 . 2]" 1
963 1 72 VAL HA 1 73 ALA HA 3.650 . 5.500 4.387 4.369 4.402 . 0 0 "[ . 1 . 2]" 1
964 1 72 VAL HB 1 73 ALA H 3.000 . 4.200 4.104 3.955 4.231 0.031 8 0 "[ . 1 . 2]" 1
965 1 72 VAL MG1 1 73 ALA H 2.950 . 4.110 2.679 2.417 2.968 . 0 0 "[ . 1 . 2]" 1
966 1 72 VAL MG1 1 74 VAL MG1 4.580 . 7.370 3.019 2.546 4.596 . 0 0 "[ . 1 . 2]" 1
967 1 72 VAL MG2 1 73 ALA H 4.160 . 6.530 4.123 4.045 4.260 . 0 0 "[ . 1 . 2]" 1
968 1 73 ALA H 1 74 VAL H 3.290 . 4.790 4.451 4.405 4.504 . 0 0 "[ . 1 . 2]" 1
969 1 73 ALA HA 1 74 VAL H 2.220 . 2.650 2.276 2.173 2.375 . 0 0 "[ . 1 . 2]" 1
970 1 73 ALA HA 1 74 VAL MG1 3.700 . 5.600 3.772 3.520 5.349 . 0 0 "[ . 1 . 2]" 1
971 1 73 ALA MB 1 74 VAL H 2.770 . 3.740 2.658 2.427 2.952 . 0 0 "[ . 1 . 2]" 1
972 1 73 ALA MB 1 74 VAL HA 4.160 . 6.530 4.043 3.960 4.104 . 0 0 "[ . 1 . 2]" 1
973 1 74 VAL H 1 74 VAL MG1 3.120 . 4.450 3.098 2.953 3.958 . 0 0 "[ . 1 . 2]" 1
974 1 74 VAL H 1 74 VAL MG2 2.640 . 3.490 2.141 1.979 2.616 . 0 0 "[ . 1 . 2]" 1
975 1 74 VAL HA 1 75 ALA H 2.410 . 3.020 2.300 2.140 2.472 . 0 0 "[ . 1 . 2]" 1
976 1 74 VAL HA 1 75 ALA MB 3.940 . 6.090 3.906 3.809 4.036 . 0 0 "[ . 1 . 2]" 1
977 1 74 VAL HB 1 75 ALA H 2.900 . 4.010 2.697 2.174 3.521 . 0 0 "[ . 1 . 2]" 1
978 1 74 VAL MG1 1 75 ALA H 3.880 . 5.970 3.512 1.908 3.734 . 0 0 "[ . 1 . 2]" 1
979 1 74 VAL MG1 1 75 ALA MB 4.680 . 7.560 4.910 3.626 5.073 . 0 0 "[ . 1 . 2]" 1
980 1 74 VAL MG2 1 75 ALA H 3.140 . 4.480 3.734 3.295 4.078 . 0 0 "[ . 1 . 2]" 1
981 1 74 VAL MG2 1 75 ALA HA 4.160 . 6.530 4.162 3.653 5.460 . 0 0 "[ . 1 . 2]" 1
982 1 75 ALA H 1 76 ASP H 3.510 . 5.220 4.116 2.701 4.584 . 0 0 "[ . 1 . 2]" 1
983 1 75 ALA HA 1 76 ASP H 2.550 . 3.300 2.403 2.140 3.067 . 0 0 "[ . 1 . 2]" 1
984 1 75 ALA MB 1 79 GLN QB 3.730 . 5.670 2.552 1.764 3.973 0.026 17 0 "[ . 1 . 2]" 1
985 1 75 ALA MB 1 79 GLN QG 4.600 . 7.410 3.890 1.718 4.930 0.072 4 0 "[ . 1 . 2]" 1
986 1 75 ALA MB 1 80 SER H 3.120 . 4.450 3.001 2.212 3.884 . 0 0 "[ . 1 . 2]" 1
987 1 75 ALA MB 1 80 SER HA 3.290 . 4.790 2.490 1.857 3.036 . 0 0 "[ . 1 . 2]" 1
988 1 75 ALA MB 1 83 ILE MD 3.780 . 5.760 1.953 1.780 2.494 0.020 1 0 "[ . 1 . 2]" 1
989 1 75 ALA MB 1 83 ILE MG 4.680 . 7.560 3.559 2.663 4.347 . 0 0 "[ . 1 . 2]" 1
990 1 76 ASP H 1 77 LEU H 3.510 . 5.220 4.048 2.883 4.682 . 0 0 "[ . 1 . 2]" 1
991 1 76 ASP QB 1 77 LEU MD1 4.600 . 7.410 4.228 1.796 6.035 . 0 0 "[ . 1 . 2]" 1
992 1 77 LEU H 1 77 LEU MD1 3.080 . 4.360 3.086 1.757 4.420 0.060 3 0 "[ . 1 . 2]" 1
993 1 77 LEU H 1 77 LEU HG 3.650 . 5.500 3.298 1.939 4.310 . 0 0 "[ . 1 . 2]" 1
994 1 77 LEU H 1 78 GLU H 2.560 . 3.330 2.532 1.724 3.376 0.066 20 0 "[ . 1 . 2]" 1
995 1 77 LEU HA 1 77 LEU MD1 3.570 . 5.350 3.442 2.631 4.108 . 0 0 "[ . 1 . 2]" 1
996 1 77 LEU HA 1 77 LEU MD2 3.230 . 4.670 3.223 1.951 4.052 . 0 0 "[ . 1 . 2]" 1
997 1 77 LEU QB 1 78 GLU H 2.940 . 4.080 2.560 1.888 3.555 . 0 0 "[ . 1 . 2]" 1
998 1 77 LEU QB 1 78 GLU HB2 4.090 . 6.380 4.283 3.559 5.108 . 0 0 "[ . 1 . 2]" 1
999 1 77 LEU HB2 1 78 GLU H 3.170 . 4.540 2.669 1.920 3.971 . 0 0 "[ . 1 . 2]" 1
1000 1 77 LEU HB3 1 78 GLU H 3.170 . 4.540 3.435 2.600 4.191 . 0 0 "[ . 1 . 2]" 1
1001 1 77 LEU MD1 1 78 GLU H 4.160 . 6.530 3.832 1.919 4.733 . 0 0 "[ . 1 . 2]" 1
1002 1 77 LEU MD2 1 78 GLU H 4.160 . 6.530 4.206 1.979 4.886 . 0 0 "[ . 1 . 2]" 1
1003 1 77 LEU HG 1 78 GLU H 3.650 . 5.500 4.145 1.749 5.055 0.051 3 0 "[ . 1 . 2]" 1
1004 1 78 GLU H 1 78 GLU HB2 2.560 . 3.330 2.729 2.198 3.572 0.242 12 0 "[ . 1 . 2]" 1
1005 1 78 GLU H 1 78 GLU HB3 2.360 . 2.930 2.539 2.391 2.754 . 0 0 "[ . 1 . 2]" 1
1006 1 78 GLU H 1 78 GLU HG2 3.540 . 5.280 4.038 1.944 4.652 . 0 0 "[ . 1 . 2]" 1
1007 1 78 GLU H 1 78 GLU HG3 3.540 . 5.280 4.216 2.957 4.528 . 0 0 "[ . 1 . 2]" 1
1008 1 78 GLU H 1 79 GLN H 2.550 . 3.300 2.562 2.320 2.827 . 0 0 "[ . 1 . 2]" 1
1009 1 78 GLU HA 1 78 GLU HB2 2.350 . 2.900 2.481 2.388 2.610 . 0 0 "[ . 1 . 2]" 1
1010 1 78 GLU HA 1 78 GLU HB3 2.420 . 3.050 2.902 2.380 3.031 . 0 0 "[ . 1 . 2]" 1
1011 1 78 GLU HB2 1 79 GLN H 2.780 . 3.760 3.748 3.504 3.836 0.076 6 0 "[ . 1 . 2]" 1
1012 1 78 GLU HB3 1 79 GLN H 2.900 . 4.010 2.763 2.286 4.056 0.046 17 0 "[ . 1 . 2]" 1
1013 1 78 GLU QG 1 79 GLN H 4.090 . 6.380 3.340 1.995 4.311 . 0 0 "[ . 1 . 2]" 1
1014 1 79 GLN H 1 79 GLN QB 2.720 . 3.640 2.411 2.080 2.634 . 0 0 "[ . 1 . 2]" 1
1015 1 79 GLN H 1 79 GLN HG2 3.520 . 5.250 3.183 1.782 4.293 0.008 4 0 "[ . 1 . 2]" 1
1016 1 79 GLN H 1 79 GLN QG 3.460 . 5.120 2.746 1.771 3.720 0.029 4 0 "[ . 1 . 2]" 1
1017 1 79 GLN H 1 79 GLN HG3 3.520 . 5.250 3.447 2.237 4.079 . 0 0 "[ . 1 . 2]" 1
1018 1 79 GLN H 1 80 SER H 2.480 . 3.170 2.678 2.501 2.852 . 0 0 "[ . 1 . 2]" 1
1019 1 79 GLN HA 1 79 GLN QE 4.080 . 6.370 4.026 3.111 4.862 . 0 0 "[ . 1 . 2]" 1
1020 1 79 GLN HA 1 82 ALA H 2.900 . 4.010 3.432 3.148 3.704 . 0 0 "[ . 1 . 2]" 1
1021 1 79 GLN HB2 1 79 GLN HE21 3.650 . 5.500 3.727 1.762 4.535 0.038 10 0 "[ . 1 . 2]" 1
1022 1 79 GLN HB2 1 79 GLN HE22 3.650 . 5.500 4.483 3.387 5.342 . 0 0 "[ . 1 . 2]" 1
1023 1 79 GLN HB2 1 80 SER H 2.830 . 3.860 2.981 2.431 3.903 0.043 14 0 "[ . 1 . 2]" 1
1024 1 79 GLN HB3 1 79 GLN HE21 3.650 . 5.500 3.844 1.767 4.604 0.033 4 0 "[ . 1 . 2]" 1
1025 1 79 GLN HB3 1 79 GLN HE22 3.650 . 5.500 4.735 3.393 5.388 . 0 0 "[ . 1 . 2]" 1
1026 1 79 GLN HB3 1 80 SER H 2.830 . 3.860 3.759 3.360 3.996 0.136 14 0 "[ . 1 . 2]" 1
1027 1 80 SER H 1 80 SER QB 2.790 . 3.780 2.526 2.265 2.721 . 0 0 "[ . 1 . 2]" 1
1028 1 80 SER H 1 81 GLU H 2.670 . 3.550 2.757 2.605 2.986 . 0 0 "[ . 1 . 2]" 1
1029 1 80 SER H 1 82 ALA H 3.210 . 4.630 4.328 4.073 4.662 0.032 16 0 "[ . 1 . 2]" 1
1030 1 80 SER H 1 83 ILE MD 4.160 . 6.530 4.270 3.848 4.594 . 0 0 "[ . 1 . 2]" 1
1031 1 80 SER HA 1 83 ILE H 2.860 . 3.920 3.507 3.169 3.689 . 0 0 "[ . 1 . 2]" 1
1032 1 80 SER HA 1 83 ILE HA 3.600 . 5.410 5.393 4.905 5.593 0.183 3 0 "[ . 1 . 2]" 1
1033 1 80 SER HA 1 83 ILE HB 2.970 . 4.140 2.620 2.055 2.945 . 0 0 "[ . 1 . 2]" 1
