NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
402682 |
1wfq   |
10054 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1wfq
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 2028
_Distance_constraint_stats_list.Viol_count 1409
_Distance_constraint_stats_list.Viol_total 514.733
_Distance_constraint_stats_list.Viol_max 0.193
_Distance_constraint_stats_list.Viol_rms 0.0056
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0006
_Distance_constraint_stats_list.Viol_average_violations_only 0.0183
_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 5 SER 0.007 0.007 19 0 "[ . 1 . 2]"
1 6 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 12 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 14 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 ALA 1.166 0.193 17 0 "[ . 1 . 2]"
1 16 ALA 1.166 0.193 17 0 "[ . 1 . 2]"
1 17 LEU 0.039 0.010 11 0 "[ . 1 . 2]"
1 18 ARG 0.105 0.015 14 0 "[ . 1 . 2]"
1 19 GLU 0.132 0.017 18 0 "[ . 1 . 2]"
1 20 THR 0.130 0.014 14 0 "[ . 1 . 2]"
1 21 GLY 0.130 0.016 13 0 "[ . 1 . 2]"
1 22 VAL 1.976 0.074 12 0 "[ . 1 . 2]"
1 23 ILE 0.475 0.074 12 0 "[ . 1 . 2]"
1 24 GLU 0.320 0.024 13 0 "[ . 1 . 2]"
1 25 LYS 1.266 0.054 4 0 "[ . 1 . 2]"
1 26 LEU 3.584 0.123 16 0 "[ . 1 . 2]"
1 27 LEU 2.865 0.123 16 0 "[ . 1 . 2]"
1 28 THR 0.258 0.121 14 0 "[ . 1 . 2]"
1 29 SER 0.120 0.017 12 0 "[ . 1 . 2]"
1 30 TYR 2.140 0.121 14 0 "[ . 1 . 2]"
1 31 GLY 0.028 0.018 18 0 "[ . 1 . 2]"
1 32 PHE 1.395 0.046 12 0 "[ . 1 . 2]"
1 33 ILE 0.960 0.074 14 0 "[ . 1 . 2]"
1 34 GLN 1.914 0.062 8 0 "[ . 1 . 2]"
1 35 CYS 0.253 0.126 18 0 "[ . 1 . 2]"
1 36 SER 1.119 0.095 7 0 "[ . 1 . 2]"
1 37 GLU 0.884 0.140 15 0 "[ . 1 . 2]"
1 38 ARG 1.337 0.128 16 0 "[ . 1 . 2]"
1 39 GLN 1.236 0.128 16 0 "[ . 1 . 2]"
1 40 ALA 0.066 0.020 12 0 "[ . 1 . 2]"
1 41 ARG 0.417 0.035 18 0 "[ . 1 . 2]"
1 42 LEU 1.659 0.074 14 0 "[ . 1 . 2]"
1 43 PHE 0.704 0.035 14 0 "[ . 1 . 2]"
1 44 PHE 0.514 0.044 18 0 "[ . 1 . 2]"
1 45 HIS 1.822 0.044 18 0 "[ . 1 . 2]"
1 46 CYS 0.157 0.017 12 0 "[ . 1 . 2]"
1 47 SER 0.008 0.005 7 0 "[ . 1 . 2]"
1 48 GLN 0.668 0.033 4 0 "[ . 1 . 2]"
1 49 TYR 0.097 0.016 13 0 "[ . 1 . 2]"
1 50 ASN 0.042 0.010 12 0 "[ . 1 . 2]"
1 51 GLY 0.014 0.013 13 0 "[ . 1 . 2]"
1 52 ASN 1.256 0.081 11 0 "[ . 1 . 2]"
1 53 LEU 1.423 0.081 11 0 "[ . 1 . 2]"
1 54 GLN 0.093 0.015 13 0 "[ . 1 . 2]"
1 55 ASP 0.023 0.014 12 0 "[ . 1 . 2]"
1 56 LEU 0.276 0.015 13 0 "[ . 1 . 2]"
1 57 LYS 0.157 0.034 6 0 "[ . 1 . 2]"
1 58 VAL 0.418 0.049 13 0 "[ . 1 . 2]"
1 59 GLY 0.133 0.014 12 0 "[ . 1 . 2]"
1 60 ASP 0.304 0.040 8 0 "[ . 1 . 2]"
1 61 ASP 0.081 0.017 14 0 "[ . 1 . 2]"
1 62 VAL 2.274 0.056 20 0 "[ . 1 . 2]"
1 63 GLU 0.907 0.051 1 0 "[ . 1 . 2]"
1 64 PHE 0.349 0.021 1 0 "[ . 1 . 2]"
1 65 GLU 1.298 0.072 8 0 "[ . 1 . 2]"
1 66 VAL 0.065 0.014 18 0 "[ . 1 . 2]"
1 67 SER 0.151 0.042 14 0 "[ . 1 . 2]"
1 68 SER 0.005 0.003 16 0 "[ . 1 . 2]"
1 69 ASP 0.140 0.060 17 0 "[ . 1 . 2]"
1 70 ARG 0.422 0.118 10 0 "[ . 1 . 2]"
1 71 ARG 0.218 0.118 10 0 "[ . 1 . 2]"
1 72 THR 0.075 0.019 10 0 "[ . 1 . 2]"
1 73 GLY 0.030 0.016 10 0 "[ . 1 . 2]"
1 74 LYS 0.145 0.019 10 0 "[ . 1 . 2]"
1 75 PRO 0.126 0.018 13 0 "[ . 1 . 2]"
1 76 ILE 0.178 0.042 14 0 "[ . 1 . 2]"
1 77 ALA 0.104 0.011 11 0 "[ . 1 . 2]"
1 78 VAL 0.260 0.014 14 0 "[ . 1 . 2]"
1 79 LYS 0.555 0.028 2 0 "[ . 1 . 2]"
1 80 LEU 3.067 0.072 8 0 "[ . 1 . 2]"
1 81 VAL 0.205 0.031 2 0 "[ . 1 . 2]"
1 82 LYS 0.111 0.010 9 0 "[ . 1 . 2]"
1 83 ILE 0.063 0.010 14 0 "[ . 1 . 2]"
1 84 SER 0.026 0.017 14 0 "[ . 1 . 2]"
1 85 GLY 0.170 0.096 10 0 "[ . 1 . 2]"
1 86 PRO 0.239 0.096 10 0 "[ . 1 . 2]"
1 87 SER 0.069 0.034 20 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 5 SER H 1 5 SER HG . . 4.010 3.193 1.900 4.017 0.007 19 0 "[ . 1 . 2]" 1
2 1 5 SER H 1 6 SER H . . 4.050 3.699 2.897 4.048 . 0 0 "[ . 1 . 2]" 1
3 1 5 SER HA 1 5 SER HG . . 3.610 2.849 2.188 3.505 . 0 0 "[ . 1 . 2]" 1
4 1 5 SER HA 1 6 SER H . . 3.160 2.381 2.146 2.782 . 0 0 "[ . 1 . 2]" 1
5 1 5 SER QB 1 6 SER H . . 4.440 3.834 3.222 4.053 . 0 0 "[ . 1 . 2]" 1
6 1 5 SER HB2 1 6 SER H . . 5.180 4.398 3.338 4.667 . 0 0 "[ . 1 . 2]" 1
7 1 5 SER HB3 1 6 SER H . . 5.180 4.294 3.711 4.650 . 0 0 "[ . 1 . 2]" 1
8 1 6 SER H 1 6 SER QB . . 3.670 2.604 2.219 3.176 . 0 0 "[ . 1 . 2]" 1
9 1 9 TYR H 1 9 TYR HB2 . . 4.200 3.381 2.190 4.006 . 0 0 "[ . 1 . 2]" 1
10 1 9 TYR H 1 9 TYR QB . . 3.320 2.787 2.169 3.286 . 0 0 "[ . 1 . 2]" 1
11 1 9 TYR H 1 9 TYR HB3 . . 4.200 3.260 2.205 3.951 . 0 0 "[ . 1 . 2]" 1
12 1 9 TYR H 1 9 TYR QD . . 4.290 2.941 2.187 4.026 . 0 0 "[ . 1 . 2]" 1
13 1 9 TYR HA 1 9 TYR QD . . 4.180 3.360 2.259 3.731 . 0 0 "[ . 1 . 2]" 1
14 1 9 TYR QD 1 10 PRO HA . . 4.940 3.126 1.995 3.965 . 0 0 "[ . 1 . 2]" 1
15 1 10 PRO HA 1 11 ASN QB . . 4.940 4.290 4.030 4.832 . 0 0 "[ . 1 . 2]" 1
16 1 11 ASN QB 1 12 GLY H . . 4.460 3.329 2.249 4.035 . 0 0 "[ . 1 . 2]" 1
17 1 13 THR HB 1 14 SER H . . 4.740 3.364 2.263 4.448 . 0 0 "[ . 1 . 2]" 1
18 1 14 SER HA 1 15 ALA H . . 3.040 2.341 2.139 2.812 . 0 0 "[ . 1 . 2]" 1
19 1 14 SER QB 1 15 ALA H . . 4.210 3.291 1.986 4.053 . 0 0 "[ . 1 . 2]" 1
20 1 14 SER HB2 1 15 ALA H . . 4.900 3.926 1.998 4.624 . 0 0 "[ . 1 . 2]" 1
21 1 14 SER HB3 1 15 ALA H . . 4.900 3.768 2.218 4.642 . 0 0 "[ . 1 . 2]" 1
22 1 15 ALA H 1 15 ALA MB . . 3.150 2.380 2.058 2.880 . 0 0 "[ . 1 . 2]" 1
23 1 15 ALA HA 1 16 ALA H . . 3.150 2.554 2.157 3.343 0.193 17 0 "[ . 1 . 2]" 1
24 1 15 ALA MB 1 16 ALA H . . 3.060 2.686 1.991 3.161 0.101 19 0 "[ . 1 . 2]" 1
25 1 16 ALA H 1 16 ALA MB . . 3.190 2.324 2.055 2.860 . 0 0 "[ . 1 . 2]" 1
26 1 16 ALA HA 1 17 LEU H . . 2.510 2.310 2.143 2.509 . 0 0 "[ . 1 . 2]" 1
27 1 16 ALA HA 1 17 LEU QB . . 4.430 4.004 3.836 4.214 . 0 0 "[ . 1 . 2]" 1
28 1 16 ALA MB 1 17 LEU H . . 3.220 2.704 2.157 3.211 . 0 0 "[ . 1 . 2]" 1
29 1 16 ALA MB 1 18 ARG H . . 5.460 4.819 4.241 5.460 0.000 11 0 "[ . 1 . 2]" 1
30 1 16 ALA MB 1 65 GLU QG . . 4.070 3.642 2.390 4.069 . 0 0 "[ . 1 . 2]" 1
31 1 17 LEU H 1 17 LEU QB . . 3.110 2.643 2.206 3.112 0.002 2 0 "[ . 1 . 2]" 1
32 1 17 LEU H 1 17 LEU MD1 . . 4.030 3.245 1.782 3.929 . 0 0 "[ . 1 . 2]" 1
33 1 17 LEU H 1 17 LEU MD2 . . 4.220 4.030 3.522 4.222 0.002 17 0 "[ . 1 . 2]" 1
34 1 17 LEU H 1 18 ARG H . . 4.610 4.213 3.730 4.455 . 0 0 "[ . 1 . 2]" 1
35 1 17 LEU HA 1 17 LEU MD1 . . 3.630 3.443 3.272 3.562 . 0 0 "[ . 1 . 2]" 1
36 1 17 LEU HA 1 17 LEU MD2 . . 3.590 2.409 1.959 3.468 . 0 0 "[ . 1 . 2]" 1
37 1 17 LEU HA 1 17 LEU HG . . 4.260 3.873 3.633 4.270 0.010 11 0 "[ . 1 . 2]" 1
38 1 17 LEU HA 1 18 ARG H . . 2.580 2.197 2.139 2.437 . 0 0 "[ . 1 . 2]" 1
39 1 17 LEU QB 1 17 LEU MD1 . . 3.060 2.144 1.984 2.399 . 0 0 "[ . 1 . 2]" 1
40 1 17 LEU QB 1 17 LEU MD2 . . 3.000 2.344 2.069 2.479 . 0 0 "[ . 1 . 2]" 1
41 1 17 LEU QB 1 18 ARG H . . 4.210 3.528 2.407 3.966 . 0 0 "[ . 1 . 2]" 1
42 1 17 LEU MD1 1 18 ARG H . . 4.260 3.666 3.154 4.154 . 0 0 "[ . 1 . 2]" 1
43 1 17 LEU MD1 1 19 GLU H . . 5.070 3.711 3.148 4.475 . 0 0 "[ . 1 . 2]" 1
44 1 17 LEU MD1 1 19 GLU HB3 . . 5.070 4.185 3.818 5.056 . 0 0 "[ . 1 . 2]" 1
45 1 17 LEU MD1 1 19 GLU HG2 . . 4.740 2.142 1.841 2.855 . 0 0 "[ . 1 . 2]" 1
46 1 17 LEU MD2 1 18 ARG H . . 3.900 2.328 1.964 2.609 . 0 0 "[ . 1 . 2]" 1
47 1 17 LEU MD2 1 18 ARG QG . . 4.560 4.036 3.743 4.526 . 0 0 "[ . 1 . 2]" 1
48 1 17 LEU MD2 1 19 GLU H . . 4.460 4.069 3.022 4.463 0.003 14 0 "[ . 1 . 2]" 1
49 1 17 LEU MD2 1 19 GLU HA . . 5.230 3.535 2.612 4.054 . 0 0 "[ . 1 . 2]" 1
50 1 18 ARG H 1 18 ARG HB2 . . 2.990 2.530 2.498 2.570 . 0 0 "[ . 1 . 2]" 1
51 1 18 ARG H 1 18 ARG HD2 . . 4.200 3.798 3.685 4.027 . 0 0 "[ . 1 . 2]" 1
52 1 18 ARG H 1 18 ARG HD3 . . 4.640 4.201 3.994 4.579 . 0 0 "[ . 1 . 2]" 1
53 1 18 ARG H 1 18 ARG HE . . 5.500 5.467 5.331 5.509 0.009 10 0 "[ . 1 . 2]" 1
54 1 18 ARG H 1 18 ARG QG . . 3.000 2.201 2.056 2.523 . 0 0 "[ . 1 . 2]" 1
55 1 18 ARG H 1 19 GLU H . . 4.580 4.500 4.436 4.554 . 0 0 "[ . 1 . 2]" 1
56 1 18 ARG H 1 19 GLU HG2 . . 5.440 5.068 4.857 5.440 0.000 20 0 "[ . 1 . 2]" 1
57 1 18 ARG H 1 65 GLU HA . . 5.500 5.300 5.099 5.481 . 0 0 "[ . 1 . 2]" 1
58 1 18 ARG H 1 65 GLU HB2 . . 5.500 5.172 4.869 5.511 0.011 1 0 "[ . 1 . 2]" 1
59 1 18 ARG HA 1 64 PHE H . . 4.770 4.561 4.399 4.722 . 0 0 "[ . 1 . 2]" 1
60 1 18 ARG HB2 1 63 GLU QG . . 4.230 3.223 2.994 3.412 . 0 0 "[ . 1 . 2]" 1
61 1 18 ARG HB3 1 18 ARG HD2 . . 3.470 2.658 2.605 2.755 . 0 0 "[ . 1 . 2]" 1
62 1 18 ARG HB3 1 18 ARG HD3 . . 4.000 3.704 3.683 3.719 . 0 0 "[ . 1 . 2]" 1
63 1 18 ARG HB3 1 18 ARG HE . . 3.290 2.687 2.367 2.813 . 0 0 "[ . 1 . 2]" 1
64 1 18 ARG HB3 1 19 GLU H . . 3.550 3.352 3.159 3.495 . 0 0 "[ . 1 . 2]" 1
65 1 18 ARG HB3 1 63 GLU HB2 . . 5.430 4.885 4.700 5.119 . 0 0 "[ . 1 . 2]" 1
66 1 18 ARG HB3 1 63 GLU HB3 . . 5.500 4.290 3.940 4.647 . 0 0 "[ . 1 . 2]" 1
67 1 18 ARG HB3 1 63 GLU HG2 . . 4.480 2.162 1.995 2.335 . 0 0 "[ . 1 . 2]" 1
68 1 18 ARG HB3 1 63 GLU QG . . 3.660 2.130 1.978 2.282 . 0 0 "[ . 1 . 2]" 1
69 1 18 ARG HB3 1 63 GLU HG3 . . 4.480 3.223 3.084 3.429 . 0 0 "[ . 1 . 2]" 1
70 1 18 ARG HB3 1 64 PHE H . . 4.320 3.879 3.675 4.142 . 0 0 "[ . 1 . 2]" 1
71 1 18 ARG HD2 1 18 ARG QH1 . . 4.120 3.226 2.608 3.397 . 0 0 "[ . 1 . 2]" 1
72 1 18 ARG HD2 1 19 GLU H . . 4.200 3.761 3.688 3.806 . 0 0 "[ . 1 . 2]" 1
73 1 18 ARG HD2 1 65 GLU H . . 5.500 4.229 3.978 4.328 . 0 0 "[ . 1 . 2]" 1
74 1 18 ARG HD2 1 65 GLU HB2 . . 3.900 2.036 1.992 2.174 . 0 0 "[ . 1 . 2]" 1
75 1 18 ARG HD2 1 65 GLU HG2 . . 5.240 4.726 4.324 5.147 . 0 0 "[ . 1 . 2]" 1
76 1 18 ARG HD2 1 65 GLU QG . . 4.410 4.114 3.907 4.297 . 0 0 "[ . 1 . 2]" 1
77 1 18 ARG HD2 1 65 GLU HG3 . . 5.240 4.637 4.099 5.060 . 0 0 "[ . 1 . 2]" 1
78 1 18 ARG HD2 1 66 VAL H . . 5.500 5.044 4.813 5.196 . 0 0 "[ . 1 . 2]" 1
79 1 18 ARG HD3 1 18 ARG HH22 . . 4.910 4.581 4.574 4.601 . 0 0 "[ . 1 . 2]" 1
80 1 18 ARG HD3 1 19 GLU H . . 5.500 5.470 5.392 5.510 0.010 14 0 "[ . 1 . 2]" 1
81 1 18 ARG HD3 1 63 GLU QG . . 5.340 5.243 5.043 5.346 0.006 10 0 "[ . 1 . 2]" 1
82 1 18 ARG HD3 1 65 GLU H . . 5.500 5.410 5.066 5.510 0.010 13 0 "[ . 1 . 2]" 1
83 1 18 ARG HD3 1 65 GLU HB2 . . 4.140 2.750 2.565 2.898 . 0 0 "[ . 1 . 2]" 1
84 1 18 ARG HD3 1 65 GLU QG . . 5.340 4.497 4.168 4.855 . 0 0 "[ . 1 . 2]" 1
85 1 18 ARG HE 1 18 ARG HG2 . . 4.180 3.914 3.604 4.010 . 0 0 "[ . 1 . 2]" 1
86 1 18 ARG HE 1 18 ARG HG3 . . 4.180 3.018 2.401 3.249 . 0 0 "[ . 1 . 2]" 1
87 1 18 ARG HE 1 19 GLU H . . 4.970 4.799 4.440 4.974 0.004 13 0 "[ . 1 . 2]" 1
88 1 18 ARG HE 1 63 GLU HB3 . . 4.310 4.163 3.664 4.325 0.015 14 0 "[ . 1 . 2]" 1
89 1 18 ARG HE 1 63 GLU QG . . 3.770 3.265 2.831 3.623 . 0 0 "[ . 1 . 2]" 1
90 1 18 ARG HE 1 81 VAL QG . . 4.230 3.242 2.992 3.507 . 0 0 "[ . 1 . 2]" 1
91 1 18 ARG QH1 1 81 VAL QG . . 4.440 3.845 3.448 4.260 . 0 0 "[ . 1 . 2]" 1
92 1 18 ARG HH11 1 79 LYS HB3 . . 5.500 5.158 4.045 5.507 0.007 14 0 "[ . 1 . 2]" 1
93 1 18 ARG HH12 1 79 LYS HB3 . . 5.500 4.272 2.335 4.952 . 0 0 "[ . 1 . 2]" 1
94 1 18 ARG HH21 1 63 GLU HB3 . . 4.940 3.962 3.409 4.375 . 0 0 "[ . 1 . 2]" 1
95 1 18 ARG HH21 1 79 LYS HB2 . . 5.300 4.047 3.506 4.682 . 0 0 "[ . 1 . 2]" 1
96 1 18 ARG HH21 1 79 LYS HB3 . . 5.300 4.095 3.590 4.756 . 0 0 "[ . 1 . 2]" 1