1034 1 80 SER HA 1 83 ILE MD 4.160 . 6.530 2.934 2.126 3.413 . 0 0 "[ . 1 . 2]" 1
1035 1 81 GLU H 1 81 GLU HB2 2.270 . 2.740 2.468 2.229 2.719 . 0 0 "[ . 1 . 2]" 1
1036 1 81 GLU H 1 81 GLU HB3 2.420 . 3.050 2.587 2.438 2.819 . 0 0 "[ . 1 . 2]" 1
1037 1 81 GLU H 1 81 GLU HG2 3.650 . 5.500 4.513 4.211 4.601 . 0 0 "[ . 1 . 2]" 1
1038 1 81 GLU H 1 81 GLU HG3 3.650 . 5.500 4.462 4.382 4.528 . 0 0 "[ . 1 . 2]" 1
1039 1 81 GLU H 1 82 ALA H 2.410 . 3.020 2.622 2.462 2.809 . 0 0 "[ . 1 . 2]" 1
1040 1 81 GLU H 1 82 ALA MB 3.940 . 6.090 4.311 4.141 4.523 . 0 0 "[ . 1 . 2]" 1
1041 1 81 GLU HA 1 81 GLU HB2 2.300 . 2.800 2.502 2.426 2.650 . 0 0 "[ . 1 . 2]" 1
1042 1 81 GLU HA 1 81 GLU HB3 2.390 . 2.990 3.017 2.996 3.023 0.033 6 0 "[ . 1 . 2]" 1
1043 1 81 GLU HB3 1 82 ALA H 2.280 . 2.770 2.517 2.358 2.631 . 0 0 "[ . 1 . 2]" 1
1044 1 81 GLU QG 1 82 ALA H 3.700 . 5.600 3.703 3.302 4.466 . 0 0 "[ . 1 . 2]" 1
1045 1 82 ALA H 1 82 ALA MB 2.610 . 3.430 2.242 2.229 2.265 . 0 0 "[ . 1 . 2]" 1
1046 1 82 ALA H 1 83 ILE H 2.450 . 3.110 2.616 2.451 2.753 . 0 0 "[ . 1 . 2]" 1
1047 1 82 ALA H 1 84 GLY H 3.170 . 4.540 4.174 3.925 4.474 . 0 0 "[ . 1 . 2]" 1
1048 1 82 ALA HA 1 85 ASP H 3.000 . 4.200 3.541 3.293 3.901 . 0 0 "[ . 1 . 2]" 1
1049 1 82 ALA MB 1 83 ILE H 2.720 . 3.640 2.543 2.401 2.779 . 0 0 "[ . 1 . 2]" 1
1050 1 82 ALA MB 1 83 ILE QG 3.840 . 5.890 3.171 3.021 3.346 . 0 0 "[ . 1 . 2]" 1
1051 1 82 ALA MB 1 85 ASP H 4.160 . 6.530 4.638 4.394 4.890 . 0 0 "[ . 1 . 2]" 1
1052 1 82 ALA MB 1 85 ASP HB2 4.160 . 6.530 5.064 4.682 5.640 . 0 0 "[ . 1 . 2]" 1
1053 1 82 ALA MB 1 85 ASP HB3 4.160 . 6.530 4.144 3.772 4.718 . 0 0 "[ . 1 . 2]" 1
1054 1 83 ILE H 1 83 ILE HB 2.360 . 2.930 2.461 2.393 2.530 . 0 0 "[ . 1 . 2]" 1
1055 1 83 ILE H 1 83 ILE MD 3.200 . 4.610 3.656 3.589 3.758 . 0 0 "[ . 1 . 2]" 1
1056 1 83 ILE H 1 83 ILE HG12 3.000 . 4.200 3.482 3.396 3.584 . 0 0 "[ . 1 . 2]" 1
1057 1 83 ILE H 1 83 ILE QG 2.820 . 3.850 2.235 2.159 2.324 . 0 0 "[ . 1 . 2]" 1
1058 1 83 ILE H 1 83 ILE HG13 3.000 . 4.200 2.262 2.183 2.354 . 0 0 "[ . 1 . 2]" 1
1059 1 83 ILE H 1 83 ILE MG 3.250 . 4.700 3.761 3.738 3.779 . 0 0 "[ . 1 . 2]" 1
1060 1 83 ILE H 1 84 GLY H 2.420 . 3.050 2.689 2.585 2.806 . 0 0 "[ . 1 . 2]" 1
1061 1 83 ILE HA 1 86 ARG H 2.920 . 4.040 3.350 3.066 3.762 . 0 0 "[ . 1 . 2]" 1
1062 1 83 ILE HB 1 84 GLY H 2.480 . 3.170 2.610 2.394 2.779 . 0 0 "[ . 1 . 2]" 1
1063 1 83 ILE MD 1 84 GLY H 3.880 . 5.970 4.636 4.450 4.770 . 0 0 "[ . 1 . 2]" 1
1064 1 83 ILE QG 1 84 GLY H 3.310 . 4.830 4.083 3.980 4.167 . 0 0 "[ . 1 . 2]" 1
1065 1 83 ILE HG12 1 84 GLY H 3.650 . 5.500 4.987 4.895 5.054 . 0 0 "[ . 1 . 2]" 1
1066 1 83 ILE HG13 1 84 GLY H 3.650 . 5.500 4.335 4.200 4.438 . 0 0 "[ . 1 . 2]" 1
1067 1 83 ILE MG 1 84 GLY H 3.230 . 4.670 3.278 3.008 3.459 . 0 0 "[ . 1 . 2]" 1
1068 1 83 ILE MG 1 87 PHE H 4.080 . 6.370 4.141 3.896 4.398 . 0 0 "[ . 1 . 2]" 1
1069 1 83 ILE MG 1 87 PHE HD1 3.730 . 5.660 5.390 4.714 5.711 0.051 8 0 "[ . 1 . 2]" 1
1070 1 83 ILE MG 1 87 PHE HD2 3.730 . 5.660 2.464 2.076 2.903 . 0 0 "[ . 1 . 2]" 1
1071 1 83 ILE MG 1 87 PHE HE2 3.400 . 5.010 2.104 1.897 2.490 . 0 0 "[ . 1 . 2]" 1
1072 1 84 GLY H 1 84 GLY HA3 2.220 . 2.650 2.297 2.284 2.309 . 0 0 "[ . 1 . 2]" 1
1073 1 84 GLY H 1 85 ASP H 2.450 . 3.110 2.708 2.595 2.859 . 0 0 "[ . 1 . 2]" 1
1074 1 84 GLY HA2 1 87 PHE H 3.000 . 4.200 3.658 3.390 3.949 . 0 0 "[ . 1 . 2]" 1
1075 1 84 GLY HA2 1 87 PHE QB 3.780 . 5.760 3.472 3.024 4.115 . 0 0 "[ . 1 . 2]" 1
1076 1 84 GLY HA2 1 89 VAL H 3.120 . 4.450 3.507 3.088 4.010 . 0 0 "[ . 1 . 2]" 1
1077 1 84 GLY HA2 1 89 VAL HB 3.210 . 4.630 3.248 2.282 4.354 . 0 0 "[ . 1 . 2]" 1
1078 1 84 GLY HA2 1 89 VAL MG1 3.700 . 5.600 3.630 1.807 4.699 . 0 0 "[ . 1 . 2]" 1
1079 1 84 GLY HA2 1 89 VAL QG 3.510 . 5.220 2.940 1.805 4.190 . 0 0 "[ . 1 . 2]" 1
1080 1 84 GLY HA2 1 89 VAL MG2 3.700 . 5.600 3.793 2.083 4.940 . 0 0 "[ . 1 . 2]" 1
1081 1 84 GLY HA3 1 85 ASP H 2.530 . 3.270 2.803 2.673 2.896 . 0 0 "[ . 1 . 2]" 1
1082 1 84 GLY HA3 1 89 VAL H 3.100 . 4.410 4.238 3.831 4.484 0.074 14 0 "[ . 1 . 2]" 1
1083 1 84 GLY HA3 1 89 VAL HB 3.650 . 5.500 4.122 2.974 5.525 0.025 3 0 "[ . 1 . 2]" 1
1084 1 84 GLY HA3 1 89 VAL QG 4.880 . 7.960 3.657 2.367 4.750 . 0 0 "[ . 1 . 2]" 1
1085 1 85 ASP H 1 85 ASP HB2 2.250 . 2.710 2.565 2.465 2.690 . 0 0 "[ . 1 . 2]" 1
1086 1 85 ASP H 1 85 ASP HB3 2.350 . 2.900 2.484 2.337 2.633 . 0 0 "[ . 1 . 2]" 1
1087 1 85 ASP H 1 86 ARG H 2.420 . 3.050 2.586 2.418 2.768 . 0 0 "[ . 1 . 2]" 1
1088 1 85 ASP H 1 87 PHE H 3.060 . 4.320 4.210 4.088 4.347 0.027 13 0 "[ . 1 . 2]" 1
1089 1 85 ASP HA 1 85 ASP HB2 2.420 . 3.050 2.451 2.371 2.521 . 0 0 "[ . 1 . 2]" 1
1090 1 85 ASP HA 1 85 ASP HB3 2.380 . 2.960 3.019 3.011 3.028 0.068 11 0 "[ . 1 . 2]" 1
1091 1 85 ASP HA 1 88 ASN H 2.870 . 3.950 3.346 2.918 3.688 . 0 0 "[ . 1 . 2]" 1
1092 1 85 ASP HA 1 89 VAL H 2.970 . 4.140 3.907 3.238 4.212 0.072 11 0 "[ . 1 . 2]" 1
1093 1 85 ASP HB2 1 86 ARG H 2.830 . 3.860 3.865 3.671 3.918 0.058 13 0 "[ . 1 . 2]" 1
1094 1 85 ASP HB3 1 86 ARG H 2.450 . 3.110 2.594 2.386 2.799 . 0 0 "[ . 1 . 2]" 1
1095 1 86 ARG H 1 86 ARG HB2 2.360 . 2.930 2.517 2.341 2.662 . 0 0 "[ . 1 . 2]" 1
1096 1 86 ARG H 1 86 ARG HB3 2.360 . 2.930 2.487 2.339 2.669 . 0 0 "[ . 1 . 2]" 1
1097 1 86 ARG H 1 86 ARG HD2 3.650 . 5.500 4.754 4.485 5.127 . 0 0 "[ . 1 . 2]" 1
1098 1 86 ARG H 1 86 ARG HD3 3.650 . 5.500 4.797 4.465 5.649 0.149 8 0 "[ . 1 . 2]" 1
1099 1 86 ARG H 1 86 ARG HG2 3.650 . 5.500 4.531 4.366 4.601 . 0 0 "[ . 1 . 2]" 1
1100 1 86 ARG H 1 86 ARG QG 3.580 . 5.370 3.991 3.947 4.049 . 0 0 "[ . 1 . 2]" 1
1101 1 86 ARG H 1 86 ARG HG3 3.650 . 5.500 4.437 4.347 4.519 . 0 0 "[ . 1 . 2]" 1
1102 1 86 ARG H 1 87 PHE H 2.380 . 2.960 2.767 2.629 2.905 . 0 0 "[ . 1 . 2]" 1
1103 1 86 ARG H 1 88 ASN H 3.200 . 4.600 3.824 3.697 3.947 . 0 0 "[ . 1 . 2]" 1
1104 1 86 ARG HA 1 86 ARG HD2 3.650 . 5.500 2.923 1.958 4.418 . 0 0 "[ . 1 . 2]" 1