97 1 18 ARG HH21 1 81 VAL H . . 4.730 4.370 3.833 4.727 . 0 0 "[ . 1 . 2]" 1
98 1 18 ARG HH21 1 81 VAL MG1 . . 5.480 2.495 1.693 3.044 . 0 0 "[ . 1 . 2]" 1
99 1 18 ARG HH21 1 81 VAL QG . . 4.570 1.821 1.691 1.984 . 0 0 "[ . 1 . 2]" 1
100 1 18 ARG HH21 1 81 VAL MG2 . . 5.480 2.434 1.713 4.358 . 0 0 "[ . 1 . 2]" 1
101 1 18 ARG HH22 1 79 LYS HB2 . . 5.020 4.055 2.182 4.713 . 0 0 "[ . 1 . 2]" 1
102 1 18 ARG HH22 1 79 LYS HB3 . . 4.830 3.611 2.456 4.379 . 0 0 "[ . 1 . 2]" 1
103 1 18 ARG HH22 1 81 VAL MG1 . . 5.010 2.706 2.052 3.216 . 0 0 "[ . 1 . 2]" 1
104 1 18 ARG HH22 1 81 VAL QG . . 4.340 2.414 2.002 2.830 . 0 0 "[ . 1 . 2]" 1
105 1 18 ARG HH22 1 81 VAL MG2 . . 5.010 3.046 2.163 4.482 . 0 0 "[ . 1 . 2]" 1
106 1 19 GLU H 1 19 GLU HB2 . . 3.520 2.588 2.533 2.662 . 0 0 "[ . 1 . 2]" 1
107 1 19 GLU H 1 19 GLU HG2 . . 3.370 2.702 2.228 3.359 . 0 0 "[ . 1 . 2]" 1
108 1 19 GLU H 1 19 GLU HG3 . . 3.860 3.424 2.602 3.837 . 0 0 "[ . 1 . 2]" 1
109 1 19 GLU H 1 20 THR H . . 4.600 4.550 4.520 4.572 . 0 0 "[ . 1 . 2]" 1
110 1 19 GLU H 1 20 THR HA . . 5.440 5.111 5.021 5.188 . 0 0 "[ . 1 . 2]" 1
111 1 19 GLU H 1 20 THR MG . . 4.840 4.534 4.419 4.698 . 0 0 "[ . 1 . 2]" 1
112 1 19 GLU H 1 63 GLU HA . . 5.250 5.063 4.899 5.216 . 0 0 "[ . 1 . 2]" 1
113 1 19 GLU H 1 63 GLU QG . . 3.930 3.720 3.551 3.870 . 0 0 "[ . 1 . 2]" 1
114 1 19 GLU H 1 64 PHE H . . 3.440 3.397 3.259 3.447 0.007 8 0 "[ . 1 . 2]" 1
115 1 19 GLU H 1 64 PHE QD . . 4.640 4.275 4.135 4.502 . 0 0 "[ . 1 . 2]" 1
116 1 19 GLU H 1 64 PHE QE . . 5.210 4.975 4.723 5.206 . 0 0 "[ . 1 . 2]" 1
117 1 19 GLU H 1 65 GLU HA . . 3.800 2.805 2.673 2.938 . 0 0 "[ . 1 . 2]" 1
118 1 19 GLU H 1 66 VAL H . . 4.420 3.726 3.368 3.860 . 0 0 "[ . 1 . 2]" 1
119 1 19 GLU H 1 66 VAL QG . . 4.490 3.904 3.632 4.223 . 0 0 "[ . 1 . 2]" 1
120 1 19 GLU HA 1 19 GLU HG2 . . 3.950 2.804 2.440 3.051 . 0 0 "[ . 1 . 2]" 1
121 1 19 GLU HA 1 19 GLU HG3 . . 4.220 3.747 3.463 3.892 . 0 0 "[ . 1 . 2]" 1
122 1 19 GLU HA 1 20 THR H . . 2.860 2.309 2.286 2.318 . 0 0 "[ . 1 . 2]" 1
123 1 19 GLU HA 1 20 THR MG . . 3.900 3.295 3.147 3.495 . 0 0 "[ . 1 . 2]" 1
124 1 19 GLU HA 1 64 PHE H . . 4.840 4.822 4.744 4.857 0.017 18 0 "[ . 1 . 2]" 1
125 1 19 GLU HB2 1 20 THR H . . 3.740 3.711 3.598 3.745 0.005 13 0 "[ . 1 . 2]" 1
126 1 19 GLU HB2 1 64 PHE H . . 4.840 4.179 4.088 4.277 . 0 0 "[ . 1 . 2]" 1
127 1 19 GLU HB2 1 64 PHE QE . . 4.580 3.121 2.864 3.353 . 0 0 "[ . 1 . 2]" 1
128 1 19 GLU HB2 1 66 VAL HB . . 5.440 4.976 4.522 5.284 . 0 0 "[ . 1 . 2]" 1
129 1 19 GLU HB2 1 66 VAL QG . . 3.930 2.726 2.292 2.906 . 0 0 "[ . 1 . 2]" 1
130 1 19 GLU HB3 1 20 THR H . . 3.200 2.673 2.639 2.748 . 0 0 "[ . 1 . 2]" 1
131 1 19 GLU HB3 1 20 THR HA . . 5.110 4.609 4.541 4.713 . 0 0 "[ . 1 . 2]" 1
132 1 19 GLU HB3 1 64 PHE QE . . 4.830 4.098 3.828 4.398 . 0 0 "[ . 1 . 2]" 1
133 1 19 GLU HG2 1 20 THR H . . 5.500 4.712 4.301 4.944 . 0 0 "[ . 1 . 2]" 1
134 1 19 GLU HG2 1 64 PHE QE . . 5.500 5.408 5.187 5.510 0.010 1 0 "[ . 1 . 2]" 1
135 1 19 GLU HG2 1 66 VAL QG . . 4.430 3.251 2.873 3.820 . 0 0 "[ . 1 . 2]" 1
136 1 19 GLU HG3 1 20 THR H . . 5.160 5.120 5.043 5.160 . 2 0 "[ . 1 . 2]" 1
137 1 19 GLU HG3 1 64 PHE QE . . 4.660 4.408 4.149 4.628 . 0 0 "[ . 1 . 2]" 1
138 1 19 GLU HG3 1 66 VAL QG . . 3.880 2.089 1.794 2.505 . 0 0 "[ . 1 . 2]" 1
139 1 20 THR H 1 20 THR HB . . 4.060 3.826 3.797 3.862 . 0 0 "[ . 1 . 2]" 1
140 1 20 THR H 1 20 THR MG . . 3.300 2.675 2.499 2.856 . 0 0 "[ . 1 . 2]" 1
141 1 20 THR H 1 21 GLY H . . 4.520 4.446 4.389 4.475 . 0 0 "[ . 1 . 2]" 1
142 1 20 THR H 1 37 GLU H . . 5.500 5.423 5.082 5.513 0.013 7 0 "[ . 1 . 2]" 1
143 1 20 THR H 1 37 GLU HB2 . . 5.500 4.838 4.539 5.055 . 0 0 "[ . 1 . 2]" 1
144 1 20 THR H 1 37 GLU HG2 . . 4.940 4.443 4.066 4.786 . 0 0 "[ . 1 . 2]" 1
145 1 20 THR H 1 37 GLU HG3 . . 3.930 3.160 2.882 3.359 . 0 0 "[ . 1 . 2]" 1
146 1 20 THR H 1 63 GLU QG . . 5.340 4.559 4.288 4.746 . 0 0 "[ . 1 . 2]" 1
147 1 20 THR H 1 64 PHE HZ . . 5.500 5.221 5.022 5.493 . 0 0 "[ . 1 . 2]" 1
148 1 20 THR HA 1 20 THR MG . . 3.090 2.456 2.337 2.530 . 0 0 "[ . 1 . 2]" 1
149 1 20 THR HA 1 21 GLY H . . 2.800 2.230 2.201 2.295 . 0 0 "[ . 1 . 2]" 1
150 1 20 THR HA 1 62 VAL H . . 4.600 4.446 4.299 4.607 0.007 13 0 "[ . 1 . 2]" 1
151 1 20 THR HA 1 62 VAL MG2 . . 4.940 4.697 4.433 4.843 . 0 0 "[ . 1 . 2]" 1
152 1 20 THR HA 1 63 GLU HA . . 3.210 2.491 2.328 2.597 . 0 0 "[ . 1 . 2]" 1
153 1 20 THR HA 1 63 GLU HB2 . . 5.470 4.490 4.228 4.728 . 0 0 "[ . 1 . 2]" 1
154 1 20 THR HA 1 63 GLU QG . . 4.370 3.645 3.409 3.833 . 0 0 "[ . 1 . 2]" 1
155 1 20 THR HA 1 64 PHE H . . 3.720 3.355 3.257 3.491 . 0 0 "[ . 1 . 2]" 1
156 1 20 THR HA 1 64 PHE QD . . 4.520 3.951 3.695 4.140 . 0 0 "[ . 1 . 2]" 1
157 1 20 THR HA 1 64 PHE QE . . 4.050 3.439 3.063 3.736 . 0 0 "[ . 1 . 2]" 1
158 1 20 THR HA 1 83 ILE MD . . 4.400 3.702 3.560 3.862 . 0 0 "[ . 1 . 2]" 1
159 1 20 THR HB 1 21 GLY H . . 3.080 2.914 2.705 3.023 . 0 0 "[ . 1 . 2]" 1
160 1 20 THR HB 1 62 VAL H . . 4.730 4.127 3.900 4.328 . 0 0 "[ . 1 . 2]" 1
161 1 20 THR HB 1 62 VAL MG2 . . 5.440 5.326 4.944 5.450 0.010 1 0 "[ . 1 . 2]" 1
162 1 20 THR HB 1 63 GLU HA . . 4.310 3.805 3.677 3.949 . 0 0 "[ . 1 . 2]" 1
163 1 20 THR HB 1 63 GLU HB2 . . 5.240 4.563 4.281 4.765 . 0 0 "[ . 1 . 2]" 1
164 1 20 THR HB 1 64 PHE H . . 5.500 5.410 5.228 5.514 0.014 14 0 "[ . 1 . 2]" 1
165 1 20 THR HB 1 83 ILE MD . . 3.420 2.342 2.155 2.522 . 0 0 "[ . 1 . 2]" 1
166 1 20 THR MG 1 21 GLY H . . 4.030 3.992 3.878 4.035 0.005 14 0 "[ . 1 . 2]" 1
167 1 20 THR MG 1 62 VAL H . . 5.120 4.935 4.786 5.119 . 0 0 "[ . 1 . 2]" 1
168 1 20 THR MG 1 63 GLU H . . 4.740 4.466 4.302 4.627 . 0 0 "[ . 1 . 2]" 1
169 1 20 THR MG 1 63 GLU HA . . 3.470 2.659 2.431 2.934 . 0 0 "[ . 1 . 2]" 1
170 1 20 THR MG 1 63 GLU HB2 . . 3.310 2.797 2.507 3.034 . 0 0 "[ . 1 . 2]" 1
171 1 20 THR MG 1 63 GLU HG2 . . 3.650 3.143 2.997 3.403 . 0 0 "[ . 1 . 2]" 1
172 1 20 THR MG 1 63 GLU QG . . 3.140 1.974 1.782 2.127 . 0 0 "[ . 1 . 2]" 1
173 1 20 THR MG 1 63 GLU HG3 . . 3.650 1.996 1.795 2.156 . 0 0 "[ . 1 . 2]" 1
174 1 20 THR MG 1 64 PHE H . . 4.220 3.784 3.637 3.992 . 0 0 "[ . 1 . 2]" 1
175 1 20 THR MG 1 64 PHE QE . . 5.500 5.155 4.900 5.403 . 0 0 "[ . 1 . 2]" 1
176 1 20 THR MG 1 83 ILE MD . . 3.040 2.139 1.936 2.409 . 0 0 "[ . 1 . 2]" 1
177 1 21 GLY H 1 22 VAL H . . 4.010 3.935 3.767 4.023 0.013 16 0 "[ . 1 . 2]" 1
178 1 21 GLY H 1 22 VAL HB . . 5.500 5.474 5.335 5.516 0.016 13 0 "[ . 1 . 2]" 1
179 1 21 GLY H 1 33 ILE MG . . 4.000 3.503 3.366 3.640 . 0 0 "[ . 1 . 2]" 1
180 1 21 GLY H 1 35 CYS HA . . 5.220 4.605 4.385 4.849 . 0 0 "[ . 1 . 2]" 1
181 1 21 GLY H 1 61 ASP HB3 . . 5.500 5.134 4.842 5.458 . 0 0 "[ . 1 . 2]" 1
182 1 21 GLY H 1 62 VAL HB . . 5.500 5.402 5.304 5.501 0.001 12 0 "[ . 1 . 2]" 1
183 1 21 GLY H 1 62 VAL MG2 . . 3.730 3.565 3.389 3.685 . 0 0 "[ . 1 . 2]" 1
184 1 21 GLY H 1 63 GLU HA . . 4.260 3.957 3.756 4.141 . 0 0 "[ . 1 . 2]" 1
185 1 21 GLY H 1 64 PHE QD . . 4.290 4.082 3.815 4.277 . 0 0 "[ . 1 . 2]" 1
186 1 21 GLY H 1 64 PHE QE . . 3.440 2.603 2.075 3.207 . 0 0 "[ . 1 . 2]" 1
187 1 21 GLY H 1 83 ILE MD . . 4.340 3.867 3.647 4.046 . 0 0 "[ . 1 . 2]" 1
188 1 21 GLY H 1 83 ILE HG13 . . 5.500 5.433 5.299 5.506 0.006 18 0 "[ . 1 . 2]" 1
189 1 21 GLY HA2 1 22 VAL H . . 3.230 3.130 3.064 3.232 0.002 12 0 "[ . 1 . 2]" 1
190 1 21 GLY HA2 1 22 VAL MG1 . . 4.740 4.387 4.185 4.534 . 0 0 "[ . 1 . 2]" 1
191 1 21 GLY HA2 1 33 ILE MG . . 4.430 4.058 3.865 4.179 . 0 0 "[ . 1 . 2]" 1
192 1 21 GLY HA2 1 35 CYS HA . . 4.350 3.043 2.674 3.400 . 0 0 "[ . 1 . 2]" 1
193 1 21 GLY HA2 1 36 SER H . . 3.290 2.107 1.898 2.547 . 0 0 "[ . 1 . 2]" 1
194 1 21 GLY HA2 1 36 SER HB2 . . 4.660 2.395 2.006 2.647 . 0 0 "[ . 1 . 2]" 1
195 1 21 GLY HA2 1 36 SER QB . . 4.060 2.372 1.995 2.615 . 0 0 "[ . 1 . 2]" 1
196 1 21 GLY HA2 1 36 SER HB3 . . 4.660 3.888 3.108 4.196 . 0 0 "[ . 1 . 2]" 1
197 1 21 GLY HA2 1 37 GLU H . . 5.280 4.350 4.003 4.748 . 0 0 "[ . 1 . 2]" 1
198 1 21 GLY HA3 1 22 VAL H . . 3.020 2.162 2.137 2.184 . 0 0 "[ . 1 . 2]" 1
199 1 21 GLY HA3 1 22 VAL MG1 . . 4.520 4.206 4.097 4.322 . 0 0 "[ . 1 . 2]" 1
200 1 21 GLY HA3 1 33 ILE MG . . 3.360 2.675 2.475 2.798 . 0 0 "[ . 1 . 2]" 1
201 1 21 GLY HA3 1 35 CYS HA . . 4.000 2.238 2.007 2.493 . 0 0 "[ . 1 . 2]" 1
202 1 21 GLY HA3 1 36 SER H . . 3.520 2.779 2.492 3.179 . 0 0 "[ . 1 . 2]" 1
203 1 21 GLY HA3 1 37 GLU H . . 5.440 4.966 4.749 5.170 . 0 0 "[ . 1 . 2]" 1
204 1 21 GLY HA3 1 62 VAL MG2 . . 4.870 4.603 4.475 4.758 . 0 0 "[ . 1 . 2]" 1
205 1 21 GLY HA3 1 64 PHE QE . . 4.180 2.965 2.701 3.189 . 0 0 "[ . 1 . 2]" 1
206 1 22 VAL H 1 22 VAL HB . . 3.230 3.224 3.137 3.274 0.044 15 0 "[ . 1 . 2]" 1
207 1 22 VAL H 1 22 VAL MG1 . . 3.330 2.570 2.430 2.676 . 0 0 "[ . 1 . 2]" 1
208 1 22 VAL H 1 22 VAL MG2 . . 4.250 4.030 4.010 4.062 . 0 0 "[ . 1 . 2]" 1
209 1 22 VAL H 1 23 ILE H . . 4.310 4.249 4.075 4.339 0.029 15 0 "[ . 1 . 2]" 1
210 1 22 VAL H 1 23 ILE HG12 . . 5.500 5.393 5.256 5.574 0.074 12 0 "[ . 1 . 2]" 1
211 1 22 VAL H 1 33 ILE HA . . 4.550 4.016 3.879 4.137 . 0 0 "[ . 1 . 2]" 1
212 1 22 VAL H 1 33 ILE HB . . 5.280 4.902 4.772 4.992 . 0 0 "[ . 1 . 2]" 1
213 1 22 VAL H 1 33 ILE MD . . 5.500 5.246 5.161 5.354 . 0 0 "[ . 1 . 2]" 1
214 1 22 VAL H 1 33 ILE MG . . 3.140 2.066 1.965 2.171 . 0 0 "[ . 1 . 2]" 1
215 1 22 VAL H 1 34 GLN H . . 3.360 3.257 3.118 3.381 0.021 19 0 "[ . 1 . 2]" 1
216 1 22 VAL H 1 34 GLN HB2 . . 5.360 5.157 4.903 5.283 . 0 0 "[ . 1 . 2]" 1
217 1 22 VAL H 1 34 GLN HB3 . . 4.150 3.813 3.533 3.954 . 0 0 "[ . 1 . 2]" 1
218 1 22 VAL H 1 34 GLN HG2 . . 5.500 5.456 5.314 5.523 0.023 16 0 "[ . 1 . 2]" 1
219 1 22 VAL H 1 34 GLN HG3 . . 5.500 4.919 4.748 5.060 . 0 0 "[ . 1 . 2]" 1
220 1 22 VAL H 1 35 CYS HA . . 4.790 3.561 3.324 3.779 . 0 0 "[ . 1 . 2]" 1
221 1 22 VAL H 1 36 SER H . . 5.180 4.282 3.959 4.614 . 0 0 "[ . 1 . 2]" 1
222 1 22 VAL H 1 64 PHE QE . . 4.560 3.888 3.735 4.192 . 0 0 "[ . 1 . 2]" 1
223 1 22 VAL HA 1 22 VAL MG1 . . 3.220 3.177 3.164 3.191 . 0 0 "[ . 1 . 2]" 1
224 1 22 VAL HA 1 22 VAL MG2 . . 3.160 2.276 2.220 2.330 . 0 0 "[ . 1 . 2]" 1
225 1 22 VAL HA 1 23 ILE H . . 2.690 2.209 2.143 2.288 . 0 0 "[ . 1 . 2]" 1
226 1 22 VAL HA 1 23 ILE HB . . 4.900 4.745 4.620 4.872 . 0 0 "[ . 1 . 2]" 1
227 1 22 VAL HA 1 23 ILE MD . . 4.870 4.561 3.818 4.888 0.018 7 0 "[ . 1 . 2]" 1
228 1 22 VAL HA 1 23 ILE HG12 . . 4.350 3.645 3.467 3.828 . 0 0 "[ . 1 . 2]" 1
229 1 22 VAL HA 1 23 ILE HG13 . . 5.500 5.262 5.065 5.415 . 0 0 "[ . 1 . 2]" 1
230 1 22 VAL HA 1 33 ILE MG . . 4.580 3.536 3.398 3.671 . 0 0 "[ . 1 . 2]" 1
231 1 22 VAL HA 1 34 GLN H . . 5.230 4.904 4.826 4.958 . 0 0 "[ . 1 . 2]" 1
232 1 22 VAL HA 1 62 VAL H . . 3.880 3.672 3.386 3.894 0.014 14 0 "[ . 1 . 2]" 1
233 1 22 VAL HA 1 62 VAL MG2 . . 3.710 3.220 2.957 3.476 . 0 0 "[ . 1 . 2]" 1
234 1 22 VAL HB 1 23 ILE H . . 4.440 4.201 4.041 4.410 . 0 0 "[ . 1 . 2]" 1
235 1 22 VAL HB 1 33 ILE MG . . 5.040 4.695 4.634 4.769 . 0 0 "[ . 1 . 2]" 1
236 1 22 VAL HB 1 34 GLN H . . 5.250 5.194 5.131 5.275 0.025 12 0 "[ . 1 . 2]" 1
237 1 22 VAL HB 1 34 GLN HB3 . . 4.530 4.491 4.303 4.557 0.027 13 0 "[ . 1 . 2]" 1