1105 1 86 ARG HA 1 86 ARG HD3 3.650 . 5.500 3.518 2.720 4.698 . 0 0 "[ . 1 . 2]" 1
1106 1 86 ARG QB 1 87 PHE H 2.820 . 3.850 2.629 2.433 2.768 . 0 0 "[ . 1 . 2]" 1
1107 1 86 ARG QB 1 87 PHE HD1 4.090 . 6.380 4.648 3.750 5.637 . 0 0 "[ . 1 . 2]" 1
1108 1 86 ARG HB2 1 87 PHE H 3.000 . 4.200 3.938 3.767 4.062 . 0 0 "[ . 1 . 2]" 1
1109 1 86 ARG HB3 1 87 PHE H 3.000 . 4.200 2.671 2.459 2.817 . 0 0 "[ . 1 . 2]" 1
1110 1 86 ARG QD 1 87 PHE H 4.090 . 6.380 4.636 4.412 5.205 . 0 0 "[ . 1 . 2]" 1
1111 1 86 ARG QG 1 87 PHE H 4.030 . 6.260 3.592 3.260 3.967 . 0 0 "[ . 1 . 2]" 1
1112 1 86 ARG QG 1 87 PHE HD1 3.720 . 5.640 3.527 2.578 4.417 . 0 0 "[ . 1 . 2]" 1
1113 1 86 ARG QG 1 87 PHE HD2 3.980 . 6.160 4.880 3.782 6.187 0.027 4 0 "[ . 1 . 2]" 1
1114 1 86 ARG QG 1 98 PHE HZ 4.090 . 6.380 5.808 5.169 6.446 0.066 8 0 "[ . 1 . 2]" 1
1115 1 87 PHE H 1 87 PHE HB2 2.900 . 4.010 2.497 2.392 2.579 . 0 0 "[ . 1 . 2]" 1
1116 1 87 PHE H 1 87 PHE QB 2.730 . 3.660 2.457 2.360 2.533 . 0 0 "[ . 1 . 2]" 1
1117 1 87 PHE H 1 87 PHE HB3 2.900 . 4.010 3.668 3.618 3.710 . 0 0 "[ . 1 . 2]" 1
1118 1 87 PHE H 1 87 PHE HD1 3.320 . 4.850 4.173 3.512 4.751 . 0 0 "[ . 1 . 2]" 1
1119 1 87 PHE H 1 88 ASN H 2.360 . 2.930 2.326 2.114 2.450 . 0 0 "[ . 1 . 2]" 1
1120 1 87 PHE H 1 88 ASN HD21 3.650 . 5.500 4.600 3.980 4.921 . 0 0 "[ . 1 . 2]" 1
1121 1 87 PHE H 1 88 ASN QD 3.480 . 5.160 4.381 3.895 4.626 . 0 0 "[ . 1 . 2]" 1
1122 1 87 PHE H 1 88 ASN HD22 3.650 . 5.500 5.562 5.504 5.641 0.141 12 0 "[ . 1 . 2]" 1
1123 1 87 PHE H 1 89 VAL H 2.920 . 4.040 3.669 3.298 4.096 0.056 7 0 "[ . 1 . 2]" 1
1124 1 87 PHE HA 1 87 PHE HD1 3.650 . 5.500 2.209 1.882 2.724 . 0 0 "[ . 1 . 2]" 1
1125 1 87 PHE HA 1 87 PHE HD2 3.650 . 5.500 4.512 4.162 4.659 . 0 0 "[ . 1 . 2]" 1
1126 1 87 PHE HA 1 88 ASN H 2.720 . 3.640 3.235 3.105 3.312 . 0 0 "[ . 1 . 2]" 1
1127 1 87 PHE QB 1 89 VAL QG 4.220 . 6.640 2.513 1.819 4.418 . 0 0 "[ . 1 . 2]" 1
1128 1 87 PHE QB 1 96 LEU QD 4.050 . 6.300 2.911 2.207 3.548 . 0 0 "[ . 1 . 2]" 1
1129 1 87 PHE QB 1 103 LEU QD 4.600 . 7.410 2.573 2.048 3.511 . 0 0 "[ . 1 . 2]" 1
1130 1 87 PHE HB2 1 89 VAL MG1 5.100 . 8.410 4.336 2.710 5.127 . 0 0 "[ . 1 . 2]" 1
1131 1 87 PHE HB2 1 89 VAL MG2 5.100 . 8.410 3.078 1.856 5.381 . 0 0 "[ . 1 . 2]" 1
1132 1 87 PHE HB2 1 96 LEU MD1 4.760 . 7.720 3.352 2.504 3.939 . 0 0 "[ . 1 . 2]" 1
1133 1 87 PHE HB2 1 96 LEU MD2 4.760 . 7.720 4.418 3.860 5.061 . 0 0 "[ . 1 . 2]" 1
1134 1 87 PHE HB2 1 103 LEU QD 4.160 . 6.530 3.824 3.294 4.766 . 0 0 "[ . 1 . 2]" 1
1135 1 87 PHE HB3 1 89 VAL MG1 5.100 . 8.410 5.016 3.814 6.198 . 0 0 "[ . 1 . 2]" 1
1136 1 87 PHE HB3 1 89 VAL MG2 5.100 . 8.410 3.487 2.198 6.039 . 0 0 "[ . 1 . 2]" 1
1137 1 87 PHE HB3 1 96 LEU MD1 4.760 . 7.720 3.356 2.485 4.333 . 0 0 "[ . 1 . 2]" 1
1138 1 87 PHE HB3 1 96 LEU MD2 4.760 . 7.720 5.119 4.336 5.956 . 0 0 "[ . 1 . 2]" 1
1139 1 87 PHE HB3 1 103 LEU QD 4.160 . 6.530 2.617 2.069 3.614 . 0 0 "[ . 1 . 2]" 1
1140 1 87 PHE HD1 1 88 ASN H 3.650 . 5.500 5.265 4.856 5.753 0.253 20 0 "[ . 1 . 2]" 1
1141 1 87 PHE HD1 1 103 LEU QD 4.160 . 4.820 3.037 1.977 3.954 . 0 0 "[ . 1 . 2]" 1
1142 1 87 PHE HD2 1 96 LEU QD 4.880 . 7.970 3.090 2.452 4.031 . 0 0 "[ . 1 . 2]" 1
1143 1 87 PHE HD2 1 103 LEU QD 3.700 . 5.600 4.293 3.847 5.140 . 0 0 "[ . 1 . 2]" 1
1144 1 87 PHE HE2 1 103 LEU QD 3.540 . 5.290 4.898 4.444 5.554 0.264 11 0 "[ . 1 . 2]" 1
1145 1 87 PHE HZ 1 103 LEU QD 4.160 . 6.530 4.830 4.077 5.352 . 0 0 "[ . 1 . 2]" 1
1146 1 88 ASN H 1 88 ASN HA 2.140 . 2.490 2.263 2.247 2.278 . 0 0 "[ . 1 . 2]" 1
1147 1 88 ASN H 1 88 ASN HB3 2.980 . 4.170 4.088 4.063 4.143 . 0 0 "[ . 1 . 2]" 1
1148 1 88 ASN H 1 89 VAL H 2.420 . 3.050 2.667 2.489 2.887 . 0 0 "[ . 1 . 2]" 1
1149 1 88 ASN H 1 89 VAL QG 4.450 . 7.100 3.854 3.433 4.321 . 0 0 "[ . 1 . 2]" 1
1150 1 88 ASN HA 1 89 VAL H 2.360 . 2.930 2.798 2.431 2.998 0.068 12 0 "[ . 1 . 2]" 1
1151 1 88 ASN HB2 1 89 VAL H 3.070 . 4.350 4.205 3.980 4.450 0.100 11 0 "[ . 1 . 2]" 1
1152 1 88 ASN HB3 1 89 VAL H 3.280 . 4.760 4.407 4.276 4.509 . 0 0 "[ . 1 . 2]" 1
1153 1 89 VAL H 1 89 VAL HB 2.280 . 2.770 2.652 2.498 2.796 0.026 11 0 "[ . 1 . 2]" 1
1154 1 89 VAL H 1 89 VAL MG1 3.230 . 4.670 3.325 2.096 3.929 . 0 0 "[ . 1 . 2]" 1
1155 1 89 VAL H 1 89 VAL QG 2.860 . 3.920 2.243 1.933 2.775 . 0 0 "[ . 1 . 2]" 1
1156 1 89 VAL H 1 89 VAL MG2 3.230 . 4.670 2.766 1.939 3.849 . 0 0 "[ . 1 . 2]" 1
1157 1 89 VAL HB 1 94 ALA MB 3.980 . 6.160 4.616 3.701 5.995 . 0 0 "[ . 1 . 2]" 1
1158 1 89 VAL HB 1 96 LEU MD1 4.160 . 6.530 3.417 2.491 4.438 . 0 0 "[ . 1 . 2]" 1
1159 1 89 VAL HB 1 96 LEU MD2 4.160 . 6.530 4.173 3.260 5.518 . 0 0 "[ . 1 . 2]" 1
1160 1 89 VAL QG 1 94 ALA H 4.940 . 8.090 4.446 3.269 5.521 . 0 0 "[ . 1 . 2]" 1
1161 1 89 VAL QG 1 94 ALA HA 4.940 . 8.090 4.970 4.227 5.906 . 0 0 "[ . 1 . 2]" 1
1162 1 89 VAL QG 1 94 ALA MB 4.160 . 6.520 2.532 1.782 3.445 0.018 1 0 "[ . 1 . 2]" 1
1163 1 89 VAL QG 1 107 LEU H 4.890 . 7.990 4.812 4.166 5.537 . 0 0 "[ . 1 . 2]" 1
1164 1 89 VAL MG1 1 94 ALA MB 4.680 . 7.560 2.898 1.957 4.426 . 0 0 "[ . 1 . 2]" 1
1165 1 89 VAL MG1 1 106 ALA MB 4.680 . 7.560 2.956 1.861 5.239 . 0 0 "[ . 1 . 2]" 1
1166 1 89 VAL MG2 1 94 ALA MB 4.680 . 7.560 3.662 1.793 4.913 0.007 1 0 "[ . 1 . 2]" 1
1167 1 89 VAL MG2 1 106 ALA MB 4.680 . 7.560 2.754 1.884 3.922 . 0 0 "[ . 1 . 2]" 1
1168 1 93 PRO HB2 1 94 ALA H 2.860 . 3.920 3.651 1.783 4.025 0.105 5 0 "[ . 1 . 2]" 1
1169 1 93 PRO HB3 1 94 ALA H 2.890 . 3.980 3.750 2.608 4.059 0.079 6 0 "[ . 1 . 2]" 1
1170 1 94 ALA H 1 95 THR H 3.370 . 4.940 4.304 4.180 4.471 . 0 0 "[ . 1 . 2]" 1
1171 1 94 ALA HA 1 95 THR H 2.250 . 2.710 2.258 2.144 2.508 . 0 0 "[ . 1 . 2]" 1
1172 1 94 ALA HA 1 95 THR HB 3.650 . 5.500 4.804 4.653 5.121 . 0 0 "[ . 1 . 2]" 1
1173 1 94 ALA HA 1 107 LEU H 2.970 . 4.140 4.235 4.165 4.295 0.155 17 0 "[ . 1 . 2]" 1
1174 1 94 ALA MB 1 95 THR H 2.740 . 3.680 2.650 2.045 3.045 . 0 0 "[ . 1 . 2]" 1
1175 1 94 ALA MB 1 95 THR HB 3.730 . 5.660 4.609 4.111 4.888 . 0 0 "[ . 1 . 2]" 1
1176 1 94 ALA MB 1 96 LEU QD 5.460 . 9.130 3.036 2.694 3.355 . 0 0 "[ . 1 . 2]" 1
1177 1 94 ALA MB 1 106 ALA MB 4.680 . 7.560 2.158 1.777 2.747 0.023 18 0 "[ . 1 . 2]" 1
1178 1 94 ALA MB 1 107 LEU H 4.160 . 6.530 2.738 2.041 3.298 . 0 0 "[ . 1 . 2]" 1
1179 1 94 ALA MB 1 107 LEU HA 4.040 . 6.280 4.460 3.655 5.211 . 0 0 "[ . 1 . 2]" 1
1180 1 95 THR H 1 95 THR HB 2.470 . 3.140 2.599 2.504 2.666 . 0 0 "[ . 1 . 2]" 1
1181 1 95 THR H 1 95 THR MG 3.310 . 4.820 3.787 3.749 3.860 . 0 0 "[ . 1 . 2]" 1
1182 1 95 THR H 1 96 LEU H 3.380 . 4.970 4.488 4.347 4.546 . 0 0 "[ . 1 . 2]" 1
1183 1 95 THR H 1 96 LEU MD1 4.160 . 6.530 5.067 4.620 5.323 . 0 0 "[ . 1 . 2]" 1
1184 1 95 THR H 1 96 LEU QD 3.970 . 6.150 4.136 3.814 4.262 . 0 0 "[ . 1 . 2]" 1
1185 1 95 THR H 1 96 LEU MD2 4.160 . 6.530 4.389 4.065 4.595 . 0 0 "[ . 1 . 2]" 1
1186 1 95 THR H 1 106 ALA MB 3.390 . 4.980 4.114 3.391 4.567 . 0 0 "[ . 1 . 2]" 1
1187 1 95 THR H 1 107 LEU H 2.530 . 3.270 2.795 2.180 3.170 . 0 0 "[ . 1 . 2]" 1
1188 1 95 THR H 1 107 LEU HB2 3.590 . 5.380 3.588 1.753 4.648 0.047 4 0 "[ . 1 . 2]" 1
1189 1 95 THR H 1 107 LEU HB3 3.150 . 4.510 2.998 2.371 3.626 . 0 0 "[ . 1 . 2]" 1
1190 1 95 THR H 1 107 LEU QD 4.950 . 8.100 4.071 3.294 4.647 . 0 0 "[ . 1 . 2]" 1
1191 1 95 THR HA 1 96 LEU H 2.250 . 2.710 2.198 2.163 2.232 . 0 0 "[ . 1 . 2]" 1
1192 1 95 THR HA 1 107 LEU HB3 3.650 . 5.500 5.045 4.353 5.612 0.112 3 0 "[ . 1 . 2]" 1
1193 1 95 THR HB 1 96 LEU H 3.210 . 4.630 4.101 3.945 4.223 . 0 0 "[ . 1 . 2]" 1
1194 1 95 THR HB 1 107 LEU H 3.620 . 5.440 3.313 2.988 3.833 . 0 0 "[ . 1 . 2]" 1
1195 1 95 THR HB 1 107 LEU HA 3.650 . 5.500 4.776 4.474 5.386 . 0 0 "[ . 1 . 2]" 1
1196 1 95 THR HB 1 107 LEU HB2 3.650 . 5.500 2.568 1.742 3.549 0.058 5 0 "[ . 1 . 2]" 1
1197 1 95 THR HB 1 107 LEU HB3 3.380 . 4.970 2.533 1.875 3.877 . 0 0 "[ . 1 . 2]" 1
1198 1 95 THR MG 1 96 LEU H 2.800 . 3.800 2.706 2.523 2.895 . 0 0 "[ . 1 . 2]" 1
1199 1 95 THR MG 1 107 LEU HG 4.160 . 6.530 4.532 3.771 5.312 . 0 0 "[ . 1 . 2]" 1
1200 1 96 LEU H 1 96 LEU QB 2.440 . 3.080 2.368 2.326 2.408 . 0 0 "[ . 1 . 2]" 1
1201 1 96 LEU H 1 96 LEU MD1 3.880 . 5.970 3.611 3.430 3.736 . 0 0 "[ . 1 . 2]" 1
1202 1 96 LEU H 1 96 LEU QD 3.280 . 4.760 2.220 2.110 2.331 . 0 0 "[ . 1 . 2]" 1
1203 1 96 LEU H 1 96 LEU MD2 3.880 . 5.970 2.240 2.129 2.355 . 0 0 "[ . 1 . 2]" 1
1204 1 96 LEU H 1 96 LEU HG 3.140 . 4.480 4.183 4.154 4.213 . 0 0 "[ . 1 . 2]" 1
1205 1 96 LEU H 1 97 VAL H 3.210 . 4.630 4.456 4.439 4.508 . 0 0 "[ . 1 . 2]" 1
1206 1 96 LEU HA 1 96 LEU MD1 3.110 . 4.420 1.905 1.860 1.946 . 0 0 "[ . 1 . 2]" 1
1207 1 96 LEU HA 1 96 LEU QD 2.930 . 4.070 1.882 1.835 1.924 . 0 0 "[ . 1 . 2]" 1
1208 1 96 LEU HA 1 96 LEU MD2 3.110 . 4.420 2.936 2.818 3.079 . 0 0 "[ . 1 . 2]" 1
1209 1 96 LEU HA 1 97 VAL H 2.180 . 2.560 2.125 2.105 2.165 . 0 0 "[ . 1 . 2]" 1
1210 1 96 LEU HA 1 106 ALA HA 2.550 . 3.300 2.544 2.366 2.756 . 0 0 "[ . 1 . 2]" 1
1211 1 96 LEU HA 1 106 ALA MB 4.160 . 6.530 3.429 2.747 3.819 . 0 0 "[ . 1 . 2]" 1
1212 1 96 LEU QB 1 97 VAL H . . 3.210 3.173 3.116 3.196 . 0 0 "[ . 1 . 2]" 1
1213 1 96 LEU QB 1 98 PHE QD 3.650 . 5.500 2.797 2.498 3.049 . 0 0 "[ . 1 . 2]" 1
1214 1 96 LEU QB 1 98 PHE QE 3.650 . 5.500 2.315 1.979 2.648 . 0 0 "[ . 1 . 2]" 1
1215 1 96 LEU QB 1 103 LEU QD 3.760 . 5.720 2.717 2.261 3.588 . 0 0 "[ . 1 . 2]" 1
1216 1 96 LEU QD 1 97 VAL H 4.950 . 8.100 3.281 3.177 3.407 . 0 0 "[ . 1 . 2]" 1
1217 1 96 LEU QD 1 103 LEU QD 4.160 . 6.520 2.279 1.963 3.073 . 0 0 "[ . 1 . 2]" 1
1218 1 96 LEU QD 1 106 ALA HA 3.290 . 4.780 2.680 2.245 3.374 . 0 0 "[ . 1 . 2]" 1
1219 1 96 LEU QD 1 106 ALA MB 4.160 . 6.520 2.278 2.011 2.673 . 0 0 "[ . 1 . 2]" 1
1220 1 96 LEU QD 1 107 LEU H 4.950 . 8.100 3.772 3.478 4.057 . 0 0 "[ . 1 . 2]" 1
1221 1 96 LEU MD1 1 103 LEU QD 4.290 . 6.780 2.289 1.968 3.101 . 0 0 "[ . 1 . 2]" 1
1222 1 96 LEU MD1 1 106 ALA HA 3.530 . 5.260 2.709 2.263 3.436 . 0 0 "[ . 1 . 2]" 1
1223 1 96 LEU MD1 1 106 ALA MB 4.680 . 7.560 2.302 2.025 2.714 . 0 0 "[ . 1 . 2]" 1
1224 1 96 LEU MD2 1 103 LEU QD 4.290 . 6.780 4.255 3.926 5.010 . 0 0 "[ . 1 . 2]" 1
1225 1 96 LEU MD2 1 106 ALA HA 3.530 . 5.260 4.301 3.760 4.920 . 0 0 "[ . 1 . 2]" 1
1226 1 96 LEU MD2 1 106 ALA MB 4.680 . 7.560 3.653 3.358 4.137 . 0 0 "[ . 1 . 2]" 1
1227 1 96 LEU HG 1 97 VAL H 3.650 . 5.500 5.209 5.162 5.290 . 0 0 "[ . 1 . 2]" 1
1228 1 96 LEU HG 1 103 LEU QD 4.160 . 6.530 3.620 3.222 4.486 . 0 0 "[ . 1 . 2]" 1
1229 1 97 VAL H 1 97 VAL HB 2.330 . 2.870 2.590 2.537 2.648 . 0 0 "[ . 1 . 2]" 1
1230 1 97 VAL H 1 97 VAL MG2 2.610 . 3.430 2.375 2.290 2.442 . 0 0 "[ . 1 . 2]" 1
1231 1 97 VAL H 1 98 PHE H 3.240 . 4.690 4.264 4.150 4.410 . 0 0 "[ . 1 . 2]" 1
1232 1 97 VAL H 1 103 LEU QD 2.890 . 3.990 2.892 2.568 3.649 . 0 0 "[ . 1 . 2]" 1
1233 1 97 VAL H 1 105 GLY H 2.670 . 3.550 3.320 3.067 3.569 0.019 4 0 "[ . 1 . 2]" 1
1234 1 97 VAL H 1 105 GLY QA 3.360 . 4.920 4.339 4.221 4.455 . 0 0 "[ . 1 . 2]" 1
1235 1 97 VAL H 1 106 ALA HA 2.620 . 3.450 3.067 2.696 3.469 0.019 18 0 "[ . 1 . 2]" 1
1236 1 97 VAL H 1 106 ALA MB 4.160 . 6.530 4.351 3.378 4.874 . 0 0 "[ . 1 . 2]" 1
1237 1 97 VAL HA 1 98 PHE H 2.210 . 2.620 2.143 2.118 2.185 . 0 0 "[ . 1 . 2]" 1
1238 1 97 VAL HA 1 98 PHE QD 3.650 . 5.500 4.284 4.070 4.496 . 0 0 "[ . 1 . 2]" 1
1239 1 97 VAL HB 1 98 PHE H 3.450 . 5.100 4.322 4.230 4.400 . 0 0 "[ . 1 . 2]" 1
1240 1 97 VAL HB 1 105 GLY H 3.150 . 4.510 2.858 2.469 3.425 . 0 0 "[ . 1 . 2]" 1
1241 1 97 VAL HB 1 123 ILE MD 4.160 . 6.530 4.237 2.830 6.176 . 0 0 "[ . 1 . 2]" 1
1242 1 97 VAL MG1 1 98 PHE H 3.060 . 4.330 3.073 2.834 3.302 . 0 0 "[ . 1 . 2]" 1
1243 1 97 VAL MG1 1 99 THR MG 4.260 . 6.720 3.140 2.429 4.586 . 0 0 "[ . 1 . 2]" 1
1244 1 97 VAL MG1 1 105 GLY H 3.900 . 6.000 4.094 3.678 4.661 . 0 0 "[ . 1 . 2]" 1
1245 1 97 VAL MG2 1 98 PHE H 3.790 . 5.780 4.196 4.108 4.272 . 0 0 "[ . 1 . 2]" 1
1246 1 97 VAL MG2 1 105 GLY QA 4.590 . 7.380 4.318 3.825 4.835 . 0 0 "[ . 1 . 2]" 1