238 1 22 VAL HB 1 34 GLN HG2 . . 5.500 5.528 5.506 5.562 0.062 8 0 "[ . 1 . 2]" 1
239 1 22 VAL HB 1 59 GLY HA2 . . 5.500 5.379 5.163 5.461 . 0 0 "[ . 1 . 2]" 1
240 1 22 VAL HB 1 61 ASP HA . . 4.740 4.289 3.863 4.645 . 0 0 "[ . 1 . 2]" 1
241 1 22 VAL HB 1 62 VAL MG2 . . 5.500 5.337 5.136 5.528 0.028 17 0 "[ . 1 . 2]" 1
242 1 22 VAL MG1 1 23 ILE H . . 3.860 3.561 3.348 3.800 . 0 0 "[ . 1 . 2]" 1
243 1 22 VAL MG1 1 23 ILE HA . . 5.090 4.134 3.997 4.318 . 0 0 "[ . 1 . 2]" 1
244 1 22 VAL MG1 1 24 GLU H . . 4.800 3.439 3.286 3.573 . 0 0 "[ . 1 . 2]" 1
245 1 22 VAL MG1 1 24 GLU HA . . 4.400 3.344 3.184 3.597 . 0 0 "[ . 1 . 2]" 1
246 1 22 VAL MG1 1 34 GLN H . . 4.170 2.693 2.446 2.897 . 0 0 "[ . 1 . 2]" 1
247 1 22 VAL MG1 1 34 GLN HB2 . . 4.180 3.335 3.036 3.443 . 0 0 "[ . 1 . 2]" 1
248 1 22 VAL MG1 1 34 GLN HB3 . . 3.820 1.916 1.806 1.985 . 0 0 "[ . 1 . 2]" 1
249 1 22 VAL MG1 1 34 GLN HG2 . . 4.670 3.094 2.973 3.217 . 0 0 "[ . 1 . 2]" 1
250 1 22 VAL MG1 1 34 GLN HG3 . . 5.330 3.545 3.313 3.859 . 0 0 "[ . 1 . 2]" 1
251 1 22 VAL MG1 1 36 SER HB2 . . 5.500 5.183 4.030 5.514 0.014 18 0 "[ . 1 . 2]" 1
252 1 22 VAL MG1 1 36 SER HB3 . . 5.500 5.511 5.502 5.519 0.019 8 0 "[ . 1 . 2]" 1
253 1 22 VAL MG1 1 59 GLY HA2 . . 4.410 4.050 3.697 4.350 . 0 0 "[ . 1 . 2]" 1
254 1 22 VAL MG1 1 60 ASP H . . 5.450 5.202 4.822 5.458 0.008 14 0 "[ . 1 . 2]" 1
255 1 22 VAL MG2 1 23 ILE H . . 3.350 2.268 1.917 2.787 . 0 0 "[ . 1 . 2]" 1
256 1 22 VAL MG2 1 23 ILE HA . . 4.740 4.271 4.031 4.578 . 0 0 "[ . 1 . 2]" 1
257 1 22 VAL MG2 1 23 ILE HB . . 4.170 3.723 3.508 3.961 . 0 0 "[ . 1 . 2]" 1
258 1 22 VAL MG2 1 34 GLN HB3 . . 4.850 4.466 4.221 4.644 . 0 0 "[ . 1 . 2]" 1
259 1 22 VAL MG2 1 59 GLY H . . 3.180 3.124 2.966 3.194 0.014 12 0 "[ . 1 . 2]" 1
260 1 22 VAL MG2 1 59 GLY HA2 . . 3.220 2.484 2.231 2.589 . 0 0 "[ . 1 . 2]" 1
261 1 22 VAL MG2 1 59 GLY HA3 . . 3.900 3.868 3.623 3.913 0.013 2 0 "[ . 1 . 2]" 1
262 1 22 VAL MG2 1 60 ASP H . . 4.580 3.121 2.797 3.495 . 0 0 "[ . 1 . 2]" 1
263 1 22 VAL MG2 1 60 ASP HA . . 4.520 3.762 3.378 4.047 . 0 0 "[ . 1 . 2]" 1
264 1 22 VAL MG2 1 61 ASP HA . . 3.920 3.330 2.938 3.539 . 0 0 "[ . 1 . 2]" 1
265 1 22 VAL MG2 1 61 ASP HB2 . . 5.500 5.103 4.638 5.346 . 0 0 "[ . 1 . 2]" 1
266 1 22 VAL MG2 1 61 ASP HB3 . . 5.500 5.335 4.896 5.503 0.003 6 0 "[ . 1 . 2]" 1
267 1 23 ILE H 1 23 ILE HB . . 3.030 2.559 2.455 2.687 . 0 0 "[ . 1 . 2]" 1
268 1 23 ILE H 1 23 ILE MD . . 3.730 3.437 2.783 3.739 0.009 1 0 "[ . 1 . 2]" 1
269 1 23 ILE H 1 23 ILE HG12 . . 3.070 2.111 1.881 2.367 . 0 0 "[ . 1 . 2]" 1
270 1 23 ILE H 1 23 ILE HG13 . . 3.670 3.453 3.228 3.648 . 0 0 "[ . 1 . 2]" 1
271 1 23 ILE H 1 23 ILE MG . . 3.820 3.764 3.756 3.775 . 0 0 "[ . 1 . 2]" 1
272 1 23 ILE H 1 24 GLU H . . 4.460 4.186 4.124 4.230 . 0 0 "[ . 1 . 2]" 1
273 1 23 ILE H 1 33 ILE HA . . 4.600 4.488 4.246 4.609 0.009 15 0 "[ . 1 . 2]" 1
274 1 23 ILE H 1 33 ILE MG . . 4.190 3.929 3.708 4.145 . 0 0 "[ . 1 . 2]" 1
275 1 23 ILE H 1 58 VAL HA . . 4.670 4.525 4.395 4.652 . 0 0 "[ . 1 . 2]" 1
276 1 23 ILE H 1 59 GLY H . . 4.010 3.211 3.033 3.390 . 0 0 "[ . 1 . 2]" 1
277 1 23 ILE H 1 59 GLY HA2 . . 4.640 4.222 3.998 4.474 . 0 0 "[ . 1 . 2]" 1
278 1 23 ILE H 1 60 ASP H . . 4.000 2.965 2.700 3.617 . 0 0 "[ . 1 . 2]" 1
279 1 23 ILE H 1 60 ASP HB2 . . 5.050 4.658 4.454 4.836 . 0 0 "[ . 1 . 2]" 1
280 1 23 ILE H 1 61 ASP HA . . 4.660 4.101 3.904 4.265 . 0 0 "[ . 1 . 2]" 1
281 1 23 ILE H 1 62 VAL H . . 4.940 4.906 4.759 4.955 0.015 1 0 "[ . 1 . 2]" 1
282 1 23 ILE H 1 62 VAL MG1 . . 4.680 4.645 4.523 4.691 0.011 8 0 "[ . 1 . 2]" 1
283 1 23 ILE H 1 62 VAL MG2 . . 4.120 3.256 3.027 3.397 . 0 0 "[ . 1 . 2]" 1
284 1 23 ILE HA 1 23 ILE MD . . 3.210 2.204 2.034 2.402 . 0 0 "[ . 1 . 2]" 1
285 1 23 ILE HA 1 23 ILE HG12 . . 4.080 2.916 2.757 3.249 . 0 0 "[ . 1 . 2]" 1
286 1 23 ILE HA 1 23 ILE MG . . 3.270 2.378 2.201 2.479 . 0 0 "[ . 1 . 2]" 1
287 1 23 ILE HA 1 24 GLU H . . 2.930 2.229 2.214 2.251 . 0 0 "[ . 1 . 2]" 1
288 1 23 ILE HA 1 24 GLU HB2 . . 5.380 4.557 4.449 4.781 . 0 0 "[ . 1 . 2]" 1
289 1 23 ILE HA 1 24 GLU QB . . 4.560 4.163 4.143 4.181 . 0 0 "[ . 1 . 2]" 1
290 1 23 ILE HA 1 24 GLU HB3 . . 5.380 4.828 4.583 4.940 . 0 0 "[ . 1 . 2]" 1
291 1 23 ILE HA 1 25 LYS H . . 4.150 3.724 3.581 3.848 . 0 0 "[ . 1 . 2]" 1
292 1 23 ILE HA 1 33 ILE HA . . 3.490 2.284 2.132 2.438 . 0 0 "[ . 1 . 2]" 1
293 1 23 ILE HA 1 33 ILE MD . . 4.580 4.307 4.127 4.479 . 0 0 "[ . 1 . 2]" 1
294 1 23 ILE HA 1 33 ILE HG12 . . 4.460 2.775 2.571 2.939 . 0 0 "[ . 1 . 2]" 1
295 1 23 ILE HA 1 33 ILE HG13 . . 4.380 3.280 3.039 3.576 . 0 0 "[ . 1 . 2]" 1
296 1 23 ILE HA 1 33 ILE MG . . 4.180 3.332 3.124 3.466 . 0 0 "[ . 1 . 2]" 1
297 1 23 ILE HA 1 34 GLN H . . 3.910 3.547 3.432 3.739 . 0 0 "[ . 1 . 2]" 1
298 1 23 ILE HA 1 58 VAL QG . . 5.440 4.254 4.140 4.381 . 0 0 "[ . 1 . 2]" 1
299 1 23 ILE HA 1 59 GLY H . . 5.040 4.322 4.210 4.512 . 0 0 "[ . 1 . 2]" 1
300 1 23 ILE HA 1 62 VAL MG2 . . 4.740 3.901 3.760 4.035 . 0 0 "[ . 1 . 2]" 1
301 1 23 ILE HB 1 23 ILE MD . . 3.590 3.206 3.175 3.224 . 0 0 "[ . 1 . 2]" 1
302 1 23 ILE HB 1 24 GLU H . . 4.920 4.443 4.383 4.487 . 0 0 "[ . 1 . 2]" 1
303 1 23 ILE HB 1 25 LYS H . . 5.500 5.196 4.906 5.421 . 0 0 "[ . 1 . 2]" 1
304 1 23 ILE HB 1 56 LEU QD . . 5.280 4.460 4.200 4.605 . 0 0 "[ . 1 . 2]" 1
305 1 23 ILE HB 1 57 LYS H . . 5.500 4.645 4.432 4.946 . 0 0 "[ . 1 . 2]" 1
306 1 23 ILE HB 1 58 VAL H . . 4.840 4.638 4.501 4.827 . 0 0 "[ . 1 . 2]" 1
307 1 23 ILE HB 1 58 VAL HA . . 3.360 2.115 1.993 2.334 . 0 0 "[ . 1 . 2]" 1
308 1 23 ILE HB 1 58 VAL MG1 . . 4.630 3.636 3.415 3.867 . 0 0 "[ . 1 . 2]" 1
309 1 23 ILE HB 1 58 VAL QG . . 3.990 3.304 3.135 3.496 . 0 0 "[ . 1 . 2]" 1
310 1 23 ILE HB 1 58 VAL MG2 . . 4.630 3.802 3.573 3.988 . 0 0 "[ . 1 . 2]" 1
311 1 23 ILE HB 1 59 GLY H . . 3.200 1.903 1.883 1.976 . 0 0 "[ . 1 . 2]" 1
312 1 23 ILE HB 1 60 ASP H . . 3.520 2.471 2.304 2.874 . 0 0 "[ . 1 . 2]" 1
313 1 23 ILE HB 1 60 ASP HB2 . . 4.520 3.943 3.759 4.352 . 0 0 "[ . 1 . 2]" 1
314 1 23 ILE HB 1 62 VAL MG2 . . 4.940 4.308 4.159 4.600 . 0 0 "[ . 1 . 2]" 1
315 1 23 ILE MD 1 23 ILE MG . . 2.840 1.881 1.818 1.931 . 0 0 "[ . 1 . 2]" 1
316 1 23 ILE MD 1 24 GLU H . . 4.220 4.040 3.829 4.229 0.009 15 0 "[ . 1 . 2]" 1
317 1 23 ILE MD 1 25 LYS H . . 4.930 4.608 4.356 4.934 0.004 16 0 "[ . 1 . 2]" 1
318 1 23 ILE MD 1 26 LEU QD . . 3.840 2.675 2.286 3.466 . 0 0 "[ . 1 . 2]" 1
319 1 23 ILE MD 1 32 PHE H . . 5.380 4.654 4.252 5.101 . 0 0 "[ . 1 . 2]" 1
320 1 23 ILE MD 1 33 ILE HA . . 4.180 3.370 3.115 3.742 . 0 0 "[ . 1 . 2]" 1
321 1 23 ILE MD 1 33 ILE MD . . 3.140 2.606 2.422 2.857 . 0 0 "[ . 1 . 2]" 1
322 1 23 ILE MD 1 33 ILE HG12 . . 3.510 1.875 1.774 1.969 . 0 0 "[ . 1 . 2]" 1
323 1 23 ILE MD 1 33 ILE HG13 . . 3.470 2.436 2.072 2.999 . 0 0 "[ . 1 . 2]" 1
324 1 23 ILE MD 1 44 PHE QE . . 3.130 2.561 2.204 3.082 . 0 0 "[ . 1 . 2]" 1
325 1 23 ILE MD 1 44 PHE HZ . . 4.260 3.347 2.983 4.037 . 0 0 "[ . 1 . 2]" 1
326 1 23 ILE MD 1 56 LEU QD . . 2.820 2.097 1.805 2.583 . 0 0 "[ . 1 . 2]" 1
327 1 23 ILE MD 1 56 LEU HG . . 4.000 2.984 2.476 3.439 . 0 0 "[ . 1 . 2]" 1
328 1 23 ILE MD 1 58 VAL HA . . 4.520 4.343 4.079 4.530 0.010 4 0 "[ . 1 . 2]" 1
329 1 23 ILE MD 1 59 GLY H . . 4.970 4.733 4.667 4.778 . 0 0 "[ . 1 . 2]" 1
330 1 23 ILE MD 1 60 ASP H . . 5.040 4.695 4.379 4.987 . 0 0 "[ . 1 . 2]" 1
331 1 23 ILE MD 1 62 VAL HB . . 4.520 3.830 3.514 4.029 . 0 0 "[ . 1 . 2]" 1
332 1 23 ILE MD 1 80 LEU MD2 . . 3.420 2.554 2.436 2.726 . 0 0 "[ . 1 . 2]" 1
333 1 23 ILE HG12 1 23 ILE MG . . 3.570 3.183 3.153 3.199 . 0 0 "[ . 1 . 2]" 1
334 1 23 ILE HG12 1 56 LEU QD . . 4.620 3.607 3.382 3.832 . 0 0 "[ . 1 . 2]" 1
335 1 23 ILE HG12 1 58 VAL HA . . 4.830 4.582 4.334 4.799 . 0 0 "[ . 1 . 2]" 1
336 1 23 ILE HG12 1 59 GLY H . . 4.640 4.091 3.815 4.357 . 0 0 "[ . 1 . 2]" 1
337 1 23 ILE HG12 1 60 ASP HB2 . . 4.400 4.108 3.251 4.415 0.015 6 0 "[ . 1 . 2]" 1
338 1 23 ILE HG12 1 62 VAL MG1 . . 3.440 3.179 2.972 3.390 . 0 0 "[ . 1 . 2]" 1
339 1 23 ILE HG13 1 23 ILE MG . . 3.030 2.496 2.307 2.623 . 0 0 "[ . 1 . 2]" 1
340 1 23 ILE HG13 1 26 LEU QD . . 3.870 3.556 3.338 3.793 . 0 0 "[ . 1 . 2]" 1
341 1 23 ILE HG13 1 56 LEU MD1 . . 3.800 3.052 2.697 3.341 . 0 0 "[ . 1 . 2]" 1
342 1 23 ILE HG13 1 56 LEU QD . . 3.320 2.788 2.558 2.971 . 0 0 "[ . 1 . 2]" 1
343 1 23 ILE HG13 1 56 LEU MD2 . . 3.800 3.261 2.786 3.649 . 0 0 "[ . 1 . 2]" 1
344 1 23 ILE HG13 1 58 VAL HA . . 4.670 3.883 3.736 4.056 . 0 0 "[ . 1 . 2]" 1
345 1 23 ILE HG13 1 59 GLY H . . 4.600 4.077 3.705 4.247 . 0 0 "[ . 1 . 2]" 1
346 1 23 ILE HG13 1 60 ASP HB2 . . 4.260 3.473 3.068 3.784 . 0 0 "[ . 1 . 2]" 1
347 1 23 ILE HG13 1 60 ASP HB3 . . 5.490 4.621 4.119 5.125 . 0 0 "[ . 1 . 2]" 1
348 1 23 ILE HG13 1 62 VAL MG1 . . 3.380 3.207 3.079 3.383 0.003 12 0 "[ . 1 . 2]" 1
349 1 23 ILE MG 1 24 GLU H . . 3.590 3.377 3.285 3.451 . 0 0 "[ . 1 . 2]" 1
350 1 23 ILE MG 1 24 GLU HA . . 4.930 4.258 4.105 4.485 . 0 0 "[ . 1 . 2]" 1
351 1 23 ILE MG 1 24 GLU QB . . 4.690 4.458 4.406 4.562 . 0 0 "[ . 1 . 2]" 1
352 1 23 ILE MG 1 25 LYS H . . 3.250 3.005 2.807 3.212 . 0 0 "[ . 1 . 2]" 1
353 1 23 ILE MG 1 25 LYS HA . . 4.590 3.683 3.545 3.877 . 0 0 "[ . 1 . 2]" 1
354 1 23 ILE MG 1 26 LEU HA . . 4.450 3.721 3.596 3.802 . 0 0 "[ . 1 . 2]" 1
355 1 23 ILE MG 1 26 LEU QB . . 3.330 2.410 2.338 2.525 . 0 0 "[ . 1 . 2]" 1
356 1 23 ILE MG 1 31 GLY HA2 . . 5.360 4.737 4.548 4.878 . 0 0 "[ . 1 . 2]" 1
357 1 23 ILE MG 1 32 PHE H . . 4.260 3.744 3.518 3.927 . 0 0 "[ . 1 . 2]" 1
358 1 23 ILE MG 1 33 ILE HA . . 4.460 3.932 3.716 4.080 . 0 0 "[ . 1 . 2]" 1
359 1 23 ILE MG 1 33 ILE MD . . 5.230 4.391 4.195 4.546 . 0 0 "[ . 1 . 2]" 1
360 1 23 ILE MG 1 33 ILE HG12 . . 4.660 3.762 3.443 3.998 . 0 0 "[ . 1 . 2]" 1
361 1 23 ILE MG 1 33 ILE HG13 . . 3.990 3.699 3.438 3.873 . 0 0 "[ . 1 . 2]" 1
362 1 23 ILE MG 1 44 PHE QD . . 4.440 4.192 3.993 4.346 . 0 0 "[ . 1 . 2]" 1
363 1 23 ILE MG 1 44 PHE QE . . 3.600 2.690 2.492 2.833 . 0 0 "[ . 1 . 2]" 1
364 1 23 ILE MG 1 56 LEU QD . . 4.320 3.349 3.097 3.611 . 0 0 "[ . 1 . 2]" 1
365 1 23 ILE MG 1 58 VAL H . . 4.460 3.652 3.485 3.871 . 0 0 "[ . 1 . 2]" 1
366 1 23 ILE MG 1 58 VAL HA . . 3.000 1.937 1.857 2.118 . 0 0 "[ . 1 . 2]" 1
367 1 23 ILE MG 1 58 VAL HB . . 4.350 4.042 3.915 4.255 . 0 0 "[ . 1 . 2]" 1
368 1 23 ILE MG 1 58 VAL QG . . 3.480 2.010 1.885 2.127 . 0 0 "[ . 1 . 2]" 1
369 1 23 ILE MG 1 59 GLY H . . 3.530 3.161 2.976 3.395 . 0 0 "[ . 1 . 2]" 1
370 1 23 ILE MG 1 59 GLY HA2 . . 5.500 5.111 4.909 5.343 . 0 0 "[ . 1 . 2]" 1
371 1 23 ILE MG 1 60 ASP H . . 4.310 4.034 3.911 4.307 . 0 0 "[ . 1 . 2]" 1
372 1 23 ILE MG 1 60 ASP HB2 . . 5.040 4.724 4.485 5.037 . 0 0 "[ . 1 . 2]" 1
373 1 24 GLU H 1 24 GLU HB2 . . 3.660 2.369 2.264 2.612 . 0 0 "[ . 1 . 2]" 1
374 1 24 GLU H 1 24 GLU QB . . 3.100 2.219 2.179 2.251 . 0 0 "[ . 1 . 2]" 1
375 1 24 GLU H 1 24 GLU HB3 . . 3.660 2.714 2.455 2.838 . 0 0 "[ . 1 . 2]" 1
376 1 24 GLU H 1 24 GLU HG2 . . 5.310 4.565 4.389 4.632 . 0 0 "[ . 1 . 2]" 1
377 1 24 GLU H 1 24 GLU QG . . 4.680 4.030 3.911 4.071 . 0 0 "[ . 1 . 2]" 1
378 1 24 GLU H 1 24 GLU HG3 . . 5.310 4.490 4.250 4.596 . 0 0 "[ . 1 . 2]" 1
379 1 24 GLU H 1 25 LYS H . . 2.870 2.619 2.559 2.743 . 0 0 "[ . 1 . 2]" 1
380 1 24 GLU H 1 32 PHE H . . 4.930 4.939 4.884 4.954 0.024 13 0 "[ . 1 . 2]" 1
381 1 24 GLU H 1 33 ILE HA . . 3.390 2.204 2.001 2.295 . 0 0 "[ . 1 . 2]" 1
382 1 24 GLU H 1 33 ILE HG12 . . 5.040 4.415 4.182 4.551 . 0 0 "[ . 1 . 2]" 1
383 1 24 GLU H 1 33 ILE HG13 . . 4.520 4.369 4.204 4.538 0.018 17 0 "[ . 1 . 2]" 1
384 1 24 GLU H 1 33 ILE MG . . 4.660 3.873 3.741 3.992 . 0 0 "[ . 1 . 2]" 1
385 1 24 GLU H 1 34 GLN H . . 3.910 2.292 2.212 2.372 . 0 0 "[ . 1 . 2]" 1
386 1 24 GLU H 1 34 GLN HB3 . . 5.500 3.914 3.786 4.100 . 0 0 "[ . 1 . 2]" 1
387 1 24 GLU H 1 58 VAL QG . . 5.230 4.113 3.924 4.260 . 0 0 "[ . 1 . 2]" 1
388 1 24 GLU HA 1 24 GLU HG2 . . 3.820 3.467 2.648 3.754 . 0 0 "[ . 1 . 2]" 1
389 1 24 GLU HA 1 24 GLU QG . . 3.320 2.718 2.201 3.033 . 0 0 "[ . 1 . 2]" 1
390 1 24 GLU HA 1 24 GLU HG3 . . 3.820 2.864 2.246 3.202 . 0 0 "[ . 1 . 2]" 1
391 1 24 GLU HA 1 34 GLN H . . 4.560 4.190 3.940 4.307 . 0 0 "[ . 1 . 2]" 1
392 1 24 GLU HA 1 58 VAL QG . . 4.520 3.055 2.863 3.277 . 0 0 "[ . 1 . 2]" 1
393 1 24 GLU QB 1 25 LYS H . . 3.180 2.493 2.349 2.610 . 0 0 "[ . 1 . 2]" 1
394 1 24 GLU QB 1 25 LYS HB2 . . 4.140 3.303 3.192 3.553 . 0 0 "[ . 1 . 2]" 1
395 1 24 GLU QB 1 25 LYS HB3 . . 5.290 4.292 4.199 4.501 . 0 0 "[ . 1 . 2]" 1
396 1 24 GLU QB 1 25 LYS QG . . 5.180 4.828 4.733 5.015 . 0 0 "[ . 1 . 2]" 1
397 1 24 GLU QB 1 32 PHE H . . 4.920 4.726 4.473 4.873 . 0 0 "[ . 1 . 2]" 1
398 1 24 GLU QB 1 32 PHE HB2 . . 4.090 3.012 2.733 3.157 . 0 0 "[ . 1 . 2]" 1
399 1 24 GLU QB 1 32 PHE HB3 . . 4.170 3.466 3.088 3.799 . 0 0 "[ . 1 . 2]" 1
400 1 24 GLU QB 1 33 ILE HA . . 4.400 3.509 3.189 3.680 . 0 0 "[ . 1 . 2]" 1
401 1 24 GLU QB 1 33 ILE MG . . 5.290 4.631 4.460 4.763 . 0 0 "[ . 1 . 2]" 1
402 1 24 GLU QB 1 34 GLN H . . 4.350 2.430 2.193 2.557 . 0 0 "[ . 1 . 2]" 1
403 1 24 GLU HB2 1 33 ILE HA . . 5.250 3.799 3.360 4.050 . 0 0 "[ . 1 . 2]" 1
404 1 24 GLU HB3 1 33 ILE HA . . 5.250 4.159 3.789 4.357 . 0 0 "[ . 1 . 2]" 1
405 1 24 GLU QG 1 25 LYS H . . 4.030 3.896 3.537 4.039 0.009 6 0 "[ . 1 . 2]" 1
406 1 24 GLU QG 1 25 LYS HB2 . . 4.260 3.480 2.884 3.673 . 0 0 "[ . 1 . 2]" 1
407 1 24 GLU QG 1 25 LYS HB3 . . 5.340 4.975 4.422 5.188 . 0 0 "[ . 1 . 2]" 1
408 1 24 GLU QG 1 25 LYS QG . . 4.690 4.501 4.057 4.689 . 0 0 "[ . 1 . 2]" 1
409 1 24 GLU QG 1 32 PHE HB2 . . 4.820 4.490 4.003 4.826 0.006 13 0 "[ . 1 . 2]" 1
410 1 24 GLU QG 1 34 GLN H . . 4.650 4.440 4.097 4.605 . 0 0 "[ . 1 . 2]" 1
411 1 24 GLU QG 1 58 VAL QG . . 4.970 4.170 3.833 4.559 . 0 0 "[ . 1 . 2]" 1
412 1 24 GLU HG2 1 34 GLN H . . 5.500 4.884 4.289 5.508 0.008 8 0 "[ . 1 . 2]" 1
413 1 24 GLU HG3 1 34 GLN H . . 5.500 5.260 4.556 5.520 0.020 2 0 "[ . 1 . 2]" 1
414 1 25 LYS H 1 25 LYS HB2 . . 3.610 2.926 2.870 2.977 . 0 0 "[ . 1 . 2]" 1
415 1 25 LYS H 1 25 LYS HB3 . . 3.580 3.119 3.057 3.194 . 0 0 "[ . 1 . 2]" 1
416 1 25 LYS H 1 25 LYS HG2 . . 5.010 4.564 4.547 4.580 . 0 0 "[ . 1 . 2]" 1
417 1 25 LYS H 1 25 LYS QG . . 4.190 4.222 4.198 4.244 0.054 4 0 "[ . 1 . 2]" 1
418 1 25 LYS H 1 25 LYS HG3 . . 5.010 4.977 4.931 5.017 0.007 4 0 "[ . 1 . 2]" 1
419 1 25 LYS H 1 26 LEU H . . 4.480 4.402 4.377 4.426 . 0 0 "[ . 1 . 2]" 1
420 1 25 LYS H 1 32 PHE H . . 3.290 3.031 2.938 3.074 . 0 0 "[ . 1 . 2]" 1
421 1 25 LYS H 1 32 PHE HA . . 5.120 4.652 4.524 4.738 . 0 0 "[ . 1 . 2]" 1
422 1 25 LYS H 1 32 PHE HB2 . . 3.860 2.657 2.462 2.862 . 0 0 "[ . 1 . 2]" 1
423 1 25 LYS H 1 32 PHE HB3 . . 4.240 3.981 3.678 4.244 0.004 12 0 "[ . 1 . 2]" 1
424 1 25 LYS H 1 32 PHE QD . . 4.840 4.156 4.030 4.290 . 0 0 "[ . 1 . 2]" 1
425 1 25 LYS H 1 33 ILE HA . . 4.260 4.000 3.909 4.084 . 0 0 "[ . 1 . 2]" 1
426 1 25 LYS H 1 34 GLN H . . 5.040 4.641 4.579 4.713 . 0 0 "[ . 1 . 2]" 1
427 1 25 LYS H 1 44 PHE QE . . 5.080 4.925 4.785 5.046 . 0 0 "[ . 1 . 2]" 1
428 1 25 LYS H 1 58 VAL HA . . 5.500 5.038 4.796 5.177 . 0 0 "[ . 1 . 2]" 1
429 1 25 LYS H 1 58 VAL MG1 . . 4.910 3.842 3.362 4.276 . 0 0 "[ . 1 . 2]" 1
430 1 25 LYS H 1 58 VAL MG2 . . 4.910 3.621 3.479 3.752 . 0 0 "[ . 1 . 2]" 1
431 1 25 LYS HA 1 25 LYS HD2 . . 4.520 4.145 3.307 4.372 . 0 0 "[ . 1 . 2]" 1
432 1 25 LYS HA 1 25 LYS HD3 . . 4.610 3.303 3.130 3.850 . 0 0 "[ . 1 . 2]" 1
433 1 25 LYS HA 1 25 LYS HE2 . . 5.500 4.911 4.130 5.416 . 0 0 "[ . 1 . 2]" 1
434 1 25 LYS HA 1 25 LYS QE . . 4.820 4.227 3.648 4.700 . 0 0 "[ . 1 . 2]" 1
435 1 25 LYS HA 1 25 LYS HE3 . . 5.500 4.811 3.758 5.526 0.026 11 0 "[ . 1 . 2]" 1
436 1 25 LYS HA 1 25 LYS HG2 . . 3.970 2.150 2.136 2.170 . 0 0 "[ . 1 . 2]" 1
437 1 25 LYS HA 1 25 LYS QG . . 3.400 2.130 2.115 2.149 . 0 0 "[ . 1 . 2]" 1
438 1 25 LYS HA 1 25 LYS HG3 . . 3.970 3.451 3.430 3.472 . 0 0 "[ . 1 . 2]" 1
439 1 25 LYS HA 1 26 LEU H . . 2.530 2.310 2.280 2.349 . 0 0 "[ . 1 . 2]" 1
440 1 25 LYS HA 1 32 PHE H . . 4.860 4.437 4.412 4.492 . 0 0 "[ . 1 . 2]" 1
441 1 25 LYS HA 1 58 VAL MG1 . . 4.050 2.713 2.415 3.040 . 0 0 "[ . 1 . 2]" 1
442 1 25 LYS HA 1 58 VAL QG . . 3.230 2.110 1.923 2.300 . 0 0 "[ . 1 . 2]" 1
443 1 25 LYS HA 1 58 VAL MG2 . . 4.050 2.216 1.960 2.472 . 0 0 "[ . 1 . 2]" 1
444 1 25 LYS HB2 1 25 LYS HE2 . . 5.500 4.869 3.476 5.452 . 0 0 "[ . 1 . 2]" 1
445 1 25 LYS HB2 1 25 LYS HE3 . . 5.500 4.985 4.543 5.453 . 0 0 "[ . 1 . 2]" 1
446 1 25 LYS HB2 1 26 LEU H . . 4.490 4.130 4.082 4.170 . 0 0 "[ . 1 . 2]" 1
447 1 25 LYS HB2 1 27 LEU QD . . 4.460 4.458 4.303 4.514 0.054 20 0 "[ . 1 . 2]" 1
448 1 25 LYS HB2 1 32 PHE H . . 4.100 4.110 4.087 4.131 0.031 16 0 "[ . 1 . 2]" 1
449 1 25 LYS HB2 1 32 PHE HB2 . . 4.050 2.926 2.670 3.074 . 0 0 "[ . 1 . 2]" 1
450 1 25 LYS HB2 1 32 PHE HB3 . . 4.660 4.471 4.100 4.671 0.011 20 0 "[ . 1 . 2]" 1
451 1 25 LYS HB2 1 32 PHE QD . . 3.880 3.543 3.431 3.722 . 0 0 "[ . 1 . 2]" 1
452 1 25 LYS HB2 1 58 VAL MG1 . . 5.500 4.618 4.407 4.879 . 0 0 "[ . 1 . 2]" 1
453 1 25 LYS HB2 1 58 VAL MG2 . . 5.500 4.484 4.364 4.660 . 0 0 "[ . 1 . 2]" 1
454 1 25 LYS HB3 1 26 LEU H . . 3.810 3.387 3.265 3.485 . 0 0 "[ . 1 . 2]" 1
455 1 25 LYS HB3 1 27 LEU QD . . 3.780 3.138 2.904 3.204 . 0 0 "[ . 1 . 2]" 1
456 1 25 LYS HB3 1 32 PHE H . . 3.800 2.831 2.755 2.926 . 0 0 "[ . 1 . 2]" 1
457 1 25 LYS HB3 1 32 PHE HB2 . . 3.970 2.598 2.410 2.882 . 0 0 "[ . 1 . 2]" 1
458 1 25 LYS HB3 1 32 PHE HB3 . . 5.230 4.289 4.086 4.562 . 0 0 "[ . 1 . 2]" 1
459 1 25 LYS HB3 1 32 PHE QD . . 3.510 2.061 1.995 2.236 . 0 0 "[ . 1 . 2]" 1
460 1 25 LYS HB3 1 32 PHE QE . . 4.320 3.926 3.807 4.026 . 0 0 "[ . 1 . 2]" 1
461 1 25 LYS HD2 1 26 LEU H . . 4.350 3.434 2.013 3.743 . 0 0 "[ . 1 . 2]" 1
462 1 25 LYS HD2 1 27 LEU QD . . 3.920 1.995 1.880 2.234 . 0 0 "[ . 1 . 2]" 1
463 1 25 LYS HD2 1 27 LEU HG . . 4.020 3.159 2.778 3.340 . 0 0 "[ . 1 . 2]" 1
464 1 25 LYS HD2 1 32 PHE QD . . 4.460 3.081 2.628 3.396 . 0 0 "[ . 1 . 2]" 1
465 1 25 LYS HD2 1 32 PHE QE . . 4.720 3.431 3.085 4.294 . 0 0 "[ . 1 . 2]" 1
466 1 25 LYS HD3 1 26 LEU H . . 4.750 2.026 1.882 2.730 . 0 0 "[ . 1 . 2]" 1
467 1 25 LYS HD3 1 27 LEU QD . . 4.010 2.372 1.963 3.226 . 0 0 "[ . 1 . 2]" 1
468 1 25 LYS HD3 1 32 PHE QD . . 4.680 3.762 3.220 4.695 0.015 14 0 "[ . 1 . 2]" 1
469 1 25 LYS HD3 1 32 PHE QE . . 5.250 4.633 4.116 5.258 0.008 14 0 "[ . 1 . 2]" 1
470 1 25 LYS HD3 1 58 VAL MG1 . . 5.500 5.435 5.212 5.519 0.019 13 0 "[ . 1 . 2]" 1
471 1 25 LYS HD3 1 58 VAL QG . . 4.600 3.909 3.771 4.230 . 0 0 "[ . 1 . 2]" 1
472 1 25 LYS HD3 1 58 VAL MG2 . . 5.500 4.009 3.858 4.396 . 0 0 "[ . 1 . 2]" 1
473 1 25 LYS QE 1 25 LYS QG . . 3.250 2.249 2.091 2.542 . 0 0 "[ . 1 . 2]" 1
474 1 25 LYS QE 1 26 LEU H . . 4.780 3.428 2.583 4.014 . 0 0 "[ . 1 . 2]" 1
475 1 25 LYS QE 1 27 LEU QD . . 3.340 2.456 1.727 3.215 . 0 0 "[ . 1 . 2]" 1
476 1 25 LYS HE2 1 26 LEU H . . 5.500 3.977 3.329 4.736 . 0 0 "[ . 1 . 2]" 1
477 1 25 LYS HE3 1 26 LEU H . . 5.500 3.809 2.691 4.594 . 0 0 "[ . 1 . 2]" 1
478 1 25 LYS QG 1 26 LEU H . . 3.840 2.690 2.625 2.823 . 0 0 "[ . 1 . 2]" 1
479 1 25 LYS QG 1 27 LEU QD . . 3.840 3.611 3.490 3.769 . 0 0 "[ . 1 . 2]" 1
480 1 25 LYS QG 1 32 PHE H . . 5.340 4.840 4.778 4.938 . 0 0 "[ . 1 . 2]" 1
481 1 25 LYS QG 1 32 PHE HB2 . . 5.090 4.439 4.246 4.629 . 0 0 "[ . 1 . 2]" 1
482 1 25 LYS QG 1 32 PHE QD . . 4.390 3.991 3.871 4.167 . 0 0 "[ . 1 . 2]" 1
483 1 25 LYS QG 1 58 VAL QG . . 5.240 3.291 3.101 3.402 . 0 0 "[ . 1 . 2]" 1
484 1 25 LYS HG2 1 32 PHE QD . . 5.040 4.842 4.735 5.027 . 0 0 "[ . 1 . 2]" 1
485 1 25 LYS HG3 1 32 PHE QD . . 5.040 4.249 4.106 4.448 . 0 0 "[ . 1 . 2]" 1
486 1 26 LEU H 1 26 LEU HB2 . . 3.480 3.060 2.990 3.104 . 0 0 "[ . 1 . 2]" 1
487 1 26 LEU H 1 26 LEU QB . . 3.040 2.703 2.665 2.726 . 0 0 "[ . 1 . 2]" 1
488 1 26 LEU H 1 26 LEU HB3 . . 3.480 3.009 2.966 3.042 . 0 0 "[ . 1 . 2]" 1
489 1 26 LEU H 1 26 LEU MD1 . . 4.910 4.432 4.350 4.675 . 0 0 "[ . 1 . 2]" 1
490 1 26 LEU H 1 26 LEU QD . . 4.150 4.027 4.001 4.049 . 0 0 "[ . 1 . 2]" 1
491 1 26 LEU H 1 26 LEU MD2 . . 4.910 4.628 4.374 4.675 . 0 0 "[ . 1 . 2]" 1
492 1 26 LEU H 1 27 LEU H . . 4.200 4.289 4.255 4.323 0.123 16 0 "[ . 1 . 2]" 1
493 1 26 LEU H 1 32 PHE H . . 4.840 4.389 4.293 4.491 . 0 0 "[ . 1 . 2]" 1
494 1 26 LEU H 1 32 PHE QD . . 5.390 4.714 4.548 4.814 . 0 0 "[ . 1 . 2]" 1
495 1 26 LEU H 1 58 VAL HB . . 5.050 5.060 5.024 5.099 0.049 13 0 "[ . 1 . 2]" 1
496 1 26 LEU H 1 58 VAL QG . . 3.180 2.414 2.372 2.465 . 0 0 "[ . 1 . 2]" 1
497 1 26 LEU HA 1 26 LEU MD1 . . 3.870 2.536 2.304 3.534 . 0 0 "[ . 1 . 2]" 1
498 1 26 LEU HA 1 26 LEU QD . . 3.220 2.480 2.287 2.984 . 0 0 "[ . 1 . 2]" 1
499 1 26 LEU HA 1 26 LEU MD2 . . 3.870 3.797 3.217 3.843 . 0 0 "[ . 1 . 2]" 1
500 1 26 LEU HA 1 27 LEU H . . 2.640 2.193 2.170 2.204 . 0 0 "[ . 1 . 2]" 1
501 1 26 LEU HA 1 27 LEU HB2 . . 4.940 4.580 4.503 4.667 . 0 0 "[ . 1 . 2]" 1
502 1 26 LEU HA 1 27 LEU QD . . 3.760 2.723 2.553 2.965 . 0 0 "[ . 1 . 2]" 1
503 1 26 LEU HA 1 27 LEU HG . . 5.330 4.489 4.382 4.597 . 0 0 "[ . 1 . 2]" 1
504 1 26 LEU HA 1 31 GLY HA2 . . 3.950 2.298 2.215 2.376 . 0 0 "[ . 1 . 2]" 1
505 1 26 LEU HA 1 31 GLY HA3 . . 3.760 2.331 2.184 2.490 . 0 0 "[ . 1 . 2]" 1
506 1 26 LEU HA 1 32 PHE H . . 5.030 3.191 3.080 3.260 . 0 0 "[ . 1 . 2]" 1
507 1 26 LEU QB 1 26 LEU QD . . 2.570 1.829 1.775 1.886 . 0 0 "[ . 1 . 2]" 1
508 1 26 LEU QB 1 27 LEU H . . 3.960 3.571 3.538 3.624 . 0 0 "[ . 1 . 2]" 1
509 1 26 LEU QB 1 31 GLY HA3 . . 5.340 3.941 3.840 4.166 . 0 0 "[ . 1 . 2]" 1
510 1 26 LEU QB 1 58 VAL H . . 4.220 3.644 3.335 3.776 . 0 0 "[ . 1 . 2]" 1
511 1 26 LEU QB 1 58 VAL QG . . 3.210 1.848 1.726 1.955 . 0 0 "[ . 1 . 2]" 1
512 1 26 LEU HB2 1 26 LEU MD1 . . 3.340 2.115 2.067 2.187 . 0 0 "[ . 1 . 2]" 1
513 1 26 LEU HB2 1 26 LEU MD2 . . 3.340 2.672 2.526 3.100 . 0 0 "[ . 1 . 2]" 1
514 1 26 LEU HB2 1 27 LEU H . . 4.620 4.260 4.241 4.319 . 0 0 "[ . 1 . 2]" 1
515 1 26 LEU HB3 1 26 LEU MD1 . . 3.340 3.094 2.633 3.155 . 0 0 "[ . 1 . 2]" 1
516 1 26 LEU HB3 1 26 LEU MD2 . . 3.340 2.109 1.974 2.226 . 0 0 "[ . 1 . 2]" 1
517 1 26 LEU HB3 1 27 LEU H . . 4.620 3.834 3.788 3.892 . 0 0 "[ . 1 . 2]" 1
518 1 26 LEU QD 1 27 LEU H . . 3.210 3.217 2.551 3.277 0.067 15 0 "[ . 1 . 2]" 1
519 1 26 LEU QD 1 31 GLY H . . 5.320 4.147 3.921 5.076 . 0 0 "[ . 1 . 2]" 1
520 1 26 LEU QD 1 31 GLY HA2 . . 4.320 3.500 3.301 4.314 . 0 0 "[ . 1 . 2]" 1