1247 1 97 VAL MG2 1 106 ALA HA 3.820 . 5.850 3.205 2.144 3.885 . 0 0 "[ . 1 . 2]" 1
1248 1 97 VAL MG2 1 106 ALA MB 4.680 . 7.560 4.472 3.657 5.038 . 0 0 "[ . 1 . 2]" 1
1249 1 97 VAL MG2 1 107 LEU H 3.850 . 5.910 3.648 3.277 4.206 . 0 0 "[ . 1 . 2]" 1
1250 1 98 PHE H 1 98 PHE HB2 2.730 . 3.670 2.417 2.352 2.495 . 0 0 "[ . 1 . 2]" 1
1251 1 98 PHE H 1 98 PHE HB3 2.900 . 4.010 3.609 3.561 3.657 . 0 0 "[ . 1 . 2]" 1
1252 1 98 PHE H 1 98 PHE QD 3.010 . 4.230 3.240 3.073 3.412 . 0 0 "[ . 1 . 2]" 1
1253 1 98 PHE H 1 99 THR H 3.320 . 4.850 4.393 4.285 4.472 . 0 0 "[ . 1 . 2]" 1
1254 1 98 PHE HA 1 98 PHE QD 3.630 . 5.470 2.772 2.638 2.914 . 0 0 "[ . 1 . 2]" 1
1255 1 98 PHE HA 1 98 PHE QE 3.650 . 5.500 4.399 4.324 4.444 . 0 0 "[ . 1 . 2]" 1
1256 1 98 PHE HA 1 99 THR H 2.210 . 2.620 2.121 2.072 2.177 . 0 0 "[ . 1 . 2]" 1
1257 1 98 PHE HA 1 103 LEU HA 2.840 . 3.890 2.658 2.322 3.085 . 0 0 "[ . 1 . 2]" 1
1258 1 98 PHE HA 1 103 LEU QD 4.160 . 6.530 3.361 2.989 3.815 . 0 0 "[ . 1 . 2]" 1
1259 1 98 PHE HA 1 104 ARG H 2.580 . 3.360 3.042 2.485 3.352 . 0 0 "[ . 1 . 2]" 1
1260 1 98 PHE HB2 1 99 THR H 3.180 . 4.570 4.266 4.115 4.384 . 0 0 "[ . 1 . 2]" 1
1261 1 98 PHE HB3 1 99 THR H 2.750 . 3.700 3.187 2.938 3.416 . 0 0 "[ . 1 . 2]" 1
1262 1 98 PHE QD 1 103 LEU QD 4.160 . 6.530 3.294 3.069 3.525 . 0 0 "[ . 1 . 2]" 1
1263 1 98 PHE QE 1 99 THR H 3.650 . 5.500 5.439 5.405 5.469 . 0 0 "[ . 1 . 2]" 1
1264 1 98 PHE QE 1 103 LEU HB2 3.650 . 5.500 2.334 2.031 2.699 . 0 0 "[ . 1 . 2]" 1
1265 1 98 PHE QE 1 103 LEU HB3 3.650 . 5.500 3.791 3.566 4.109 . 0 0 "[ . 1 . 2]" 1
1266 1 98 PHE QE 1 103 LEU QD 4.160 . 6.280 2.674 2.532 2.822 . 0 0 "[ . 1 . 2]" 1
1267 1 98 PHE HZ 1 103 LEU QD 4.160 . 6.530 2.587 2.288 2.790 . 0 0 "[ . 1 . 2]" 1
1268 1 98 PHE HZ 1 103 LEU HG 3.650 . 5.500 5.264 5.060 5.499 . 0 0 "[ . 1 . 2]" 1
1269 1 99 THR H 1 99 THR MG 3.310 . 4.820 3.525 2.983 4.043 . 0 0 "[ . 1 . 2]" 1
1270 1 99 THR H 1 100 ASP H 3.150 . 4.510 4.251 4.160 4.336 . 0 0 "[ . 1 . 2]" 1
1271 1 99 THR H 1 102 LYS H 2.450 . 3.110 3.068 2.795 3.253 0.143 7 0 "[ . 1 . 2]" 1
1272 1 99 THR H 1 104 ARG H 3.200 . 4.600 3.991 3.573 4.278 . 0 0 "[ . 1 . 2]" 1
1273 1 99 THR H 1 104 ARG QB 3.480 . 5.170 4.654 3.456 5.186 0.016 17 0 "[ . 1 . 2]" 1
1274 1 99 THR H 1 104 ARG QG 3.580 . 5.360 3.289 2.345 5.376 0.016 13 0 "[ . 1 . 2]" 1
1275 1 99 THR HA 1 100 ASP H 2.210 . 2.620 2.214 2.132 2.309 . 0 0 "[ . 1 . 2]" 1
1276 1 99 THR HA 1 101 GLY H 2.860 . 3.920 3.319 3.032 3.640 . 0 0 "[ . 1 . 2]" 1
1277 1 99 THR HB 1 100 ASP H 2.590 . 3.390 3.165 2.688 3.582 0.192 4 0 "[ . 1 . 2]" 1
1278 1 99 THR MG 1 100 ASP H 3.430 . 5.070 3.314 2.126 3.932 . 0 0 "[ . 1 . 2]" 1
1279 1 99 THR MG 1 104 ARG QG 4.040 . 6.290 3.337 2.413 4.167 . 0 0 "[ . 1 . 2]" 1
1280 1 100 ASP H 1 100 ASP HA 2.240 . 2.680 2.274 2.249 2.291 . 0 0 "[ . 1 . 2]" 1
1281 1 100 ASP H 1 100 ASP HB2 2.900 . 4.010 3.413 3.055 3.981 . 0 0 "[ . 1 . 2]" 1
1282 1 100 ASP H 1 100 ASP QB 2.800 . 3.810 3.040 2.925 3.414 . 0 0 "[ . 1 . 2]" 1
1283 1 100 ASP H 1 100 ASP HB3 2.900 . 4.010 3.623 3.025 4.106 0.096 3 0 "[ . 1 . 2]" 1
1284 1 100 ASP H 1 101 GLY H 2.590 . 3.390 2.643 2.512 2.784 . 0 0 "[ . 1 . 2]" 1
1285 1 100 ASP H 1 102 LYS H 3.140 . 4.480 4.160 4.027 4.346 . 0 0 "[ . 1 . 2]" 1
1286 1 100 ASP HA 1 101 GLY H 2.380 . 2.960 3.020 2.973 3.079 0.119 1 0 "[ . 1 . 2]" 1
1287 1 100 ASP QB 1 101 GLY H 3.080 . 4.370 3.777 3.639 4.024 . 0 0 "[ . 1 . 2]" 1
1288 1 100 ASP QB 1 102 LYS H 2.920 . 4.050 3.308 2.911 4.025 . 0 0 "[ . 1 . 2]" 1
1289 1 100 ASP QB 1 102 LYS QD 4.520 . 7.250 3.967 2.060 5.973 . 0 0 "[ . 1 . 2]" 1
1290 1 100 ASP HB2 1 101 GLY H 3.180 . 4.570 4.378 3.879 4.582 0.012 13 0 "[ . 1 . 2]" 1
1291 1 100 ASP HB2 1 102 LYS H 3.060 . 4.320 4.210 3.128 4.608 0.288 8 0 "[ . 1 . 2]" 1
1292 1 100 ASP HB3 1 101 GLY H 3.180 . 4.570 4.175 3.878 4.516 . 0 0 "[ . 1 . 2]" 1
1293 1 100 ASP HB3 1 102 LYS H 3.060 . 4.320 3.691 2.955 4.620 0.300 7 0 "[ . 1 . 2]" 1
1294 1 101 GLY H 1 102 LYS H 2.450 . 3.110 2.574 2.466 2.649 . 0 0 "[ . 1 . 2]" 1
1295 1 101 GLY HA2 1 102 LYS H 2.720 . 3.640 3.247 3.049 3.398 . 0 0 "[ . 1 . 2]" 1
1296 1 101 GLY HA3 1 102 LYS H 2.720 . 3.640 3.320 3.179 3.469 . 0 0 "[ . 1 . 2]" 1
1297 1 102 LYS H 1 102 LYS HB2 2.760 . 3.730 2.667 2.401 3.093 . 0 0 "[ . 1 . 2]" 1
1298 1 102 LYS H 1 102 LYS QB 2.600 . 3.410 2.525 2.355 2.695 . 0 0 "[ . 1 . 2]" 1
1299 1 102 LYS H 1 102 LYS HB3 2.760 . 3.730 3.474 2.508 3.798 0.068 16 0 "[ . 1 . 2]" 1
1300 1 102 LYS H 1 102 LYS QG 3.160 . 4.520 3.164 2.421 4.210 . 0 0 "[ . 1 . 2]" 1
1301 1 102 LYS HA 1 102 LYS HD2 3.650 . 5.500 4.326 3.050 4.843 . 0 0 "[ . 1 . 2]" 1
1302 1 102 LYS HA 1 102 LYS HD3 3.650 . 5.500 4.112 2.024 4.849 . 0 0 "[ . 1 . 2]" 1
1303 1 102 LYS HA 1 102 LYS QE 4.090 . 6.380 4.588 3.729 5.204 . 0 0 "[ . 1 . 2]" 1
1304 1 102 LYS HA 1 103 LEU H 2.450 . 3.110 2.301 2.207 2.588 . 0 0 "[ . 1 . 2]" 1
1305 1 102 LYS QB 1 102 LYS QD 2.430 . 3.060 2.192 2.061 2.380 . 0 0 "[ . 1 . 2]" 1
1306 1 102 LYS QB 1 102 LYS QE 3.480 . 5.160 3.378 1.990 3.795 . 0 0 "[ . 1 . 2]" 1
1307 1 102 LYS QB 1 103 LEU H 2.820 . 3.840 2.822 2.025 3.614 . 0 0 "[ . 1 . 2]" 1
1308 1 102 LYS HB2 1 102 LYS HD2 2.930 . 4.070 2.912 2.195 3.765 . 0 0 "[ . 1 . 2]" 1
1309 1 102 LYS HB2 1 102 LYS HD3 2.930 . 4.070 3.121 2.287 3.836 . 0 0 "[ . 1 . 2]" 1
1310 1 102 LYS HB2 1 102 LYS HE2 3.650 . 5.500 4.381 2.842 5.479 . 0 0 "[ . 1 . 2]" 1
1311 1 102 LYS HB2 1 102 LYS HE3 3.650 . 5.500 4.352 2.184 5.501 0.001 10 0 "[ . 1 . 2]" 1
1312 1 102 LYS HB3 1 102 LYS HD2 2.930 . 4.070 3.041 2.310 4.117 0.047 8 0 "[ . 1 . 2]" 1
1313 1 102 LYS HB3 1 102 LYS HD3 2.930 . 4.070 2.882 2.476 3.729 . 0 0 "[ . 1 . 2]" 1
1314 1 102 LYS HB3 1 102 LYS HE2 3.650 . 5.500 4.337 2.075 5.475 . 0 0 "[ . 1 . 2]" 1
1315 1 102 LYS HB3 1 102 LYS HE3 3.650 . 5.500 4.385 2.821 4.883 . 0 0 "[ . 1 . 2]" 1
1316 1 102 LYS QG 1 103 LEU H 3.950 . 6.100 3.613 2.204 4.592 . 0 0 "[ . 1 . 2]" 1