521 1 26 LEU QD 1 31 GLY HA3 . . 3.700 2.197 2.012 3.592 . 0 0 "[ . 1 . 2]" 1
522 1 26 LEU QD 1 32 PHE H . . 4.800 3.973 3.776 4.820 0.020 4 0 "[ . 1 . 2]" 1
523 1 26 LEU QD 1 44 PHE QE . . 3.950 2.187 1.997 3.207 . 0 0 "[ . 1 . 2]" 1
524 1 26 LEU QD 1 44 PHE HZ . . 3.340 1.823 1.762 2.541 . 0 0 "[ . 1 . 2]" 1
525 1 26 LEU QD 1 53 LEU HB3 . . 5.420 3.462 3.188 3.747 . 0 0 "[ . 1 . 2]" 1
526 1 26 LEU QD 1 53 LEU MD1 . . 3.270 2.149 1.927 2.387 . 0 0 "[ . 1 . 2]" 1
527 1 26 LEU QD 1 53 LEU HG . . 4.450 4.159 3.980 4.453 0.003 10 0 "[ . 1 . 2]" 1
528 1 26 LEU QD 1 56 LEU QB . . 3.740 2.589 1.976 2.773 . 0 0 "[ . 1 . 2]" 1
529 1 26 LEU QD 1 56 LEU QD . . 3.010 2.390 2.053 2.562 . 0 0 "[ . 1 . 2]" 1
530 1 26 LEU QD 1 56 LEU HG . . 4.100 2.932 2.414 3.134 . 0 0 "[ . 1 . 2]" 1
531 1 26 LEU QD 1 57 LYS H . . 4.030 3.591 3.260 3.793 . 0 0 "[ . 1 . 2]" 1
532 1 26 LEU QD 1 57 LYS HA . . 3.350 2.367 2.036 2.607 . 0 0 "[ . 1 . 2]" 1
533 1 26 LEU QD 1 57 LYS QB . . 4.850 3.792 3.552 3.989 . 0 0 "[ . 1 . 2]" 1
534 1 26 LEU QD 1 58 VAL H . . 3.980 3.408 3.141 3.520 . 0 0 "[ . 1 . 2]" 1
535 1 26 LEU QD 1 58 VAL QG . . 3.830 2.787 2.609 2.923 . 0 0 "[ . 1 . 2]" 1
536 1 26 LEU MD1 1 27 LEU H . . 4.330 3.502 3.367 4.370 0.040 4 0 "[ . 1 . 2]" 1
537 1 26 LEU MD1 1 31 GLY HA2 . . 5.500 3.573 3.329 5.039 . 0 0 "[ . 1 . 2]" 1
538 1 26 LEU MD1 1 31 GLY HA3 . . 4.970 2.215 2.014 3.897 . 0 0 "[ . 1 . 2]" 1
539 1 26 LEU MD1 1 44 PHE HZ . . 4.010 1.828 1.765 2.578 . 0 0 "[ . 1 . 2]" 1
540 1 26 LEU MD1 1 53 LEU MD1 . . 3.820 2.343 2.022 2.646 . 0 0 "[ . 1 . 2]" 1
541 1 26 LEU MD1 1 53 LEU HG . . 5.360 4.711 4.342 5.118 . 0 0 "[ . 1 . 2]" 1
542 1 26 LEU MD1 1 56 LEU HA . . 5.500 5.032 3.964 5.204 . 0 0 "[ . 1 . 2]" 1
543 1 26 LEU MD1 1 56 LEU HB2 . . 5.330 4.277 3.530 4.498 . 0 0 "[ . 1 . 2]" 1
544 1 26 LEU MD1 1 56 LEU HB3 . . 5.330 2.987 2.007 3.174 . 0 0 "[ . 1 . 2]" 1
545 1 26 LEU MD1 1 57 LYS H . . 5.500 4.092 3.294 4.425 . 0 0 "[ . 1 . 2]" 1
546 1 26 LEU MD1 1 57 LYS HA . . 3.860 3.746 2.572 3.871 0.011 2 0 "[ . 1 . 2]" 1
547 1 26 LEU MD1 1 58 VAL H . . 4.520 4.437 3.223 4.539 0.019 13 0 "[ . 1 . 2]" 1
548 1 26 LEU MD2 1 27 LEU H . . 4.330 3.901 2.568 4.195 . 0 0 "[ . 1 . 2]" 1
549 1 26 LEU MD2 1 31 GLY HA2 . . 5.500 5.420 4.690 5.518 0.018 18 0 "[ . 1 . 2]" 1
550 1 26 LEU MD2 1 31 GLY HA3 . . 4.970 4.690 4.208 4.816 . 0 0 "[ . 1 . 2]" 1
551 1 26 LEU MD2 1 44 PHE HZ . . 4.010 3.908 3.796 4.019 0.009 14 0 "[ . 1 . 2]" 1
552 1 26 LEU MD2 1 53 LEU MD1 . . 3.820 2.534 2.151 2.829 . 0 0 "[ . 1 . 2]" 1
553 1 26 LEU MD2 1 53 LEU HG . . 5.360 4.654 4.227 4.915 . 0 0 "[ . 1 . 2]" 1
554 1 26 LEU MD2 1 56 LEU HA . . 5.500 4.902 4.661 5.513 0.013 4 0 "[ . 1 . 2]" 1
555 1 26 LEU MD2 1 56 LEU HB2 . . 5.330 4.487 4.007 4.723 . 0 0 "[ . 1 . 2]" 1
556 1 26 LEU MD2 1 56 LEU HB3 . . 5.330 2.970 2.449 3.246 . 0 0 "[ . 1 . 2]" 1
557 1 26 LEU MD2 1 57 LYS H . . 5.500 4.043 3.742 5.184 . 0 0 "[ . 1 . 2]" 1
558 1 26 LEU MD2 1 57 LYS HA . . 3.860 2.451 2.046 3.756 . 0 0 "[ . 1 . 2]" 1
559 1 26 LEU MD2 1 58 VAL H . . 4.520 3.597 3.223 4.526 0.006 4 0 "[ . 1 . 2]" 1
560 1 26 LEU HG 1 27 LEU H . . 4.150 2.484 2.405 2.852 . 0 0 "[ . 1 . 2]" 1
561 1 26 LEU HG 1 32 PHE H . . 5.500 5.494 4.834 5.546 0.046 12 0 "[ . 1 . 2]" 1
562 1 26 LEU HG 1 58 VAL QG . . 4.380 4.249 4.059 4.390 0.010 12 0 "[ . 1 . 2]" 1
563 1 27 LEU H 1 27 LEU HB2 . . 3.420 2.720 2.645 2.779 . 0 0 "[ . 1 . 2]" 1
564 1 27 LEU H 1 27 LEU HB3 . . 4.020 3.815 3.782 3.840 . 0 0 "[ . 1 . 2]" 1
565 1 27 LEU H 1 27 LEU QD . . 3.480 2.350 2.040 2.640 . 0 0 "[ . 1 . 2]" 1
566 1 27 LEU H 1 27 LEU HG . . 3.730 3.660 3.549 3.735 0.005 12 0 "[ . 1 . 2]" 1
567 1 27 LEU H 1 28 THR H . . 4.480 4.385 4.376 4.397 . 0 0 "[ . 1 . 2]" 1
568 1 27 LEU H 1 30 TYR H . . 3.890 3.663 3.569 3.743 . 0 0 "[ . 1 . 2]" 1
569 1 27 LEU H 1 30 TYR QD . . 4.780 4.102 3.861 4.465 . 0 0 "[ . 1 . 2]" 1
570 1 27 LEU H 1 31 GLY H . . 4.890 4.424 4.368 4.491 . 0 0 "[ . 1 . 2]" 1
571 1 27 LEU H 1 31 GLY HA2 . . 3.600 2.820 2.572 2.956 . 0 0 "[ . 1 . 2]" 1
572 1 27 LEU H 1 31 GLY HA3 . . 3.740 3.233 3.138 3.347 . 0 0 "[ . 1 . 2]" 1
573 1 27 LEU HA 1 27 LEU MD1 . . 4.140 3.377 3.273 3.432 . 0 0 "[ . 1 . 2]" 1
574 1 27 LEU HA 1 27 LEU QD . . 3.510 3.091 3.055 3.117 . 0 0 "[ . 1 . 2]" 1
575 1 27 LEU HA 1 27 LEU MD2 . . 4.140 3.587 3.500 3.660 . 0 0 "[ . 1 . 2]" 1
576 1 27 LEU HA 1 27 LEU HG . . 3.870 2.539 2.466 2.608 . 0 0 "[ . 1 . 2]" 1
577 1 27 LEU HA 1 28 THR H . . 3.030 2.646 2.620 2.668 . 0 0 "[ . 1 . 2]" 1
578 1 27 LEU HA 1 28 THR HA . . 4.520 4.331 4.323 4.342 . 0 0 "[ . 1 . 2]" 1
579 1 27 LEU HB2 1 28 THR H . . 3.360 3.062 2.944 3.137 . 0 0 "[ . 1 . 2]" 1
580 1 27 LEU HB2 1 28 THR HA . . 5.040 4.904 4.788 4.961 . 0 0 "[ . 1 . 2]" 1
581 1 27 LEU HB2 1 28 THR HB . . 5.500 5.126 4.974 5.294 . 0 0 "[ . 1 . 2]" 1
582 1 27 LEU HB2 1 30 TYR H . . 3.330 2.197 2.131 2.286 . 0 0 "[ . 1 . 2]" 1
583 1 27 LEU HB2 1 30 TYR QE . . 5.070 3.746 3.448 4.081 . 0 0 "[ . 1 . 2]" 1
584 1 27 LEU HB2 1 31 GLY H . . 5.500 5.159 5.034 5.249 . 0 0 "[ . 1 . 2]" 1
585 1 27 LEU HB3 1 28 THR H . . 2.750 1.992 1.933 2.063 . 0 0 "[ . 1 . 2]" 1
586 1 27 LEU HB3 1 28 THR HA . . 4.950 4.636 4.566 4.701 . 0 0 "[ . 1 . 2]" 1
587 1 27 LEU HB3 1 28 THR HB . . 4.830 4.124 4.048 4.296 . 0 0 "[ . 1 . 2]" 1
588 1 27 LEU HB3 1 30 TYR H . . 3.830 3.519 3.393 3.670 . 0 0 "[ . 1 . 2]" 1
589 1 27 LEU HB3 1 30 TYR QD . . 4.940 4.305 3.996 4.638 . 0 0 "[ . 1 . 2]" 1
590 1 27 LEU HB3 1 30 TYR QE . . 4.740 4.470 4.069 4.749 0.009 4 0 "[ . 1 . 2]" 1
591 1 27 LEU QD 1 28 THR H . . 4.060 3.544 3.450 3.650 . 0 0 "[ . 1 . 2]" 1
592 1 27 LEU QD 1 30 TYR HB2 . . 4.910 4.149 3.894 4.399 . 0 0 "[ . 1 . 2]" 1
593 1 27 LEU QD 1 30 TYR QD . . 3.820 1.998 1.947 2.316 . 0 0 "[ . 1 . 2]" 1
594 1 27 LEU QD 1 30 TYR QE . . 3.320 2.209 1.832 2.461 . 0 0 "[ . 1 . 2]" 1
595 1 27 LEU QD 1 31 GLY HA2 . . 3.780 2.210 1.923 2.400 . 0 0 "[ . 1 . 2]" 1
596 1 27 LEU QD 1 31 GLY HA3 . . 4.230 3.545 3.367 3.747 . 0 0 "[ . 1 . 2]" 1
597 1 27 LEU QD 1 32 PHE QD . . 3.980 2.632 2.198 2.872 . 0 0 "[ . 1 . 2]" 1
598 1 27 LEU QD 1 32 PHE QE . . 3.660 2.160 1.975 2.346 . 0 0 "[ . 1 . 2]" 1
599 1 27 LEU QD 1 32 PHE HZ . . 4.790 3.941 3.699 4.200 . 0 0 "[ . 1 . 2]" 1
600 1 27 LEU MD1 1 30 TYR QE . . 3.830 2.733 2.178 2.984 . 0 0 "[ . 1 . 2]" 1
601 1 27 LEU MD2 1 30 TYR QE . . 3.830 2.354 1.971 2.702 . 0 0 "[ . 1 . 2]" 1
602 1 27 LEU HG 1 28 THR H . . 4.800 4.228 4.151 4.307 . 0 0 "[ . 1 . 2]" 1
603 1 27 LEU HG 1 30 TYR QE . . 5.230 4.909 4.444 5.147 . 0 0 "[ . 1 . 2]" 1
604 1 27 LEU HG 1 32 PHE QE . . 5.360 4.699 4.244 5.094 . 0 0 "[ . 1 . 2]" 1
605 1 28 THR H 1 28 THR HA . . 2.930 2.880 2.868 2.897 . 0 0 "[ . 1 . 2]" 1
606 1 28 THR H 1 28 THR HB . . 3.100 2.448 2.383 2.594 . 0 0 "[ . 1 . 2]" 1
607 1 28 THR H 1 28 THR MG . . 3.780 3.701 2.568 3.789 0.009 15 0 "[ . 1 . 2]" 1
608 1 28 THR H 1 29 SER H . . 4.030 2.402 2.318 2.443 . 0 0 "[ . 1 . 2]" 1
609 1 28 THR H 1 30 TYR H . . 4.120 3.970 3.659 4.035 . 0 0 "[ . 1 . 2]" 1
610 1 28 THR HA 1 28 THR MG . . 3.030 2.448 2.263 3.137 0.107 14 0 "[ . 1 . 2]" 1
611 1 28 THR HA 1 30 TYR H . . 4.870 4.768 4.311 4.880 0.010 16 0 "[ . 1 . 2]" 1
612 1 28 THR HB 1 29 SER H . . 4.520 3.102 2.869 3.761 . 0 0 "[ . 1 . 2]" 1
613 1 28 THR HB 1 30 TYR H . . 5.390 5.258 5.147 5.511 0.121 14 0 "[ . 1 . 2]" 1
614 1 28 THR MG 1 29 SER HA . . 4.400 3.564 3.058 3.966 . 0 0 "[ . 1 . 2]" 1
615 1 28 THR MG 1 29 SER HB2 . . 5.440 4.646 4.148 5.017 . 0 0 "[ . 1 . 2]" 1
616 1 28 THR MG 1 29 SER QB . . 4.590 4.287 2.843 4.559 . 0 0 "[ . 1 . 2]" 1
617 1 28 THR MG 1 29 SER HB3 . . 5.440 5.169 2.892 5.396 . 0 0 "[ . 1 . 2]" 1
618 1 28 THR MG 1 30 TYR H . . 5.500 5.254 4.172 5.494 . 0 0 "[ . 1 . 2]" 1
619 1 29 SER H 1 30 TYR H . . 3.330 2.207 2.051 2.344 . 0 0 "[ . 1 . 2]" 1
620 1 29 SER HA 1 46 CYS QB . . 3.870 3.855 3.737 3.887 0.017 12 0 "[ . 1 . 2]" 1
621 1 29 SER QB 1 30 TYR H . . 4.070 2.667 2.527 3.595 . 0 0 "[ . 1 . 2]" 1
622 1 29 SER QB 1 30 TYR QD . . 4.000 3.296 2.823 3.616 . 0 0 "[ . 1 . 2]" 1
623 1 29 SER HB2 1 30 TYR QD . . 4.660 4.042 2.855 4.669 0.009 19 0 "[ . 1 . 2]" 1
624 1 29 SER HB3 1 30 TYR QD . . 4.660 3.612 3.256 4.465 . 0 0 "[ . 1 . 2]" 1
625 1 30 TYR H 1 30 TYR HB2 . . 4.170 3.874 3.802 3.932 . 0 0 "[ . 1 . 2]" 1
626 1 30 TYR H 1 30 TYR HB3 . . 3.820 3.678 3.610 3.785 . 0 0 "[ . 1 . 2]" 1
627 1 30 TYR H 1 30 TYR QD . . 3.390 2.648 2.248 3.350 . 0 0 "[ . 1 . 2]" 1
628 1 30 TYR H 1 30 TYR QE . . 4.530 4.098 3.907 4.536 0.006 14 0 "[ . 1 . 2]" 1
629 1 30 TYR H 1 31 GLY H . . 4.610 4.360 4.355 4.372 . 0 0 "[ . 1 . 2]" 1
630 1 30 TYR H 1 46 CYS H . . 4.810 4.707 4.547 4.806 . 0 0 "[ . 1 . 2]" 1
631 1 30 TYR H 1 46 CYS QB . . 5.340 4.405 3.956 4.947 . 0 0 "[ . 1 . 2]" 1
632 1 30 TYR H 1 53 LEU MD1 . . 5.460 5.353 5.093 5.480 0.020 1 0 "[ . 1 . 2]" 1
633 1 30 TYR HA 1 30 TYR QD . . 4.130 3.621 3.535 3.704 . 0 0 "[ . 1 . 2]" 1
634 1 30 TYR HA 1 30 TYR QE . . 5.500 5.582 5.564 5.597 0.097 15 0 "[ . 1 . 2]" 1
635 1 30 TYR HA 1 31 GLY H . . 2.860 2.637 2.575 2.655 . 0 0 "[ . 1 . 2]" 1
636 1 30 TYR HA 1 46 CYS H . . 3.860 2.220 2.006 2.410 . 0 0 "[ . 1 . 2]" 1
637 1 30 TYR HB2 1 31 GLY H . . 3.020 1.963 1.924 2.085 . 0 0 "[ . 1 . 2]" 1
638 1 30 TYR HB2 1 43 PHE QD . . 4.290 3.246 3.086 3.356 . 0 0 "[ . 1 . 2]" 1
639 1 30 TYR HB2 1 43 PHE QE . . 4.310 1.998 1.993 2.010 . 0 0 "[ . 1 . 2]" 1
640 1 30 TYR HB2 1 43 PHE HZ . . 4.620 4.268 4.229 4.336 . 0 0 "[ . 1 . 2]" 1
641 1 30 TYR HB2 1 44 PHE H . . 4.820 4.619 4.428 4.813 . 0 0 "[ . 1 . 2]" 1
642 1 30 TYR HB2 1 45 HIS HA . . 3.970 2.438 2.247 2.721 . 0 0 "[ . 1 . 2]" 1
643 1 30 TYR HB2 1 45 HIS HD2 . . 5.500 5.509 5.497 5.518 0.018 14 0 "[ . 1 . 2]" 1
644 1 30 TYR HB2 1 46 CYS H . . 4.140 3.462 3.231 3.715 . 0 0 "[ . 1 . 2]" 1
645 1 30 TYR HB3 1 31 GLY H . . 3.500 3.302 3.205 3.362 . 0 0 "[ . 1 . 2]" 1
646 1 30 TYR HB3 1 43 PHE QE . . 4.520 2.657 2.457 2.791 . 0 0 "[ . 1 . 2]" 1
647 1 30 TYR HB3 1 43 PHE HZ . . 4.180 4.092 3.929 4.164 . 0 0 "[ . 1 . 2]" 1
648 1 30 TYR HB3 1 45 HIS HA . . 3.940 2.043 1.992 2.205 . 0 0 "[ . 1 . 2]" 1
649 1 30 TYR HB3 1 45 HIS HD2 . . 4.930 4.554 4.381 4.634 . 0 0 "[ . 1 . 2]" 1
650 1 30 TYR HB3 1 46 CYS H . . 4.660 2.397 2.186 2.625 . 0 0 "[ . 1 . 2]" 1
651 1 30 TYR QD 1 31 GLY H . . 3.760 3.552 3.452 3.696 . 0 0 "[ . 1 . 2]" 1
652 1 30 TYR QD 1 31 GLY HA2 . . 4.180 3.441 3.280 3.619 . 0 0 "[ . 1 . 2]" 1
653 1 30 TYR QD 1 31 GLY HA3 . . 5.040 4.674 4.519 4.880 . 0 0 "[ . 1 . 2]" 1
654 1 30 TYR QD 1 32 PHE QE . . 3.950 3.722 3.194 3.953 0.003 13 0 "[ . 1 . 2]" 1
655 1 30 TYR QD 1 32 PHE HZ . . 5.250 4.998 4.626 5.257 0.007 13 0 "[ . 1 . 2]" 1
656 1 30 TYR QD 1 43 PHE QE . . 3.840 2.789 2.355 3.328 . 0 0 "[ . 1 . 2]" 1
657 1 30 TYR QD 1 45 HIS HA . . 4.470 3.646 3.346 3.963 . 0 0 "[ . 1 . 2]" 1
658 1 30 TYR QD 1 46 CYS H . . 4.690 4.241 4.084 4.456 . 0 0 "[ . 1 . 2]" 1
659 1 30 TYR QE 1 32 PHE QE . . 3.540 3.484 3.196 3.552 0.012 17 0 "[ . 1 . 2]" 1
660 1 30 TYR QE 1 32 PHE HZ . . 4.320 4.219 3.786 4.330 0.010 18 0 "[ . 1 . 2]" 1
661 1 30 TYR QE 1 43 PHE QE . . 4.870 4.115 3.713 4.620 . 0 0 "[ . 1 . 2]" 1