1317 1 103 LEU H 1 103 LEU QB 2.770 . 3.750 2.264 2.233 2.301 . 0 0 "[ . 1 . 2]" 1
1318 1 103 LEU H 1 103 LEU QD 4.010 . 6.090 3.780 3.750 3.819 . 0 0 "[ . 1 . 2]" 1
1319 1 103 LEU H 1 103 LEU HG 3.650 . 5.500 4.417 4.377 4.452 . 0 0 "[ . 1 . 2]" 1
1320 1 103 LEU HA 1 103 LEU QD 3.010 . 4.230 2.097 2.034 2.156 . 0 0 "[ . 1 . 2]" 1
1321 1 103 LEU HA 1 104 ARG H 2.310 . 2.830 2.149 2.114 2.207 . 0 0 "[ . 1 . 2]" 1
1322 1 103 LEU HA 1 105 GLY H 2.900 . 4.010 3.771 3.567 4.023 0.013 13 0 "[ . 1 . 2]" 1
1323 1 103 LEU QB 1 104 ARG H 3.610 . 5.420 3.783 3.646 3.914 . 0 0 "[ . 1 . 2]" 1
1324 1 103 LEU QD 1 104 ARG H 3.010 . 4.230 2.328 2.083 2.672 . 0 0 "[ . 1 . 2]" 1
1325 1 103 LEU QD 1 104 ARG HA 4.160 . 6.530 4.309 4.151 4.450 . 0 0 "[ . 1 . 2]" 1
1326 1 103 LEU QD 1 105 GLY H 2.740 . 3.680 2.361 2.032 2.692 . 0 0 "[ . 1 . 2]" 1
1327 1 103 LEU QD 1 105 GLY QA 4.600 . 7.410 3.001 2.631 3.293 . 0 0 "[ . 1 . 2]" 1
1328 1 103 LEU HG 1 104 ARG H 3.650 . 5.500 3.279 2.841 3.708 . 0 0 "[ . 1 . 2]" 1
1329 1 103 LEU HG 1 105 GLY H 3.630 . 5.470 2.871 2.398 3.488 . 0 0 "[ . 1 . 2]" 1
1330 1 104 ARG H 1 104 ARG HB2 2.970 . 4.140 2.464 2.236 2.613 . 0 0 "[ . 1 . 2]" 1
1331 1 104 ARG H 1 104 ARG QB 2.760 . 3.730 2.419 2.207 2.568 . 0 0 "[ . 1 . 2]" 1
1332 1 104 ARG H 1 104 ARG HB3 2.970 . 4.140 3.590 2.766 3.763 . 0 0 "[ . 1 . 2]" 1
1333 1 104 ARG H 1 104 ARG HG2 3.650 . 5.500 2.806 2.182 4.691 . 0 0 "[ . 1 . 2]" 1
1334 1 104 ARG H 1 104 ARG HG3 3.650 . 5.500 3.955 3.539 4.541 . 0 0 "[ . 1 . 2]" 1
1335 1 104 ARG H 1 105 GLY H 2.280 . 2.770 2.223 1.993 2.436 . 0 0 "[ . 1 . 2]" 1
1336 1 104 ARG HA 1 104 ARG QD 3.270 . 4.740 2.384 1.785 3.274 0.015 6 0 "[ . 1 . 2]" 1
1337 1 104 ARG QB 1 105 GLY H 2.710 . 3.630 2.699 2.340 2.926 . 0 0 "[ . 1 . 2]" 1
1338 1 104 ARG QB 1 123 ILE MD 3.560 . 5.330 3.855 3.090 4.533 . 0 0 "[ . 1 . 2]" 1
1339 1 104 ARG QB 1 123 ILE MG 3.650 . 5.500 2.002 1.779 2.620 0.021 19 0 "[ . 1 . 2]" 1
1340 1 104 ARG HB2 1 105 GLY H 2.830 . 3.860 2.832 2.373 3.478 . 0 0 "[ . 1 . 2]" 1
1341 1 104 ARG HB2 1 123 ILE MD 3.740 . 5.690 4.614 3.476 5.852 0.162 13 0 "[ . 1 . 2]" 1
1342 1 104 ARG HB2 1 123 ILE MG 3.760 . 5.720 2.659 1.992 3.766 . 0 0 "[ . 1 . 2]" 1
1343 1 104 ARG HB3 1 105 GLY H 2.830 . 3.860 3.671 2.390 3.956 0.096 2 0 "[ . 1 . 2]" 1
1344 1 104 ARG HB3 1 123 ILE MD 3.740 . 5.690 4.227 3.400 5.138 . 0 0 "[ . 1 . 2]" 1
1345 1 104 ARG HB3 1 123 ILE MG 3.760 . 5.720 2.127 1.793 2.673 0.007 1 0 "[ . 1 . 2]" 1
1346 1 104 ARG QD 1 123 ILE MG 4.600 . 7.410 3.619 2.512 4.441 . 0 0 "[ . 1 . 2]" 1
1347 1 104 ARG QG 1 123 ILE MG 4.600 . 7.410 2.884 1.748 3.609 0.042 13 0 "[ . 1 . 2]" 1
1348 1 104 ARG HG2 1 105 GLY H 3.650 . 5.500 4.406 4.068 5.136 . 0 0 "[ . 1 . 2]" 1
1349 1 104 ARG HG3 1 105 GLY H 3.650 . 5.500 5.003 4.206 5.282 . 0 0 "[ . 1 . 2]" 1
1350 1 105 GLY H 1 106 ALA H 3.310 . 4.820 4.377 4.330 4.444 . 0 0 "[ . 1 . 2]" 1
1351 1 105 GLY H 1 123 ILE MG 3.310 . 4.820 3.906 3.072 4.808 . 0 0 "[ . 1 . 2]" 1
1352 1 105 GLY QA 1 106 ALA MB 4.140 . 6.480 3.689 3.559 3.761 . 0 0 "[ . 1 . 2]" 1
1353 1 105 GLY QA 1 123 ILE MD 4.230 . 6.660 3.505 2.205 4.588 . 0 0 "[ . 1 . 2]" 1
1354 1 105 GLY HA2 1 106 ALA H 2.590 . 3.390 2.687 2.455 2.821 . 0 0 "[ . 1 . 2]" 1
1355 1 105 GLY HA3 1 106 ALA H 2.590 . 3.390 2.436 2.322 2.674 . 0 0 "[ . 1 . 2]" 1
1356 1 106 ALA HA 1 107 LEU H 2.280 . 2.770 2.343 2.200 2.551 . 0 0 "[ . 1 . 2]" 1
1357 1 106 ALA MB 1 107 LEU H 2.740 . 3.680 2.549 2.208 2.871 . 0 0 "[ . 1 . 2]" 1
1358 1 107 LEU H 1 107 LEU HB2 2.550 . 3.300 2.581 2.176 2.953 . 0 0 "[ . 1 . 2]" 1
1359 1 107 LEU H 1 107 LEU HB3 2.640 . 3.490 3.002 2.486 3.510 0.020 5 0 "[ . 1 . 2]" 1
1360 1 107 LEU H 1 107 LEU QD 3.600 . 5.400 3.476 2.387 3.816 . 0 0 "[ . 1 . 2]" 1
1361 1 107 LEU HB2 1 107 LEU HG 2.380 . 2.960 2.482 2.364 3.015 0.055 20 0 "[ . 1 . 2]" 1
1362 1 107 LEU HB3 1 107 LEU HG 2.100 . 2.400 2.440 2.372 2.487 0.087 8 0 "[ . 1 . 2]" 1
1363 1 107 LEU QD 1 116 LEU HA 3.850 . 5.910 3.512 2.121 4.892 . 0 0 "[ . 1 . 2]" 1
1364 1 107 LEU QD 1 119 LEU HG 4.170 . 6.550 4.458 2.793 6.055 . 0 0 "[ . 1 . 2]" 1
1365 1 107 LEU QD 1 120 MET H 3.580 . 5.370 3.823 2.786 4.814 . 0 0 "[ . 1 . 2]" 1
1366 1 107 LEU QD 1 120 MET HA 3.360 . 4.920 3.251 2.760 3.964 . 0 0 "[ . 1 . 2]" 1
1367 1 107 LEU QD 1 120 MET QB 5.390 . 8.980 2.848 2.062 3.926 . 0 0 "[ . 1 . 2]" 1
1368 1 107 LEU MD1 1 116 LEU HA 4.160 . 6.530 3.763 2.146 5.408 . 0 0 "[ . 1 . 2]" 1
1369 1 107 LEU MD1 1 120 MET HA 3.560 . 5.320 4.769 3.455 5.380 0.060 17 0 "[ . 1 . 2]" 1
1370 1 107 LEU MD2 1 116 LEU HA 4.160 . 6.530 4.641 3.057 6.395 . 0 0 "[ . 1 . 2]" 1
1371 1 107 LEU MD2 1 120 MET HA 3.560 . 5.320 3.529 2.778 5.391 0.071 20 0 "[ . 1 . 2]" 1
1372 1 110 ILE H 1 110 ILE QG 4.090 . 6.380 2.506 1.788 4.060 0.012 12 0 "[ . 1 . 2]" 1
1373 1 110 ILE MD 1 110 ILE MG 3.130 . 4.460 2.128 1.895 3.204 . 0 0 "[ . 1 . 2]" 1
1374 1 113 TRP HA 1 113 TRP HD1 3.650 . 5.500 3.888 3.460 4.380 . 0 0 "[ . 1 . 2]" 1
1375 1 113 TRP HA 1 113 TRP HE1 3.650 . 5.500 5.240 4.854 5.566 0.066 4 0 "[ . 1 . 2]" 1
1376 1 113 TRP HA 1 113 TRP HE3 3.540 . 5.280 3.377 2.644 3.879 . 0 0 "[ . 1 . 2]" 1
1377 1 113 TRP HA 1 116 LEU H 3.240 . 4.690 3.618 2.854 4.463 . 0 0 "[ . 1 . 2]" 1
1378 1 113 TRP QB 1 114 ALA H 3.120 . 4.440 2.812 1.749 3.875 0.051 17 0 "[ . 1 . 2]" 1
1379 1 113 TRP HB2 1 114 ALA H 3.410 . 5.030 3.846 3.278 4.462 . 0 0 "[ . 1 . 2]" 1
1380 1 113 TRP HB3 1 114 ALA H 3.410 . 5.030 2.971 1.755 4.296 0.035 17 0 "[ . 1 . 2]" 1
1381 1 113 TRP HD1 1 114 ALA H 3.650 . 5.500 2.637 1.738 3.963 0.062 14 0 "[ . 1 . 2]" 1
1382 1 113 TRP HD1 1 114 ALA MB 4.110 . 6.430 3.810 3.261 4.568 . 0 0 "[ . 1 . 2]" 1
1383 1 113 TRP HD1 1 115 GLU H 3.650 . 5.500 5.584 5.489 5.686 0.186 20 0 "[ . 1 . 2]" 1
1384 1 113 TRP HE1 1 117 LEU MD2 2.750 . 3.710 2.413 1.920 3.356 . 0 0 "[ . 1 . 2]" 1
1385 1 113 TRP HE3 1 114 ALA H 3.650 . 5.500 5.314 4.651 5.700 0.200 7 0 "[ . 1 . 2]" 1