662 1 30 TYR QE 1 45 HIS HD2 . . 5.500 5.151 4.756 5.504 0.004 4 0 "[ . 1 . 2]" 1
663 1 31 GLY H 1 32 PHE H . . 4.700 4.415 4.401 4.434 . 0 0 "[ . 1 . 2]" 1
664 1 31 GLY H 1 43 PHE QD . . 4.100 3.683 3.552 3.832 . 0 0 "[ . 1 . 2]" 1
665 1 31 GLY H 1 43 PHE QE . . 4.640 3.594 3.451 3.703 . 0 0 "[ . 1 . 2]" 1
666 1 31 GLY H 1 44 PHE H . . 4.120 3.891 3.768 4.015 . 0 0 "[ . 1 . 2]" 1
667 1 31 GLY H 1 44 PHE QD . . 4.470 3.709 3.629 3.815 . 0 0 "[ . 1 . 2]" 1
668 1 31 GLY H 1 45 HIS H . . 5.500 4.932 4.857 4.992 . 0 0 "[ . 1 . 2]" 1
669 1 31 GLY H 1 45 HIS HA . . 4.370 3.297 3.204 3.403 . 0 0 "[ . 1 . 2]" 1
670 1 31 GLY H 1 46 CYS H . . 4.160 3.899 3.678 4.110 . 0 0 "[ . 1 . 2]" 1
671 1 31 GLY HA2 1 32 PHE H . . 3.090 2.373 2.332 2.417 . 0 0 "[ . 1 . 2]" 1
672 1 31 GLY HA2 1 32 PHE QE . . 4.830 4.136 3.783 4.385 . 0 0 "[ . 1 . 2]" 1
673 1 31 GLY HA2 1 44 PHE H . . 5.280 5.103 4.997 5.180 . 0 0 "[ . 1 . 2]" 1
674 1 31 GLY HA2 1 44 PHE QE . . 4.150 3.639 3.511 3.859 . 0 0 "[ . 1 . 2]" 1
675 1 31 GLY HA3 1 32 PHE H . . 3.010 2.773 2.718 2.826 . 0 0 "[ . 1 . 2]" 1
676 1 31 GLY HA3 1 44 PHE H . . 5.310 4.806 4.721 4.879 . 0 0 "[ . 1 . 2]" 1
677 1 31 GLY HA3 1 44 PHE QE . . 4.050 2.093 1.994 2.303 . 0 0 "[ . 1 . 2]" 1
678 1 32 PHE H 1 32 PHE HB2 . . 3.440 2.529 2.474 2.597 . 0 0 "[ . 1 . 2]" 1
679 1 32 PHE H 1 32 PHE HB3 . . 3.790 3.700 3.672 3.733 . 0 0 "[ . 1 . 2]" 1
680 1 32 PHE H 1 32 PHE QD . . 3.890 2.296 2.094 2.452 . 0 0 "[ . 1 . 2]" 1
681 1 32 PHE H 1 32 PHE QE . . 4.830 4.494 4.347 4.611 . 0 0 "[ . 1 . 2]" 1
682 1 32 PHE H 1 33 ILE H . . 4.640 4.525 4.480 4.550 . 0 0 "[ . 1 . 2]" 1
683 1 32 PHE H 1 33 ILE HG13 . . 4.890 4.538 4.382 4.608 . 0 0 "[ . 1 . 2]" 1
684 1 32 PHE H 1 44 PHE H . . 4.690 4.648 4.578 4.702 0.012 11 0 "[ . 1 . 2]" 1
685 1 32 PHE H 1 44 PHE QD . . 4.940 3.876 3.703 4.022 . 0 0 "[ . 1 . 2]" 1
686 1 32 PHE H 1 44 PHE QE . . 3.740 3.362 3.088 3.586 . 0 0 "[ . 1 . 2]" 1
687 1 32 PHE HA 1 32 PHE QD . . 3.800 3.125 3.065 3.198 . 0 0 "[ . 1 . 2]" 1
688 1 32 PHE HA 1 32 PHE QE . . 4.950 4.713 4.670 4.772 . 0 0 "[ . 1 . 2]" 1
689 1 32 PHE HA 1 33 ILE H . . 2.840 2.281 2.218 2.367 . 0 0 "[ . 1 . 2]" 1
690 1 32 PHE HA 1 33 ILE HB . . 4.740 4.481 4.419 4.538 . 0 0 "[ . 1 . 2]" 1
691 1 32 PHE HA 1 33 ILE HG13 . . 4.400 3.667 3.461 3.819 . 0 0 "[ . 1 . 2]" 1
692 1 32 PHE HA 1 42 LEU H . . 5.370 5.210 4.964 5.350 . 0 0 "[ . 1 . 2]" 1
693 1 32 PHE HA 1 43 PHE H . . 5.120 4.731 4.598 4.854 . 0 0 "[ . 1 . 2]" 1
694 1 32 PHE HA 1 43 PHE HA . . 3.670 2.221 2.129 2.311 . 0 0 "[ . 1 . 2]" 1
695 1 32 PHE HA 1 44 PHE H . . 3.740 2.463 2.312 2.616 . 0 0 "[ . 1 . 2]" 1
696 1 32 PHE HA 1 44 PHE QD . . 4.080 2.967 2.821 3.109 . 0 0 "[ . 1 . 2]" 1
697 1 32 PHE HB2 1 33 ILE H . . 4.000 3.865 3.705 3.999 . 0 0 "[ . 1 . 2]" 1
698 1 32 PHE HB2 1 41 ARG QG . . 5.010 4.798 4.574 5.044 0.034 12 0 "[ . 1 . 2]" 1
699 1 32 PHE HB3 1 33 ILE H . . 3.670 2.756 2.517 2.954 . 0 0 "[ . 1 . 2]" 1
700 1 32 PHE HB3 1 41 ARG HA . . 5.110 4.567 4.068 4.881 . 0 0 "[ . 1 . 2]" 1
701 1 32 PHE HB3 1 41 ARG QB . . 4.010 3.577 2.987 3.842 . 0 0 "[ . 1 . 2]" 1
702 1 32 PHE HB3 1 41 ARG QG . . 3.980 3.913 3.783 3.986 0.006 7 0 "[ . 1 . 2]" 1
703 1 32 PHE HB3 1 42 LEU H . . 4.610 4.434 4.089 4.622 0.012 14 0 "[ . 1 . 2]" 1
704 1 32 PHE QD 1 33 ILE H . . 4.390 4.015 3.817 4.296 . 0 0 "[ . 1 . 2]" 1
705 1 32 PHE QD 1 41 ARG QG . . 5.080 4.281 2.927 4.836 . 0 0 "[ . 1 . 2]" 1
706 1 32 PHE QD 1 42 LEU H . . 5.140 5.018 4.745 5.146 0.006 17 0 "[ . 1 . 2]" 1
707 1 32 PHE QD 1 43 PHE H . . 5.050 4.640 4.162 4.966 . 0 0 "[ . 1 . 2]" 1
708 1 32 PHE QD 1 43 PHE HA . . 3.970 3.020 2.540 3.283 . 0 0 "[ . 1 . 2]" 1
709 1 32 PHE QD 1 43 PHE HB2 . . 4.580 2.849 2.342 3.165 . 0 0 "[ . 1 . 2]" 1
710 1 32 PHE QD 1 43 PHE QD . . 4.400 4.212 3.969 4.392 . 0 0 "[ . 1 . 2]" 1
711 1 32 PHE QD 1 44 PHE H . . 4.890 4.636 4.383 4.776 . 0 0 "[ . 1 . 2]" 1
712 1 32 PHE QE 1 43 PHE HA . . 4.400 4.189 3.854 4.376 . 0 0 "[ . 1 . 2]" 1
713 1 32 PHE QE 1 43 PHE HB2 . . 3.840 2.685 2.118 3.023 . 0 0 "[ . 1 . 2]" 1
714 1 32 PHE QE 1 43 PHE HB3 . . 4.860 4.171 3.621 4.532 . 0 0 "[ . 1 . 2]" 1
715 1 32 PHE QE 1 43 PHE QD . . 4.490 4.149 3.798 4.331 . 0 0 "[ . 1 . 2]" 1
716 1 32 PHE QE 1 43 PHE QE . . 5.440 5.251 5.018 5.450 0.010 18 0 "[ . 1 . 2]" 1
717 1 33 ILE H 1 33 ILE HB . . 3.050 2.680 2.575 2.786 . 0 0 "[ . 1 . 2]" 1
718 1 33 ILE H 1 33 ILE MD . . 4.060 3.808 3.655 3.975 . 0 0 "[ . 1 . 2]" 1
719 1 33 ILE H 1 33 ILE HG12 . . 4.580 4.356 4.229 4.453 . 0 0 "[ . 1 . 2]" 1
720 1 33 ILE H 1 33 ILE HG13 . . 3.590 3.079 2.919 3.212 . 0 0 "[ . 1 . 2]" 1
721 1 33 ILE H 1 33 ILE MG . . 3.970 3.846 3.801 3.903 . 0 0 "[ . 1 . 2]" 1
722 1 33 ILE H 1 41 ARG HA . . 4.730 4.534 4.060 4.736 0.006 8 0 "[ . 1 . 2]" 1
723 1 33 ILE H 1 42 LEU H . . 3.460 3.276 2.953 3.418 . 0 0 "[ . 1 . 2]" 1
724 1 33 ILE H 1 42 LEU HA . . 5.120 4.509 4.346 4.621 . 0 0 "[ . 1 . 2]" 1
725 1 33 ILE H 1 42 LEU HB2 . . 4.740 3.383 3.158 3.549 . 0 0 "[ . 1 . 2]" 1
726 1 33 ILE H 1 43 PHE HA . . 4.150 3.335 3.232 3.637 . 0 0 "[ . 1 . 2]" 1
727 1 33 ILE H 1 44 PHE H . . 4.600 3.611 3.408 3.871 . 0 0 "[ . 1 . 2]" 1
728 1 33 ILE H 1 44 PHE QD . . 4.060 3.601 3.352 3.783 . 0 0 "[ . 1 . 2]" 1
729 1 33 ILE H 1 77 ALA MB . . 4.930 4.843 4.617 4.937 0.007 5 0 "[ . 1 . 2]" 1
730 1 33 ILE HA 1 33 ILE MD . . 4.220 3.856 3.837 3.888 . 0 0 "[ . 1 . 2]" 1
731 1 33 ILE HA 1 33 ILE HG12 . . 4.000 2.755 2.711 2.800 . 0 0 "[ . 1 . 2]" 1
732 1 33 ILE HA 1 33 ILE HG13 . . 4.020 2.664 2.593 2.776 . 0 0 "[ . 1 . 2]" 1
733 1 33 ILE HA 1 33 ILE MG . . 3.150 2.373 2.307 2.439 . 0 0 "[ . 1 . 2]" 1
734 1 33 ILE HA 1 34 GLN H . . 2.800 2.144 2.139 2.158 . 0 0 "[ . 1 . 2]" 1
735 1 33 ILE HA 1 34 GLN HB2 . . 4.950 4.679 4.575 4.731 . 0 0 "[ . 1 . 2]" 1
736 1 33 ILE HA 1 34 GLN HB3 . . 4.660 4.523 4.488 4.610 . 0 0 "[ . 1 . 2]" 1
737 1 33 ILE HB 1 33 ILE MD . . 3.140 2.151 2.107 2.216 . 0 0 "[ . 1 . 2]" 1
738 1 33 ILE HB 1 34 GLN H . . 4.490 4.357 4.305 4.421 . 0 0 "[ . 1 . 2]" 1
739 1 33 ILE HB 1 42 LEU H . . 4.180 4.010 3.977 4.070 . 0 0 "[ . 1 . 2]" 1
740 1 33 ILE HB 1 44 PHE H . . 4.970 4.581 4.415 4.724 . 0 0 "[ . 1 . 2]" 1
741 1 33 ILE HB 1 44 PHE QD . . 4.460 3.903 3.757 4.140 . 0 0 "[ . 1 . 2]" 1
742 1 33 ILE HB 1 64 PHE QD . . 5.500 4.561 4.278 4.804 . 0 0 "[ . 1 . 2]" 1
743 1 33 ILE HB 1 77 ALA MB . . 3.920 3.695 3.566 3.808 . 0 0 "[ . 1 . 2]" 1
744 1 33 ILE MD 1 33 ILE MG . . 3.010 2.359 2.215 2.441 . 0 0 "[ . 1 . 2]" 1
745 1 33 ILE MD 1 34 GLN H . . 5.500 5.369 5.317 5.427 . 0 0 "[ . 1 . 2]" 1
746 1 33 ILE MD 1 42 LEU H . . 5.500 5.532 5.509 5.574 0.074 14 0 "[ . 1 . 2]" 1
747 1 33 ILE MD 1 42 LEU HB2 . . 4.660 4.215 4.136 4.336 . 0 0 "[ . 1 . 2]" 1
748 1 33 ILE MD 1 42 LEU HB3 . . 4.830 4.114 3.929 4.348 . 0 0 "[ . 1 . 2]" 1
749 1 33 ILE MD 1 44 PHE H . . 4.900 3.670 3.550 3.801 . 0 0 "[ . 1 . 2]" 1
750 1 33 ILE MD 1 44 PHE HA . . 4.660 4.078 3.962 4.225 . 0 0 "[ . 1 . 2]" 1
751 1 33 ILE MD 1 44 PHE HB3 . . 3.760 1.911 1.809 2.035 . 0 0 "[ . 1 . 2]" 1
752 1 33 ILE MD 1 44 PHE QD . . 3.260 2.354 2.259 2.536 . 0 0 "[ . 1 . 2]" 1
753 1 33 ILE MD 1 62 VAL HB . . 4.580 3.781 3.516 4.004 . 0 0 "[ . 1 . 2]" 1
754 1 33 ILE MD 1 62 VAL MG2 . . 3.170 2.485 2.295 2.595 . 0 0 "[ . 1 . 2]" 1
755 1 33 ILE MD 1 64 PHE HB2 . . 4.660 4.070 3.989 4.181 . 0 0 "[ . 1 . 2]" 1
756 1 33 ILE MD 1 64 PHE HB3 . . 4.350 3.336 3.197 3.477 . 0 0 "[ . 1 . 2]" 1
757 1 33 ILE MD 1 64 PHE QD . . 3.740 2.761 2.538 3.154 . 0 0 "[ . 1 . 2]" 1
758 1 33 ILE MD 1 64 PHE QE . . 4.050 3.293 3.145 3.518 . 0 0 "[ . 1 . 2]" 1
759 1 33 ILE MD 1 77 ALA H . . 5.170 4.993 4.806 5.148 . 0 0 "[ . 1 . 2]" 1
760 1 33 ILE MD 1 77 ALA HA . . 5.420 5.073 4.886 5.274 . 0 0 "[ . 1 . 2]" 1
761 1 33 ILE MD 1 77 ALA MB . . 2.880 2.624 2.506 2.777 . 0 0 "[ . 1 . 2]" 1
762 1 33 ILE MD 1 78 VAL H . . 5.500 5.495 5.410 5.514 0.014 14 0 "[ . 1 . 2]" 1
763 1 33 ILE MD 1 80 LEU HA . . 5.500 4.726 4.609 4.786 . 0 0 "[ . 1 . 2]" 1
764 1 33 ILE HG12 1 33 ILE MG . . 3.390 2.181 2.101 2.271 . 0 0 "[ . 1 . 2]" 1
765 1 33 ILE HG12 1 34 GLN H . . 4.640 4.607 4.523 4.657 0.017 18 0 "[ . 1 . 2]" 1
766 1 33 ILE HG12 1 44 PHE QD . . 3.920 3.561 3.472 3.628 . 0 0 "[ . 1 . 2]" 1
767 1 33 ILE HG12 1 44 PHE QE . . 4.310 4.149 4.021 4.299 . 0 0 "[ . 1 . 2]" 1
768 1 33 ILE HG12 1 62 VAL MG2 . . 3.710 2.655 2.398 2.842 . 0 0 "[ . 1 . 2]" 1
769 1 33 ILE HG12 1 80 LEU MD2 . . 4.580 3.531 3.258 3.699 . 0 0 "[ . 1 . 2]" 1
770 1 33 ILE HG13 1 33 ILE MG . . 3.470 3.152 3.137 3.169 . 0 0 "[ . 1 . 2]" 1
771 1 33 ILE HG13 1 34 GLN H . . 4.880 4.783 4.705 4.880 . 0 0 "[ . 1 . 2]" 1
772 1 33 ILE HG13 1 44 PHE QD . . 3.420 2.003 1.989 2.030 . 0 0 "[ . 1 . 2]" 1
773 1 33 ILE HG13 1 44 PHE QE . . 3.880 3.216 3.056 3.432 . 0 0 "[ . 1 . 2]" 1
774 1 33 ILE MG 1 34 GLN H . . 3.200 2.772 2.607 2.930 . 0 0 "[ . 1 . 2]" 1
775 1 33 ILE MG 1 34 GLN HA . . 4.460 4.043 3.944 4.139 . 0 0 "[ . 1 . 2]" 1
776 1 33 ILE MG 1 34 GLN HB2 . . 5.070 4.979 4.805 5.074 0.004 5 0 "[ . 1 . 2]" 1
777 1 33 ILE MG 1 34 GLN HB3 . . 4.940 4.333 4.172 4.462 . 0 0 "[ . 1 . 2]" 1
778 1 33 ILE MG 1 35 CYS H . . 4.220 3.708 3.360 4.060 . 0 0 "[ . 1 . 2]" 1
779 1 33 ILE MG 1 35 CYS HB2 . . 5.500 5.208 4.460 5.392 . 0 0 "[ . 1 . 2]" 1
780 1 33 ILE MG 1 36 SER H . . 5.250 4.728 4.493 4.958 . 0 0 "[ . 1 . 2]" 1
781 1 33 ILE MG 1 42 LEU H . . 4.500 4.198 4.046 4.300 . 0 0 "[ . 1 . 2]" 1
782 1 33 ILE MG 1 42 LEU HB2 . . 4.660 3.464 3.211 3.644 . 0 0 "[ . 1 . 2]" 1
783 1 33 ILE MG 1 42 LEU MD1 . . 4.110 3.770 3.553 3.988 . 0 0 "[ . 1 . 2]" 1
784 1 33 ILE MG 1 64 PHE HB2 . . 5.500 5.462 5.275 5.521 0.021 1 0 "[ . 1 . 2]" 1
785 1 33 ILE MG 1 64 PHE QD . . 3.900 3.164 2.821 3.393 . 0 0 "[ . 1 . 2]" 1
786 1 33 ILE MG 1 64 PHE QE . . 3.360 1.884 1.788 2.186 . 0 0 "[ . 1 . 2]" 1
787 1 33 ILE MG 1 64 PHE HZ . . 3.880 2.325 1.964 3.108 . 0 0 "[ . 1 . 2]" 1
788 1 34 GLN H 1 34 GLN HB2 . . 3.150 2.736 2.589 2.802 . 0 0 "[ . 1 . 2]" 1
789 1 34 GLN H 1 34 GLN HB3 . . 3.300 2.403 2.366 2.497 . 0 0 "[ . 1 . 2]" 1
790 1 34 GLN H 1 34 GLN HE21 . . 5.500 4.989 4.492 5.388 . 0 0 "[ . 1 . 2]" 1
791 1 34 GLN H 1 34 GLN HG2 . . 4.960 4.543 4.522 4.587 . 0 0 "[ . 1 . 2]" 1
792 1 34 GLN H 1 34 GLN HG3 . . 5.260 4.351 4.324 4.408 . 0 0 "[ . 1 . 2]" 1
793 1 34 GLN H 1 41 ARG HA . . 5.490 4.340 3.959 4.549 . 0 0 "[ . 1 . 2]" 1
794 1 34 GLN HA 1 34 GLN HG3 . . 3.620 2.824 2.718 2.884 . 0 0 "[ . 1 . 2]" 1
795 1 34 GLN HA 1 35 CYS H . . 2.750 2.196 2.151 2.260 . 0 0 "[ . 1 . 2]" 1
796 1 34 GLN HA 1 41 ARG HA . . 3.620 2.013 1.967 2.179 . 0 0 "[ . 1 . 2]" 1
797 1 34 GLN HA 1 42 LEU H . . 4.120 2.873 2.779 3.003 . 0 0 "[ . 1 . 2]" 1
798 1 34 GLN HB2 1 34 GLN HE21 . . 4.390 3.313 2.763 3.680 . 0 0 "[ . 1 . 2]" 1
799 1 34 GLN HB2 1 34 GLN HG2 . . 2.980 2.660 2.647 2.674 . 0 0 "[ . 1 . 2]" 1
800 1 34 GLN HB2 1 35 CYS H . . 4.550 4.456 4.409 4.523 . 0 0 "[ . 1 . 2]" 1
801 1 34 GLN HB3 1 34 GLN HE21 . . 4.640 4.102 3.819 4.299 . 0 0 "[ . 1 . 2]" 1
802 1 34 GLN HB3 1 34 GLN HG2 . . 2.920 2.250 2.243 2.256 . 0 0 "[ . 1 . 2]" 1
803 1 34 GLN HB3 1 35 CYS H . . 4.570 4.473 4.372 4.518 . 0 0 "[ . 1 . 2]" 1
804 1 34 GLN HE21 1 34 GLN HG3 . . 3.190 2.336 2.190 2.575 . 0 0 "[ . 1 . 2]" 1
805 1 34 GLN HE21 1 35 CYS H . . 5.040 3.134 2.887 3.424 . 0 0 "[ . 1 . 2]" 1
806 1 34 GLN HE21 1 40 ALA H . . 4.580 3.326 2.836 4.130 . 0 0 "[ . 1 . 2]" 1
807 1 34 GLN HE21 1 41 ARG QB . . 4.600 3.781 2.661 4.493 . 0 0 "[ . 1 . 2]" 1
808 1 34 GLN HE21 1 41 ARG QD . . 4.820 4.648 4.355 4.844 0.024 4 0 "[ . 1 . 2]" 1
809 1 34 GLN HE21 1 41 ARG QG . . 4.700 3.318 2.715 4.486 . 0 0 "[ . 1 . 2]" 1
810 1 34 GLN HE22 1 34 GLN HG3 . . 3.830 3.524 3.465 3.624 . 0 0 "[ . 1 . 2]" 1
811 1 34 GLN HE22 1 35 CYS H . . 5.120 4.764 4.553 4.984 . 0 0 "[ . 1 . 2]" 1
812 1 34 GLN HE22 1 40 ALA H . . 5.500 4.371 3.958 4.921 . 0 0 "[ . 1 . 2]" 1
813 1 34 GLN HE22 1 41 ARG QB . . 3.900 3.129 2.041 3.795 . 0 0 "[ . 1 . 2]" 1
814 1 34 GLN HE22 1 41 ARG HD2 . . 4.830 4.403 3.164 4.858 0.028 10 0 "[ . 1 . 2]" 1
815 1 34 GLN HE22 1 41 ARG QD . . 4.010 3.527 3.104 3.882 . 0 0 "[ . 1 . 2]" 1
816 1 34 GLN HE22 1 41 ARG HD3 . . 4.830 3.890 3.344 4.834 0.004 16 0 "[ . 1 . 2]" 1
817 1 34 GLN HE22 1 41 ARG HE . . 5.500 4.407 2.242 5.506 0.006 12 0 "[ . 1 . 2]" 1
818 1 34 GLN HE22 1 41 ARG QG . . 4.730 2.713 1.945 4.096 . 0 0 "[ . 1 . 2]" 1
819 1 34 GLN HG3 1 35 CYS H . . 3.860 3.443 3.167 3.688 . 0 0 "[ . 1 . 2]" 1
820 1 34 GLN HG3 1 35 CYS HA . . 4.830 4.603 4.492 4.739 . 0 0 "[ . 1 . 2]" 1
821 1 34 GLN HG3 1 40 ALA H . . 4.780 4.193 3.722 4.568 . 0 0 "[ . 1 . 2]" 1
822 1 34 GLN HG3 1 42 LEU H . . 5.500 5.538 5.523 5.553 0.053 12 0 "[ . 1 . 2]" 1
823 1 35 CYS H 1 35 CYS HB2 . . 3.090 2.522 2.157 2.832 . 0 0 "[ . 1 . 2]" 1
824 1 35 CYS H 1 35 CYS HB3 . . 3.680 3.552 2.991 3.613 . 0 0 "[ . 1 . 2]" 1
825 1 35 CYS H 1 36 SER H . . 4.740 4.572 4.396 4.635 . 0 0 "[ . 1 . 2]" 1
826 1 35 CYS H 1 40 ALA H . . 3.760 3.337 2.999 3.704 . 0 0 "[ . 1 . 2]" 1
827 1 35 CYS H 1 40 ALA MB . . 4.300 4.112 3.981 4.248 . 0 0 "[ . 1 . 2]" 1
828 1 35 CYS H 1 41 ARG HA . . 3.650 3.266 2.903 3.542 . 0 0 "[ . 1 . 2]" 1
829 1 35 CYS H 1 42 LEU H . . 4.490 3.024 2.839 3.211 . 0 0 "[ . 1 . 2]" 1
830 1 35 CYS HA 1 36 SER H . . 2.810 2.191 2.138 2.256 . 0 0 "[ . 1 . 2]" 1
831 1 35 CYS HA 1 37 GLU H . . 3.940 3.600 3.346 3.736 . 0 0 "[ . 1 . 2]" 1
832 1 35 CYS HA 1 38 ARG H . . 4.640 4.535 4.364 4.677 0.037 19 0 "[ . 1 . 2]" 1
833 1 35 CYS HA 1 64 PHE HZ . . 4.660 2.912 2.692 3.099 . 0 0 "[ . 1 . 2]" 1
834 1 35 CYS HB2 1 36 SER H . . 4.340 4.137 3.705 4.361 0.021 8 0 "[ . 1 . 2]" 1
835 1 35 CYS HB2 1 37 GLU H . . 4.570 3.781 3.433 4.258 . 0 0 "[ . 1 . 2]" 1
836 1 35 CYS HB2 1 38 ARG H . . 3.720 3.170 2.734 3.846 0.126 18 0 "[ . 1 . 2]" 1
837 1 35 CYS HB2 1 38 ARG HB3 . . 4.950 4.484 4.233 4.957 0.007 19 0 "[ . 1 . 2]" 1
838 1 35 CYS HB2 1 38 ARG HG2 . . 4.100 2.220 2.004 2.807 . 0 0 "[ . 1 . 2]" 1
839 1 35 CYS HB2 1 38 ARG HG3 . . 3.750 2.416 2.025 3.034 . 0 0 "[ . 1 . 2]" 1
840 1 35 CYS HB2 1 39 GLN H . . 4.520 3.218 2.489 4.447 . 0 0 "[ . 1 . 2]" 1
841 1 35 CYS HB2 1 40 ALA H . . 3.330 2.026 1.893 3.092 . 0 0 "[ . 1 . 2]" 1
842 1 35 CYS HB3 1 36 SER H . . 3.650 3.185 2.887 3.675 0.025 18 0 "[ . 1 . 2]" 1
843 1 35 CYS HB3 1 37 GLU H . . 3.700 2.606 2.441 2.853 . 0 0 "[ . 1 . 2]" 1
844 1 35 CYS HB3 1 37 GLU HB2 . . 4.940 3.766 3.456 4.382 . 0 0 "[ . 1 . 2]" 1
845 1 35 CYS HB3 1 38 ARG H . . 3.420 2.393 2.112 2.724 . 0 0 "[ . 1 . 2]" 1
846 1 35 CYS HB3 1 38 ARG HG2 . . 4.120 2.058 1.980 2.176 . 0 0 "[ . 1 . 2]" 1
847 1 35 CYS HB3 1 38 ARG HG3 . . 3.860 3.198 2.295 3.566 . 0 0 "[ . 1 . 2]" 1
848 1 35 CYS HB3 1 40 ALA H . . 3.800 3.412 2.457 3.799 . 0 0 "[ . 1 . 2]" 1
849 1 35 CYS HB3 1 40 ALA MB . . 4.620 4.338 3.799 4.640 0.020 12 0 "[ . 1 . 2]" 1
850 1 36 SER H 1 36 SER HB2 . . 3.600 2.401 2.291 2.518 . 0 0 "[ . 1 . 2]" 1
851 1 36 SER H 1 36 SER QB . . 2.980 2.360 2.265 2.419 . 0 0 "[ . 1 . 2]" 1
852 1 36 SER H 1 36 SER HB3 . . 3.600 3.554 2.906 3.653 0.053 15 0 "[ . 1 . 2]" 1
853 1 36 SER H 1 37 GLU HB2 . . 5.040 4.566 4.072 4.959 . 0 0 "[ . 1 . 2]" 1
854 1 36 SER H 1 37 GLU HG3 . . 4.640 3.652 3.281 4.680 0.040 15 0 "[ . 1 . 2]" 1
855 1 36 SER H 1 38 ARG H . . 4.520 4.129 3.818 4.480 . 0 0 "[ . 1 . 2]" 1
856 1 36 SER H 1 64 PHE QE . . 5.440 5.151 4.774 5.392 . 0 0 "[ . 1 . 2]" 1
857 1 36 SER H 1 64 PHE HZ . . 5.140 4.570 4.274 4.824 . 0 0 "[ . 1 . 2]" 1
858 1 36 SER HA 1 38 ARG H . . 4.700 4.638 4.492 4.711 0.011 6 0 "[ . 1 . 2]" 1
859 1 36 SER QB 1 37 GLU H . . 3.570 3.433 3.201 3.564 . 0 0 "[ . 1 . 2]" 1
860 1 36 SER QB 1 37 GLU HG2 . . 3.810 3.509 3.073 3.717 . 0 0 "[ . 1 . 2]" 1
861 1 36 SER QB 1 37 GLU HG3 . . 4.740 3.921 3.621 4.707 . 0 0 "[ . 1 . 2]" 1
862 1 36 SER QB 1 38 ARG H . . 5.340 5.237 5.070 5.350 0.010 1 0 "[ . 1 . 2]" 1
863 1 36 SER HB2 1 37 GLU HG2 . . 4.390 3.855 3.505 4.485 0.095 7 0 "[ . 1 . 2]" 1
864 1 36 SER HB3 1 37 GLU HG2 . . 4.390 4.201 3.131 4.401 0.011 1 0 "[ . 1 . 2]" 1
865 1 37 GLU H 1 37 GLU HB2 . . 3.150 2.673 2.444 2.941 . 0 0 "[ . 1 . 2]" 1
866 1 37 GLU H 1 37 GLU HB3 . . 4.020 3.734 3.657 3.792 . 0 0 "[ . 1 . 2]" 1
867 1 37 GLU H 1 37 GLU HG2 . . 3.460 3.166 2.777 3.434 . 0 0 "[ . 1 . 2]" 1
868 1 37 GLU H 1 37 GLU HG3 . . 3.700 2.849 2.598 3.719 0.019 19 0 "[ . 1 . 2]" 1
869 1 37 GLU H 1 38 ARG H . . 2.780 2.081 1.956 2.255 . 0 0 "[ . 1 . 2]" 1
870 1 37 GLU H 1 38 ARG HG2 . . 4.420 3.784 3.553 4.050 . 0 0 "[ . 1 . 2]" 1
871 1 37 GLU H 1 38 ARG HG3 . . 5.380 4.761 4.336 5.093 . 0 0 "[ . 1 . 2]" 1
872 1 37 GLU HA 1 37 GLU HG2 . . 3.650 2.558 2.466 2.792 . 0 0 "[ . 1 . 2]" 1
873 1 37 GLU HA 1 37 GLU HG3 . . 3.610 3.574 3.486 3.750 0.140 15 0 "[ . 1 . 2]" 1
874 1 37 GLU HB2 1 38 ARG H . . 3.270 2.610 2.498 2.733 . 0 0 "[ . 1 . 2]" 1
875 1 37 GLU HB2 1 38 ARG HB3 . . 4.310 3.763 3.556 4.078 . 0 0 "[ . 1 . 2]" 1
876 1 37 GLU HB3 1 38 ARG H . . 3.950 3.789 3.562 3.960 0.010 6 0 "[ . 1 . 2]" 1
877 1 38 ARG H 1 38 ARG HB3 . . 3.510 2.814 2.696 2.951 . 0 0 "[ . 1 . 2]" 1
878 1 38 ARG H 1 38 ARG HG2 . . 3.340 2.256 1.973 2.509 . 0 0 "[ . 1 . 2]" 1
879 1 38 ARG H 1 38 ARG HG3 . . 3.490 3.087 2.805 3.333 . 0 0 "[ . 1 . 2]" 1
880 1 38 ARG H 1 39 GLN H . . 3.680 2.154 2.025 2.301 . 0 0 "[ . 1 . 2]" 1
881 1 38 ARG H 1 40 ALA H . . 4.780 3.818 3.554 4.095 . 0 0 "[ . 1 . 2]" 1
882 1 38 ARG HA 1 38 ARG HG2 . . 4.220 3.833 3.724 3.948 . 0 0 "[ . 1 . 2]" 1
883 1 38 ARG HA 1 39 GLN H . . 3.540 3.324 3.191 3.391 . 0 0 "[ . 1 . 2]" 1
884 1 38 ARG HB2 1 38 ARG HD2 . . 3.820 3.082 2.684 3.717 . 0 0 "[ . 1 . 2]" 1
885 1 38 ARG HB2 1 38 ARG HD3 . . 3.820 3.389 2.391 3.712 . 0 0 "[ . 1 . 2]" 1
886 1 38 ARG HB2 1 38 ARG HE . . 4.600 2.565 1.912 4.240 . 0 0 "[ . 1 . 2]" 1
887 1 38 ARG HB2 1 39 GLN H . . 4.350 4.278 4.121 4.478 0.128 16 0 "[ . 1 . 2]" 1
888 1 38 ARG HB2 1 40 ALA H . . 4.620 4.428 4.169 4.623 0.003 2 0 "[ . 1 . 2]" 1
889 1 38 ARG HB2 1 40 ALA MB . . 4.000 3.308 3.148 3.488 . 0 0 "[ . 1 . 2]" 1
890 1 38 ARG HB3 1 38 ARG QD . . 3.600 2.656 2.376 3.031 . 0 0 "[ . 1 . 2]" 1
891 1 38 ARG HB3 1 38 ARG HE . . 4.800 3.397 2.184 4.236 . 0 0 "[ . 1 . 2]" 1
892 1 38 ARG HB3 1 39 GLN H . . 4.210 4.244 4.215 4.309 0.099 16 0 "[ . 1 . 2]" 1
893 1 38 ARG HB3 1 40 ALA MB . . 4.390 4.272 4.120 4.407 0.017 19 0 "[ . 1 . 2]" 1
894 1 38 ARG QD 1 38 ARG QH1 . . 3.510 1.918 1.854 1.996 . 0 0 "[ . 1 . 2]" 1
895 1 38 ARG QD 1 40 ALA MB . . 3.240 2.133 1.945 2.506 . 0 0 "[ . 1 . 2]" 1
896 1 38 ARG QD 1 42 LEU MD2 . . 4.560 3.527 3.214 3.729 . 0 0 "[ . 1 . 2]" 1
897 1 38 ARG QD 1 66 VAL QG . . 3.990 3.457 3.230 3.641 . 0 0 "[ . 1 . 2]" 1
898 1 38 ARG HD2 1 40 ALA MB . . 3.860 3.218 2.186 3.591 . 0 0 "[ . 1 . 2]" 1
899 1 38 ARG HD2 1 42 LEU MD1 . . 4.580 4.051 3.138 4.501 . 0 0 "[ . 1 . 2]" 1
900 1 38 ARG HD2 1 66 VAL MG1 . . 5.500 4.557 4.341 4.818 . 0 0 "[ . 1 . 2]" 1
901 1 38 ARG HD2 1 66 VAL MG2 . . 5.500 3.945 3.584 4.074 . 0 0 "[ . 1 . 2]" 1
902 1 38 ARG HD3 1 40 ALA MB . . 3.860 2.203 1.958 2.752 . 0 0 "[ . 1 . 2]" 1
903 1 38 ARG HD3 1 42 LEU MD1 . . 4.580 3.902 3.383 4.602 0.022 19 0 "[ . 1 . 2]" 1
904 1 38 ARG HD3 1 66 VAL MG1 . . 5.500 4.952 4.633 5.324 . 0 0 "[ . 1 . 2]" 1
905 1 38 ARG HD3 1 66 VAL MG2 . . 5.500 4.440 3.911 4.945 . 0 0 "[ . 1 . 2]" 1
906 1 38 ARG HE 1 38 ARG HG2 . . 4.170 3.452 2.432 3.981 . 0 0 "[ . 1 . 2]" 1
907 1 38 ARG HE 1 40 ALA MB . . 4.830 2.549 1.825 4.736 . 0 0 "[ . 1 . 2]" 1
908 1 38 ARG HG2 1 39 GLN H . . 4.170 3.413 3.157 3.761 . 0 0 "[ . 1 . 2]" 1
909 1 38 ARG HG2 1 40 ALA MB . . 3.800 3.303 2.952 3.670 . 0 0 "[ . 1 . 2]" 1
910 1 38 ARG HG3 1 39 GLN H . . 4.060 3.126 2.811 3.544 . 0 0 "[ . 1 . 2]" 1
911 1 38 ARG HG3 1 40 ALA H . . 3.100 2.125 1.902 2.353 . 0 0 "[ . 1 . 2]" 1
912 1 38 ARG HG3 1 40 ALA HA . . 5.010 4.058 3.737 4.333 . 0 0 "[ . 1 . 2]" 1
913 1 38 ARG QH1 1 66 VAL QG . . 4.690 3.175 2.220 4.398 . 0 0 "[ . 1 . 2]" 1
914 1 39 GLN H 1 39 GLN QB . . 3.330 3.190 2.903 3.359 0.029 9 0 "[ . 1 . 2]" 1
915 1 39 GLN H 1 39 GLN HG2 . . 4.200 3.523 2.657 4.240 0.040 2 0 "[ . 1 . 2]" 1
916 1 39 GLN H 1 39 GLN QG . . 3.600 2.970 2.629 3.522 . 0 0 "[ . 1 . 2]" 1
917 1 39 GLN H 1 39 GLN HG3 . . 4.200 3.565 2.734 4.213 0.013 9 0 "[ . 1 . 2]" 1
918 1 39 GLN H 1 40 ALA H . . 3.740 2.775 2.656 3.064 . 0 0 "[ . 1 . 2]" 1
919 1 39 GLN HA 1 39 GLN HG2 . . 4.110 2.822 2.209 4.169 0.059 16 0 "[ . 1 . 2]" 1
920 1 39 GLN HA 1 39 GLN QG . . 3.480 2.580 2.157 3.338 . 0 0 "[ . 1 . 2]" 1
921 1 39 GLN HA 1 39 GLN HG3 . . 4.110 3.260 2.518 3.795 . 0 0 "[ . 1 . 2]" 1
922 1 39 GLN HA 1 40 ALA H . . 2.870 2.741 2.627 2.876 0.006 11 0 "[ . 1 . 2]" 1
923 1 39 GLN QG 1 40 ALA H . . 5.330 4.443 3.692 4.643 . 0 0 "[ . 1 . 2]" 1
924 1 40 ALA H 1 40 ALA MB . . 3.270 2.524 2.381 2.625 . 0 0 "[ . 1 . 2]" 1
925 1 40 ALA H 1 41 ARG H . . 4.650 4.393 4.305 4.486 . 0 0 "[ . 1 . 2]" 1
926 1 40 ALA HA 1 41 ARG H . . 2.520 2.204 2.168 2.240 . 0 0 "[ . 1 . 2]" 1
927 1 40 ALA HA 1 41 ARG HA . . 4.940 4.346 4.339 4.355 . 0 0 "[ . 1 . 2]" 1
928 1 40 ALA HA 1 41 ARG QB . . 4.720 4.197 4.169 4.262 . 0 0 "[ . 1 . 2]" 1
929 1 40 ALA MB 1 41 ARG H . . 3.140 2.923 2.776 3.027 . 0 0 "[ . 1 . 2]" 1
930 1 40 ALA MB 1 41 ARG HA . . 4.740 4.340 4.261 4.414 . 0 0 "[ . 1 . 2]" 1
931 1 40 ALA MB 1 42 LEU MD2 . . 3.640 3.561 3.408 3.645 0.005 13 0 "[ . 1 . 2]" 1
932 1 41 ARG H 1 41 ARG QB . . 2.820 2.255 2.153 2.499 . 0 0 "[ . 1 . 2]" 1
933 1 41 ARG H 1 41 ARG QD . . 4.960 3.750 3.199 4.477 . 0 0 "[ . 1 . 2]" 1
934 1 41 ARG H 1 41 ARG QG . . 3.760 2.841 2.289 3.133 . 0 0 "[ . 1 . 2]" 1
935 1 41 ARG H 1 42 LEU H . . 4.480 4.286 4.215 4.392 . 0 0 "[ . 1 . 2]" 1
936 1 41 ARG H 1 42 LEU MD2 . . 5.370 5.326 5.175 5.388 0.018 12 0 "[ . 1 . 2]" 1
937 1 41 ARG HA 1 41 ARG HD2 . . 5.140 4.652 4.341 5.036 . 0 0 "[ . 1 . 2]" 1
938 1 41 ARG HA 1 41 ARG QD . . 4.490 4.090 3.929 4.252 . 0 0 "[ . 1 . 2]" 1
939 1 41 ARG HA 1 41 ARG HD3 . . 5.140 4.561 4.319 4.715 . 0 0 "[ . 1 . 2]" 1
940 1 41 ARG HA 1 41 ARG HG2 . . 4.020 3.014 2.532 3.654 . 0 0 "[ . 1 . 2]" 1
941 1 41 ARG HA 1 41 ARG QG . . 3.410 2.589 2.253 3.333 . 0 0 "[ . 1 . 2]" 1
942 1 41 ARG HA 1 41 ARG HG3 . . 4.020 2.859 2.373 3.871 . 0 0 "[ . 1 . 2]" 1
943 1 41 ARG HA 1 42 LEU H . . 2.740 2.176 2.145 2.209 . 0 0 "[ . 1 . 2]" 1