1386 1 113 TRP HE3 1 116 LEU MD2 4.160 . 6.530 5.091 3.949 5.853 . 0 0 "[ . 1 . 2]" 1
1387 1 113 TRP HH2 1 116 LEU MD2 3.980 . 6.160 4.977 4.182 5.591 . 0 0 "[ . 1 . 2]" 1
1388 1 113 TRP HZ2 1 116 LEU MD2 3.490 . 5.190 5.092 4.454 5.335 0.145 3 0 "[ . 1 . 2]" 1
1389 1 113 TRP HZ2 1 117 LEU MD2 3.310 . 4.820 3.232 1.880 4.528 . 0 0 "[ . 1 . 2]" 1
1390 1 114 ALA H 1 115 GLU H 3.100 . 4.410 3.323 1.765 4.137 0.025 19 0 "[ . 1 . 2]" 1
1391 1 114 ALA HA 1 117 LEU QB 3.280 . 4.770 4.046 2.824 4.796 0.026 3 0 "[ . 1 . 2]" 1
1392 1 114 ALA MB 1 115 GLU H 3.050 . 4.300 2.096 1.803 2.991 . 0 0 "[ . 1 . 2]" 1
1393 1 114 ALA MB 1 115 GLU QG 4.120 . 6.450 2.990 2.242 4.135 . 0 0 "[ . 1 . 2]" 1
1394 1 115 GLU H 1 115 GLU HB2 2.980 . 4.170 2.836 2.342 3.614 . 0 0 "[ . 1 . 2]" 1
1395 1 115 GLU H 1 115 GLU HB3 2.980 . 4.170 3.339 2.617 3.674 . 0 0 "[ . 1 . 2]" 1
1396 1 115 GLU H 1 115 GLU QG 3.140 . 4.490 2.201 1.753 3.365 0.037 17 0 "[ . 1 . 2]" 1
1397 1 115 GLU H 1 116 LEU H 2.390 . 2.990 2.450 1.947 2.636 . 0 0 "[ . 1 . 2]" 1
1398 1 115 GLU HA 1 115 GLU QG 2.870 . 3.950 2.948 2.413 3.410 . 0 0 "[ . 1 . 2]" 1
1399 1 115 GLU QB 1 119 LEU MD1 4.600 . 7.410 5.166 3.081 6.488 . 0 0 "[ . 1 . 2]" 1
1400 1 115 GLU HB2 1 116 LEU H 3.650 . 5.500 3.188 2.634 4.033 . 0 0 "[ . 1 . 2]" 1
1401 1 115 GLU HB3 1 116 LEU H 3.650 . 5.500 3.956 3.481 4.308 . 0 0 "[ . 1 . 2]" 1
1402 1 115 GLU QG 1 116 LEU H 3.220 . 4.650 3.588 2.294 4.508 . 0 0 "[ . 1 . 2]" 1
1403 1 115 GLU HG2 1 116 LEU H 3.650 . 5.500 4.017 2.478 5.114 . 0 0 "[ . 1 . 2]" 1
1404 1 115 GLU HG3 1 116 LEU H 3.650 . 5.500 4.250 2.379 5.462 . 0 0 "[ . 1 . 2]" 1
1405 1 116 LEU H 1 116 LEU HB2 2.560 . 3.330 2.280 2.061 2.426 . 0 0 "[ . 1 . 2]" 1
1406 1 116 LEU H 1 116 LEU QB 2.460 . 3.120 2.153 2.040 2.205 . 0 0 "[ . 1 . 2]" 1
1407 1 116 LEU H 1 116 LEU HB3 2.560 . 3.330 2.715 2.506 3.382 0.052 11 0 "[ . 1 . 2]" 1
1408 1 116 LEU H 1 116 LEU MD1 3.540 . 5.290 4.094 3.545 4.170 . 0 0 "[ . 1 . 2]" 1
1409 1 116 LEU H 1 116 LEU MD2 3.910 . 6.030 4.241 4.125 4.311 . 0 0 "[ . 1 . 2]" 1
1410 1 116 LEU H 1 116 LEU HG 3.240 . 4.690 4.271 3.167 4.444 . 0 0 "[ . 1 . 2]" 1
1411 1 116 LEU H 1 117 LEU H 2.450 . 3.110 2.750 2.638 2.830 . 0 0 "[ . 1 . 2]" 1
1412 1 116 LEU H 1 117 LEU QB 3.640 . 5.480 4.684 4.464 4.822 . 0 0 "[ . 1 . 2]" 1
1413 1 116 LEU HA 1 116 LEU MD1 3.230 . 4.670 3.684 3.555 3.768 . 0 0 "[ . 1 . 2]" 1
1414 1 116 LEU HA 1 116 LEU MD2 3.260 . 4.730 3.012 2.216 3.411 . 0 0 "[ . 1 . 2]" 1
1415 1 116 LEU HA 1 119 LEU H 2.840 . 3.890 3.576 3.269 3.761 . 0 0 "[ . 1 . 2]" 1
1416 1 116 LEU HA 1 120 MET H 2.660 . 3.520 3.563 3.112 3.695 0.175 14 0 "[ . 1 . 2]" 1
1417 1 116 LEU QB 1 117 LEU H 2.600 . 3.400 2.550 2.367 2.833 . 0 0 "[ . 1 . 2]" 1
1418 1 116 LEU HB2 1 117 LEU H 2.760 . 3.730 3.691 3.064 3.852 0.122 6 0 "[ . 1 . 2]" 1
1419 1 116 LEU HB3 1 117 LEU H 2.760 . 3.730 2.620 2.396 3.337 . 0 0 "[ . 1 . 2]" 1
1420 1 116 LEU MD2 1 117 LEU H 4.160 . 6.530 3.491 2.958 4.691 . 0 0 "[ . 1 . 2]" 1
1421 1 116 LEU MD2 1 120 MET QB 4.350 . 6.910 2.329 1.899 3.055 . 0 0 "[ . 1 . 2]" 1
1422 1 116 LEU MD2 1 120 MET QG 4.600 . 7.410 3.074 1.869 4.022 . 0 0 "[ . 1 . 2]" 1
1423 1 116 LEU HG 1 117 LEU H 3.650 . 5.500 4.795 4.402 5.125 . 0 0 "[ . 1 . 2]" 1
1424 1 117 LEU H 1 117 LEU HB2 2.690 . 3.580 2.408 2.168 2.578 . 0 0 "[ . 1 . 2]" 1
1425 1 117 LEU H 1 117 LEU QB 2.520 . 3.240 2.371 2.148 2.523 . 0 0 "[ . 1 . 2]" 1
1426 1 117 LEU H 1 117 LEU HB3 2.690 . 3.580 3.567 3.477 3.597 0.017 4 0 "[ . 1 . 2]" 1
1427 1 117 LEU H 1 117 LEU MD2 2.920 . 4.050 2.459 1.764 3.287 0.026 12 0 "[ . 1 . 2]" 1
1428 1 117 LEU H 1 117 LEU HG 2.830 . 3.860 3.216 2.096 3.924 0.064 5 0 "[ . 1 . 2]" 1
1429 1 117 LEU H 1 118 THR H 2.520 . 3.240 2.794 2.616 2.982 . 0 0 "[ . 1 . 2]" 1
1430 1 117 LEU HA 1 117 LEU MD1 3.260 . 4.730 2.709 1.877 3.871 . 0 0 "[ . 1 . 2]" 1
1431 1 117 LEU HA 1 117 LEU MD2 2.920 . 4.050 2.408 1.955 3.013 . 0 0 "[ . 1 . 2]" 1
1432 1 117 LEU HB2 1 118 THR H 2.700 . 3.610 2.536 2.239 2.998 . 0 0 "[ . 1 . 2]" 1
1433 1 117 LEU HB3 1 118 THR H 2.700 . 3.610 3.387 3.066 3.614 0.004 2 0 "[ . 1 . 2]" 1
1434 1 117 LEU MD1 1 118 THR H 4.010 . 6.220 4.499 4.194 4.735 . 0 0 "[ . 1 . 2]" 1
1435 1 117 LEU MD2 1 118 THR H 3.770 . 5.750 4.226 3.783 4.635 . 0 0 "[ . 1 . 2]" 1
1436 1 117 LEU HG 1 118 THR H 3.650 . 5.500 4.721 4.160 5.292 . 0 0 "[ . 1 . 2]" 1
1437 1 118 THR H 1 118 THR HB 2.360 . 2.930 2.643 2.558 2.759 . 0 0 "[ . 1 . 2]" 1
1438 1 118 THR H 1 118 THR MG 3.260 . 4.730 3.749 3.694 3.793 . 0 0 "[ . 1 . 2]" 1
1439 1 118 THR H 1 119 LEU H 2.480 . 3.170 2.659 2.367 2.872 . 0 0 "[ . 1 . 2]" 1
1440 1 118 THR HA 1 121 ARG H 2.920 . 4.040 3.889 3.523 4.074 0.034 18 0 "[ . 1 . 2]" 1
1441 1 118 THR HA 1 121 ARG QB 2.970 . 4.150 2.962 2.301 3.257 . 0 0 "[ . 1 . 2]" 1
1442 1 118 THR HB 1 119 LEU H 2.530 . 3.270 2.526 2.360 2.717 . 0 0 "[ . 1 . 2]" 1
1443 1 118 THR MG 1 119 LEU H 3.450 . 5.100 3.593 3.341 3.864 . 0 0 "[ . 1 . 2]" 1
1444 1 119 LEU H 1 119 LEU QB 2.670 . 3.540 2.190 2.054 2.422 . 0 0 "[ . 1 . 2]" 1
1445 1 119 LEU H 1 119 LEU MD1 3.770 . 5.750 3.985 3.619 4.312 . 0 0 "[ . 1 . 2]" 1
1446 1 119 LEU H 1 119 LEU MD2 3.090 . 4.390 2.912 2.205 3.875 . 0 0 "[ . 1 . 2]" 1
1447 1 119 LEU H 1 119 LEU HG 3.650 . 5.500 4.137 2.297 4.548 . 0 0 "[ . 1 . 2]" 1
1448 1 119 LEU H 1 120 MET H 2.450 . 3.110 2.706 2.564 2.796 . 0 0 "[ . 1 . 2]" 1
1449 1 119 LEU HA 1 119 LEU MD1 3.230 . 4.670 2.329 1.831 3.849 . 0 0 "[ . 1 . 2]" 1
1450 1 119 LEU HA 1 119 LEU MD2 2.950 . 4.110 2.248 1.829 2.661 . 0 0 "[ . 1 . 2]" 1
1451 1 119 LEU QB 1 120 MET H 2.400 . 3.000 2.486 2.307 2.711 . 0 0 "[ . 1 . 2]" 1
1452 1 119 LEU HB2 1 120 MET H 2.640 . 3.490 2.998 2.480 3.557 0.067 8 0 "[ . 1 . 2]" 1
1453 1 119 LEU HB3 1 120 MET H 2.640 . 3.490 2.918 2.338 3.498 0.008 4 0 "[ . 1 . 2]" 1
1454 1 119 LEU MD1 1 120 MET H 4.160 . 6.530 4.202 3.375 4.647 . 0 0 "[ . 1 . 2]" 1
1455 1 119 LEU MD1 1 123 ILE MD 3.620 . 5.450 3.477 2.130 4.603 . 0 0 "[ . 1 . 2]" 1
1456 1 119 LEU MD2 1 120 MET H 4.160 . 6.530 4.338 4.107 4.623 . 0 0 "[ . 1 . 2]" 1
1457 1 119 LEU HG 1 120 MET H 3.650 . 5.500 4.930 4.315 5.179 . 0 0 "[ . 1 . 2]" 1
1458 1 120 MET H 1 120 MET HG2 3.650 . 5.500 3.810 2.193 4.619 . 0 0 "[ . 1 . 2]" 1
1459 1 120 MET H 1 120 MET HG3 3.650 . 5.500 3.967 2.599 4.496 . 0 0 "[ . 1 . 2]" 1
1460 1 120 MET H 1 121 ARG H 2.550 . 3.300 2.670 2.465 2.789 . 0 0 "[ . 1 . 2]" 1
1461 1 120 MET HA 1 121 ARG H 2.700 . 3.610 3.524 3.436 3.573 . 0 0 "[ . 1 . 2]" 1
1462 1 120 MET HA 1 123 ILE HB 3.010 . 4.230 2.881 2.153 3.628 . 0 0 "[ . 1 . 2]" 1
1463 1 120 MET HA 1 123 ILE MD 3.490 . 5.190 2.812 1.884 4.497 . 0 0 "[ . 1 . 2]" 1
1464 1 120 MET HA 1 123 ILE QG 4.090 . 6.380 2.864 2.162 3.448 . 0 0 "[ . 1 . 2]" 1
1465 1 120 MET QG 1 121 ARG H 3.580 . 5.370 3.680 2.238 4.553 . 0 0 "[ . 1 . 2]" 1
1466 1 120 MET HG2 1 121 ARG H 3.650 . 5.500 4.198 2.544 5.160 . 0 0 "[ . 1 . 2]" 1
1467 1 120 MET HG3 1 121 ARG H 3.650 . 5.500 4.217 2.484 5.152 . 0 0 "[ . 1 . 2]" 1
1468 1 121 ARG H 1 121 ARG HB2 2.530 . 3.270 2.240 2.079 2.519 . 0 0 "[ . 1 . 2]" 1
1469 1 121 ARG H 1 121 ARG QB 2.330 . 2.860 2.190 2.053 2.300 . 0 0 "[ . 1 . 2]" 1
1470 1 121 ARG H 1 121 ARG HB3 2.530 . 3.270 3.287 2.657 3.518 0.248 19 0 "[ . 1 . 2]" 1
1471 1 121 ARG H 1 121 ARG QD 4.090 . 6.380 3.994 3.549 4.456 . 0 0 "[ . 1 . 2]" 1
1472 1 121 ARG H 1 121 ARG HG2 3.650 . 5.500 3.938 2.436 4.543 . 0 0 "[ . 1 . 2]" 1
1473 1 121 ARG H 1 121 ARG HG3 3.650 . 5.500 3.249 2.353 4.439 . 0 0 "[ . 1 . 2]" 1
1474 1 121 ARG H 1 122 SER H 2.450 . 3.110 2.621 2.459 2.788 . 0 0 "[ . 1 . 2]" 1
1475 1 121 ARG HA 1 121 ARG HD2 3.650 . 5.500 4.368 2.911 4.640 . 0 0 "[ . 1 . 2]" 1
1476 1 121 ARG HA 1 121 ARG HD3 3.650 . 5.500 4.161 1.776 4.693 0.024 10 0 "[ . 1 . 2]" 1
1477 1 121 ARG HA 1 124 VAL H 2.970 . 4.140 3.378 3.111 3.898 . 0 0 "[ . 1 . 2]" 1
1478 1 121 ARG HA 1 124 VAL MG1 4.160 . 6.530 4.029 3.503 4.795 . 0 0 "[ . 1 . 2]" 1
1479 1 121 ARG HA 1 124 VAL MG2 3.880 . 5.970 2.070 1.704 2.762 0.086 4 0 "[ . 1 . 2]" 1
1480 1 121 ARG QB 1 122 SER H 2.910 . 4.020 2.663 2.464 2.802 . 0 0 "[ . 1 . 2]" 1
1481 1 121 ARG HD2 1 122 SER H 3.650 . 5.500 5.349 4.691 5.615 0.115 10 0 "[ . 1 . 2]" 1
1482 1 121 ARG HD3 1 122 SER H 3.650 . 5.500 5.383 4.727 5.634 0.134 19 0 "[ . 1 . 2]" 1
1483 1 121 ARG HG2 1 122 SER H 3.650 . 5.500 4.839 3.856 5.123 . 0 0 "[ . 1 . 2]" 1
1484 1 121 ARG HG3 1 122 SER H 3.650 . 5.500 4.787 4.410 5.067 . 0 0 "[ . 1 . 2]" 1
1485 1 122 SER H 1 122 SER HB2 2.450 . 3.110 2.480 2.367 2.622 . 0 0 "[ . 1 . 2]" 1
1486 1 122 SER H 1 122 SER QB 2.270 . 2.750 2.303 2.218 2.479 . 0 0 "[ . 1 . 2]" 1
1487 1 122 SER H 1 122 SER HB3 2.450 . 3.110 2.823 2.503 3.480 0.370 13 0 "[ . 1 . 2]" 1
1488 1 122 SER H 1 123 ILE H 2.530 . 3.270 2.597 2.451 2.701 . 0 0 "[ . 1 . 2]" 1
1489 1 122 SER QB 1 123 ILE H 3.030 . 4.270 2.778 2.606 2.886 . 0 0 "[ . 1 . 2]" 1
1490 1 123 ILE H 1 123 ILE HB 2.350 . 2.900 2.501 2.420 2.570 . 0 0 "[ . 1 . 2]" 1
1491 1 123 ILE H 1 123 ILE MD 3.050 . 4.300 3.540 3.225 3.755 . 0 0 "[ . 1 . 2]" 1
1492 1 123 ILE H 1 123 ILE HG12 3.210 . 4.630 3.152 2.150 3.645 . 0 0 "[ . 1 . 2]" 1
1493 1 123 ILE H 1 123 ILE QG 2.910 . 4.030 2.201 2.024 2.373 . 0 0 "[ . 1 . 2]" 1
1494 1 123 ILE H 1 123 ILE HG13 3.210 . 4.630 2.587 2.042 3.710 . 0 0 "[ . 1 . 2]" 1
1495 1 123 ILE H 1 124 VAL H 2.410 . 3.020 2.569 2.354 2.720 . 0 0 "[ . 1 . 2]" 1
1496 1 123 ILE H 1 124 VAL MG1 4.160 . 6.530 4.260 3.887 4.530 . 0 0 "[ . 1 . 2]" 1
1497 1 123 ILE H 1 124 VAL MG2 3.590 . 5.380 3.795 3.566 3.985 . 0 0 "[ . 1 . 2]" 1
1498 1 123 ILE H 1 125 ASP H 3.600 . 5.410 4.046 3.708 4.588 . 0 0 "[ . 1 . 2]" 1
1499 1 123 ILE HA 1 123 ILE MD 3.250 . 4.700 3.368 1.970 3.866 . 0 0 "[ . 1 . 2]" 1
1500 1 123 ILE HA 1 124 VAL H 2.700 . 3.610 3.548 3.529 3.569 . 0 0 "[ . 1 . 2]" 1
1501 1 123 ILE HB 1 124 VAL H 2.550 . 3.300 2.595 2.425 2.780 . 0 0 "[ . 1 . 2]" 1
1502 1 123 ILE QG 1 124 VAL H 4.090 . 6.380 4.000 3.852 4.114 . 0 0 "[ . 1 . 2]" 1
1503 1 123 ILE MG 1 124 VAL H 3.280 . 4.760 3.402 3.206 3.570 . 0 0 "[ . 1 . 2]" 1
1504 1 124 VAL H 1 124 VAL HB 2.840 . 3.890 3.674 3.640 3.707 . 0 0 "[ . 1 . 2]" 1
1505 1 124 VAL H 1 124 VAL MG1 2.830 . 3.860 2.433 2.220 2.680 . 0 0 "[ . 1 . 2]" 1
1506 1 124 VAL H 1 124 VAL MG2 2.870 . 3.950 1.989 1.884 2.126 . 0 0 "[ . 1 . 2]" 1
1507 1 124 VAL H 1 125 ASP H 2.520 . 3.240 2.767 2.377 3.097 . 0 0 "[ . 1 . 2]" 1
1508 1 124 VAL HA 1 125 ASP H 2.560 . 3.330 3.035 2.815 3.357 0.027 2 0 "[ . 1 . 2]" 1
1509 1 124 VAL HB 1 125 ASP H 3.370 . 4.940 4.401 4.220 4.455 . 0 0 "[ . 1 . 2]" 1
1510 1 124 VAL MG2 1 125 ASP H 3.110 . 4.420 3.417 2.731 3.744 . 0 0 "[ . 1 . 2]" 1
1511 1 125 ASP H 1 125 ASP HB2 2.580 . 3.360 2.531 2.389 2.710 . 0 0 "[ . 1 . 2]" 1
1512 1 125 ASP H 1 125 ASP QB 2.460 . 3.130 2.252 2.188 2.301 . 0 0 "[ . 1 . 2]" 1
1513 1 125 ASP H 1 125 ASP HB3 2.580 . 3.360 2.547 2.310 2.662 . 0 0 "[ . 1 . 2]" 1
1514 1 125 ASP H 1 126 THR H 2.640 . 3.490 2.596 2.344 3.022 . 0 0 "[ . 1 . 2]" 1
1515 1 125 ASP QB 1 126 THR H 3.030 . 4.270 2.758 2.035 3.471 . 0 0 "[ . 1 . 2]" 1
1516 1 125 ASP HB2 1 126 THR H 3.460 . 5.130 3.956 3.508 4.302 . 0 0 "[ . 1 . 2]" 1
1517 1 125 ASP HB3 1 126 THR H 3.460 . 5.130 2.824 2.047 3.662 . 0 0 "[ . 1 . 2]" 1
1518 1 126 THR HA 1 127 PRO HD2 2.670 . 3.550 2.421 1.893 3.092 . 0 0 "[ . 1 . 2]" 1
1519 1 126 THR HA 1 127 PRO HD3 2.670 . 3.550 2.172 1.767 2.915 0.023 20 0 "[ . 1 . 2]" 1
1520 1 126 THR HB 1 127 PRO QD 4.090 . 6.380 3.555 1.770 4.410 0.030 10 0 "[ . 1 . 2]" 1
1521 1 126 THR MG 1 127 PRO HD2 3.870 . 5.940 3.469 2.332 4.394 . 0 0 "[ . 1 . 2]" 1
1522 1 126 THR MG 1 127 PRO QD 3.780 . 5.760 3.190 2.258 4.052 . 0 0 "[ . 1 . 2]" 1
1523 1 126 THR MG 1 127 PRO HD3 3.870 . 5.940 3.899 3.015 4.761 . 0 0 "[ . 1 . 2]" 1
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