944 1 41 ARG HA 1 42 LEU HA . . 4.830 4.429 4.404 4.452 . 0 0 "[ . 1 . 2]" 1
945 1 41 ARG HA 1 42 LEU HB2 . . 4.740 4.334 4.293 4.367 . 0 0 "[ . 1 . 2]" 1
946 1 41 ARG QB 1 41 ARG QD . . 2.990 2.194 2.022 2.391 . 0 0 "[ . 1 . 2]" 1
947 1 41 ARG QB 1 41 ARG HE . . 4.700 3.117 2.004 4.194 . 0 0 "[ . 1 . 2]" 1
948 1 41 ARG QB 1 42 LEU H . . 3.830 3.642 3.499 3.735 . 0 0 "[ . 1 . 2]" 1
949 1 41 ARG HB2 1 41 ARG HE . . 5.460 3.598 2.015 4.976 . 0 0 "[ . 1 . 2]" 1
950 1 41 ARG HB3 1 41 ARG HE . . 5.460 3.823 2.202 4.900 . 0 0 "[ . 1 . 2]" 1
951 1 41 ARG QD 1 41 ARG QH1 . . 3.620 1.929 1.840 1.999 . 0 0 "[ . 1 . 2]" 1
952 1 41 ARG QG 1 41 ARG QH2 . . 4.880 4.066 3.784 4.371 . 0 0 "[ . 1 . 2]" 1
953 1 41 ARG QG 1 42 LEU H . . 4.170 4.082 3.941 4.205 0.035 18 0 "[ . 1 . 2]" 1
954 1 41 ARG HG2 1 42 LEU H . . 4.900 4.564 4.368 4.699 . 0 0 "[ . 1 . 2]" 1
955 1 41 ARG HG3 1 42 LEU H . . 4.900 4.607 4.428 4.832 . 0 0 "[ . 1 . 2]" 1
956 1 42 LEU H 1 42 LEU HB2 . . 3.100 2.190 2.170 2.220 . 0 0 "[ . 1 . 2]" 1
957 1 42 LEU H 1 42 LEU HB3 . . 4.150 3.484 3.469 3.505 . 0 0 "[ . 1 . 2]" 1
958 1 42 LEU H 1 42 LEU MD1 . . 4.580 4.094 4.002 4.191 . 0 0 "[ . 1 . 2]" 1
959 1 42 LEU H 1 42 LEU MD2 . . 3.890 3.827 3.765 3.875 . 0 0 "[ . 1 . 2]" 1
960 1 42 LEU H 1 42 LEU HG . . 3.410 3.194 3.038 3.332 . 0 0 "[ . 1 . 2]" 1
961 1 42 LEU H 1 43 PHE H . . 4.670 4.572 4.553 4.591 . 0 0 "[ . 1 . 2]" 1
962 1 42 LEU HA 1 42 LEU MD1 . . 4.280 3.756 3.734 3.783 . 0 0 "[ . 1 . 2]" 1
963 1 42 LEU HA 1 42 LEU MD2 . . 2.990 1.967 1.921 2.031 . 0 0 "[ . 1 . 2]" 1
964 1 42 LEU HA 1 42 LEU HG . . 4.120 2.969 2.929 3.014 . 0 0 "[ . 1 . 2]" 1
965 1 42 LEU HA 1 43 PHE H . . 2.620 2.449 2.376 2.502 . 0 0 "[ . 1 . 2]" 1
966 1 42 LEU HA 1 43 PHE HB2 . . 4.930 4.792 4.771 4.820 . 0 0 "[ . 1 . 2]" 1
967 1 42 LEU HA 1 43 PHE HB3 . . 4.650 4.186 4.168 4.215 . 0 0 "[ . 1 . 2]" 1
968 1 42 LEU HB2 1 42 LEU MD1 . . 3.330 2.384 2.314 2.435 . 0 0 "[ . 1 . 2]" 1
969 1 42 LEU HB2 1 42 LEU MD2 . . 3.480 3.180 3.174 3.185 . 0 0 "[ . 1 . 2]" 1
970 1 42 LEU HB2 1 43 PHE H . . 4.000 3.796 3.693 3.906 . 0 0 "[ . 1 . 2]" 1
971 1 42 LEU HB2 1 77 ALA MB . . 4.230 3.902 3.722 4.020 . 0 0 "[ . 1 . 2]" 1
972 1 42 LEU HB3 1 42 LEU MD2 . . 3.320 2.410 2.355 2.448 . 0 0 "[ . 1 . 2]" 1
973 1 42 LEU HB3 1 43 PHE H . . 3.540 2.376 2.241 2.543 . 0 0 "[ . 1 . 2]" 1
974 1 42 LEU HB3 1 44 PHE H . . 5.030 4.566 4.476 4.690 . 0 0 "[ . 1 . 2]" 1
975 1 42 LEU HB3 1 77 ALA H . . 3.910 3.749 3.516 3.906 . 0 0 "[ . 1 . 2]" 1
976 1 42 LEU HB3 1 77 ALA MB . . 3.530 2.848 2.621 3.080 . 0 0 "[ . 1 . 2]" 1
977 1 42 LEU MD1 1 43 PHE H . . 4.640 3.961 3.857 4.125 . 0 0 "[ . 1 . 2]" 1
978 1 42 LEU MD1 1 64 PHE HB2 . . 4.680 4.651 4.545 4.693 0.013 13 0 "[ . 1 . 2]" 1
979 1 42 LEU MD1 1 64 PHE QD . . 4.180 2.999 2.894 3.183 . 0 0 "[ . 1 . 2]" 1
980 1 42 LEU MD1 1 64 PHE QE . . 3.530 1.793 1.769 1.878 . 0 0 "[ . 1 . 2]" 1
981 1 42 LEU MD1 1 64 PHE HZ . . 4.400 3.068 2.582 3.348 . 0 0 "[ . 1 . 2]" 1
982 1 42 LEU MD1 1 66 VAL HB . . 4.680 4.490 4.269 4.609 . 0 0 "[ . 1 . 2]" 1
983 1 42 LEU MD1 1 66 VAL MG1 . . 3.600 3.000 2.762 3.264 . 0 0 "[ . 1 . 2]" 1
984 1 42 LEU MD1 1 66 VAL QG . . 2.870 2.004 1.862 2.155 . 0 0 "[ . 1 . 2]" 1
985 1 42 LEU MD1 1 66 VAL MG2 . . 3.600 2.037 1.889 2.210 . 0 0 "[ . 1 . 2]" 1
986 1 42 LEU MD1 1 67 SER H . . 4.940 4.600 4.405 4.800 . 0 0 "[ . 1 . 2]" 1
987 1 42 LEU MD1 1 75 PRO HB2 . . 4.080 3.875 3.613 4.071 . 0 0 "[ . 1 . 2]" 1
988 1 42 LEU MD1 1 75 PRO HB3 . . 5.440 5.238 4.923 5.418 . 0 0 "[ . 1 . 2]" 1
989 1 42 LEU MD1 1 76 ILE H . . 5.140 4.987 4.831 5.130 . 0 0 "[ . 1 . 2]" 1
990 1 42 LEU MD1 1 76 ILE HA . . 4.590 3.836 3.682 4.068 . 0 0 "[ . 1 . 2]" 1
991 1 42 LEU MD1 1 77 ALA H . . 4.890 3.845 3.678 3.980 . 0 0 "[ . 1 . 2]" 1
992 1 42 LEU MD1 1 77 ALA HA . . 4.580 3.423 3.286 3.545 . 0 0 "[ . 1 . 2]" 1
993 1 42 LEU MD2 1 43 PHE H . . 3.610 2.433 2.364 2.561 . 0 0 "[ . 1 . 2]" 1
994 1 42 LEU MD2 1 64 PHE QE . . 4.490 4.272 4.221 4.312 . 0 0 "[ . 1 . 2]" 1
995 1 42 LEU MD2 1 66 VAL HB . . 5.500 5.473 5.332 5.514 0.014 18 0 "[ . 1 . 2]" 1
996 1 42 LEU MD2 1 75 PRO HB2 . . 3.220 2.471 2.048 2.537 . 0 0 "[ . 1 . 2]" 1
997 1 42 LEU MD2 1 75 PRO HB3 . . 4.060 4.015 3.589 4.066 0.006 1 0 "[ . 1 . 2]" 1
998 1 42 LEU MD2 1 75 PRO HG2 . . 3.410 3.036 2.764 3.144 . 0 0 "[ . 1 . 2]" 1
999 1 42 LEU MD2 1 75 PRO HG3 . . 4.220 4.096 3.718 4.179 . 0 0 "[ . 1 . 2]" 1
1000 1 42 LEU MD2 1 76 ILE H . . 4.460 4.231 4.092 4.388 . 0 0 "[ . 1 . 2]" 1
1001 1 42 LEU MD2 1 76 ILE HA . . 4.280 2.689 2.496 2.890 . 0 0 "[ . 1 . 2]" 1
1002 1 42 LEU MD2 1 77 ALA HA . . 5.160 4.671 4.553 4.887 . 0 0 "[ . 1 . 2]" 1
1003 1 42 LEU HG 1 66 VAL QG . . 4.860 3.857 3.669 3.981 . 0 0 "[ . 1 . 2]" 1
1004 1 43 PHE H 1 43 PHE HB2 . . 3.570 3.474 3.422 3.512 . 0 0 "[ . 1 . 2]" 1
1005 1 43 PHE H 1 43 PHE HB3 . . 2.930 2.484 2.418 2.519 . 0 0 "[ . 1 . 2]" 1
1006 1 43 PHE H 1 43 PHE QD . . 4.220 4.123 4.086 4.144 . 0 0 "[ . 1 . 2]" 1
1007 1 43 PHE H 1 44 PHE H . . 4.280 4.080 4.020 4.174 . 0 0 "[ . 1 . 2]" 1
1008 1 43 PHE H 1 76 ILE HB . . 5.210 4.459 4.295 4.687 . 0 0 "[ . 1 . 2]" 1
1009 1 43 PHE H 1 76 ILE MG . . 4.120 3.811 3.593 3.995 . 0 0 "[ . 1 . 2]" 1
1010 1 43 PHE HA 1 43 PHE QD . . 4.120 2.505 2.470 2.543 . 0 0 "[ . 1 . 2]" 1
1011 1 43 PHE HA 1 44 PHE H . . 2.640 2.158 2.145 2.170 . 0 0 "[ . 1 . 2]" 1
1012 1 43 PHE HA 1 44 PHE HA . . 4.940 4.406 4.397 4.415 . 0 0 "[ . 1 . 2]" 1
1013 1 43 PHE HA 1 44 PHE QD . . 4.650 4.162 4.087 4.269 . 0 0 "[ . 1 . 2]" 1
1014 1 43 PHE HA 1 77 ALA MB . . 5.500 4.745 4.602 4.928 . 0 0 "[ . 1 . 2]" 1
1015 1 43 PHE HB2 1 44 PHE H . . 4.310 4.198 4.133 4.242 . 0 0 "[ . 1 . 2]" 1
1016 1 43 PHE HB2 1 76 ILE MG . . 4.780 4.631 4.339 4.784 0.004 13 0 "[ . 1 . 2]" 1
1017 1 43 PHE HB3 1 44 PHE H . . 4.810 4.564 4.539 4.579 . 0 0 "[ . 1 . 2]" 1
1018 1 43 PHE HB3 1 76 ILE HA . . 4.910 4.080 3.890 4.227 . 0 0 "[ . 1 . 2]" 1
1019 1 43 PHE HB3 1 76 ILE MG . . 3.280 3.128 2.822 3.275 . 0 0 "[ . 1 . 2]" 1
1020 1 43 PHE HB3 1 77 ALA H . . 4.900 4.763 4.567 4.890 . 0 0 "[ . 1 . 2]" 1
1021 1 43 PHE QD 1 44 PHE H . . 3.650 2.650 2.482 2.779 . 0 0 "[ . 1 . 2]" 1
1022 1 43 PHE QD 1 44 PHE HA . . 4.080 4.007 3.820 4.093 0.013 12 0 "[ . 1 . 2]" 1
1023 1 43 PHE QD 1 45 HIS H . . 4.850 4.770 4.642 4.853 0.003 4 0 "[ . 1 . 2]" 1
1024 1 43 PHE QD 1 76 ILE HA . . 4.940 4.698 4.395 4.835 . 0 0 "[ . 1 . 2]" 1
1025 1 43 PHE QD 1 76 ILE HB . . 4.220 4.202 4.080 4.227 0.007 11 0 "[ . 1 . 2]" 1
1026 1 43 PHE QD 1 76 ILE MD . . 4.710 4.659 4.579 4.716 0.006 14 0 "[ . 1 . 2]" 1
1027 1 43 PHE QD 1 76 ILE MG . . 3.330 2.580 2.406 2.782 . 0 0 "[ . 1 . 2]" 1
1028 1 43 PHE QD 1 77 ALA H . . 5.250 5.041 4.913 5.166 . 0 0 "[ . 1 . 2]" 1
1029 1 43 PHE QE 1 44 PHE H . . 4.900 4.483 4.373 4.587 . 0 0 "[ . 1 . 2]" 1
1030 1 43 PHE QE 1 44 PHE HA . . 4.950 4.640 4.478 4.716 . 0 0 "[ . 1 . 2]" 1
1031 1 43 PHE QE 1 45 HIS H . . 4.520 4.320 4.151 4.418 . 0 0 "[ . 1 . 2]" 1
1032 1 43 PHE QE 1 45 HIS HA . . 4.540 2.749 2.665 2.848 . 0 0 "[ . 1 . 2]" 1
1033 1 43 PHE QE 1 45 HIS HB2 . . 4.580 3.785 3.612 3.865 . 0 0 "[ . 1 . 2]" 1
1034 1 43 PHE QE 1 45 HIS HB3 . . 5.170 4.961 4.821 5.033 . 0 0 "[ . 1 . 2]" 1
1035 1 43 PHE QE 1 45 HIS HD2 . . 4.580 3.835 3.713 3.908 . 0 0 "[ . 1 . 2]" 1
1036 1 43 PHE QE 1 45 HIS HE1 . . 5.500 5.526 5.516 5.535 0.035 14 0 "[ . 1 . 2]" 1
1037 1 43 PHE QE 1 76 ILE MD . . 4.580 4.349 4.193 4.444 . 0 0 "[ . 1 . 2]" 1
1038 1 43 PHE QE 1 76 ILE MG . . 4.350 3.532 3.345 3.748 . 0 0 "[ . 1 . 2]" 1
1039 1 43 PHE HZ 1 45 HIS HA . . 4.830 4.146 4.031 4.222 . 0 0 "[ . 1 . 2]" 1
1040 1 43 PHE HZ 1 45 HIS HB2 . . 4.940 3.756 3.625 3.814 . 0 0 "[ . 1 . 2]" 1
1041 1 43 PHE HZ 1 45 HIS HB3 . . 5.240 5.210 5.066 5.266 0.026 18 0 "[ . 1 . 2]" 1
1042 1 43 PHE HZ 1 45 HIS HD2 . . 4.080 2.737 2.560 2.842 . 0 0 "[ . 1 . 2]" 1
1043 1 43 PHE HZ 1 45 HIS HE1 . . 5.500 5.450 5.361 5.516 0.016 10 0 "[ . 1 . 2]" 1
1044 1 44 PHE H 1 44 PHE HB3 . . 3.490 2.540 2.508 2.579 . 0 0 "[ . 1 . 2]" 1
1045 1 44 PHE H 1 44 PHE QD . . 3.140 2.469 2.395 2.581 . 0 0 "[ . 1 . 2]" 1
1046 1 44 PHE H 1 45 HIS H . . 4.610 4.516 4.496 4.529 . 0 0 "[ . 1 . 2]" 1
1047 1 44 PHE H 1 77 ALA MB . . 4.420 3.857 3.609 4.101 . 0 0 "[ . 1 . 2]" 1
1048 1 44 PHE H 1 80 LEU MD1 . . 4.840 4.632 4.492 4.730 . 0 0 "[ . 1 . 2]" 1
1049 1 44 PHE HA 1 44 PHE QD . . 4.180 3.633 3.610 3.649 . 0 0 "[ . 1 . 2]" 1
1050 1 44 PHE HA 1 45 HIS H . . 2.940 2.206 2.185 2.215 . 0 0 "[ . 1 . 2]" 1
1051 1 44 PHE HA 1 77 ALA H . . 4.660 3.093 2.952 3.222 . 0 0 "[ . 1 . 2]" 1
1052 1 44 PHE HA 1 77 ALA MB . . 3.670 2.644 2.350 2.882 . 0 0 "[ . 1 . 2]" 1
1053 1 44 PHE HA 1 80 LEU MD1 . . 4.580 3.877 3.810 4.008 . 0 0 "[ . 1 . 2]" 1
1054 1 44 PHE HB2 1 45 HIS H . . 3.500 3.134 3.108 3.218 . 0 0 "[ . 1 . 2]" 1
1055 1 44 PHE HB2 1 45 HIS HB2 . . 5.500 5.520 5.505 5.544 0.044 18 0 "[ . 1 . 2]" 1
1056 1 44 PHE HB2 1 77 ALA H . . 4.950 4.527 4.337 4.671 . 0 0 "[ . 1 . 2]" 1
1057 1 44 PHE HB2 1 77 ALA MB . . 3.260 2.322 2.090 2.498 . 0 0 "[ . 1 . 2]" 1
1058 1 44 PHE HB2 1 80 LEU MD1 . . 3.340 1.972 1.937 2.081 . 0 0 "[ . 1 . 2]" 1
1059 1 44 PHE HB3 1 77 ALA H . . 5.220 4.391 4.250 4.567 . 0 0 "[ . 1 . 2]" 1
1060 1 44 PHE HB3 1 77 ALA MB . . 3.530 2.453 2.255 2.635 . 0 0 "[ . 1 . 2]" 1
1061 1 44 PHE QD 1 45 HIS H . . 4.100 3.291 3.182 3.372 . 0 0 "[ . 1 . 2]" 1
1062 1 44 PHE QD 1 45 HIS HA . . 4.920 4.175 3.997 4.281 . 0 0 "[ . 1 . 2]" 1
1063 1 44 PHE QD 1 45 HIS HB3 . . 5.070 4.926 4.816 5.039 . 0 0 "[ . 1 . 2]" 1
1064 1 44 PHE QD 1 46 CYS H . . 5.170 4.586 4.416 4.688 . 0 0 "[ . 1 . 2]" 1
1065 1 44 PHE QD 1 46 CYS HA . . 3.880 3.749 3.653 3.816 . 0 0 "[ . 1 . 2]" 1
1066 1 44 PHE QD 1 48 GLN H . . 4.490 4.033 3.921 4.136 . 0 0 "[ . 1 . 2]" 1
1067 1 44 PHE QD 1 48 GLN HB2 . . 4.740 2.739 2.605 2.866 . 0 0 "[ . 1 . 2]" 1
1068 1 44 PHE QD 1 53 LEU MD2 . . 4.950 4.648 4.377 4.948 . 0 0 "[ . 1 . 2]" 1
1069 1 44 PHE QD 1 77 ALA MB . . 4.690 3.933 3.812 4.076 . 0 0 "[ . 1 . 2]" 1
1070 1 44 PHE QD 1 80 LEU MD1 . . 3.760 2.794 2.700 2.946 . 0 0 "[ . 1 . 2]" 1
1071 1 44 PHE QD 1 80 LEU MD2 . . 3.390 3.064 2.945 3.262 . 0 0 "[ . 1 . 2]" 1
1072 1 44 PHE QE 1 46 CYS H . . 4.520 4.448 4.290 4.527 0.007 17 0 "[ . 1 . 2]" 1
1073 1 44 PHE QE 1 46 CYS HA . . 3.590 2.588 2.504 2.726 . 0 0 "[ . 1 . 2]" 1
1074 1 44 PHE QE 1 46 CYS QB . . 4.820 4.271 3.950 4.621 . 0 0 "[ . 1 . 2]" 1
1075 1 44 PHE QE 1 53 LEU MD1 . . 4.850 2.451 2.140 2.704 . 0 0 "[ . 1 . 2]" 1
1076 1 44 PHE QE 1 53 LEU MD2 . . 4.070 3.030 2.650 3.382 . 0 0 "[ . 1 . 2]" 1
1077 1 44 PHE QE 1 56 LEU QD . . 4.130 2.927 2.815 3.061 . 0 0 "[ . 1 . 2]" 1
1078 1 44 PHE QE 1 80 LEU MD2 . . 4.260 3.208 3.079 3.404 . 0 0 "[ . 1 . 2]" 1
1079 1 44 PHE HZ 1 53 LEU MD1 . . 5.210 2.447 2.227 2.816 . 0 0 "[ . 1 . 2]" 1
1080 1 44 PHE HZ 1 56 LEU QD . . 4.260 2.514 2.275 2.718 . 0 0 "[ . 1 . 2]" 1
1081 1 45 HIS H 1 45 HIS HB2 . . 3.410 2.391 2.326 2.415 . 0 0 "[ . 1 . 2]" 1
1082 1 45 HIS H 1 45 HIS HB3 . . 3.230 2.921 2.906 2.933 . 0 0 "[ . 1 . 2]" 1
1083 1 45 HIS H 1 45 HIS HD2 . . 5.040 5.038 4.950 5.061 0.021 19 0 "[ . 1 . 2]" 1
1084 1 45 HIS H 1 46 CYS H . . 4.770 4.550 4.540 4.564 . 0 0 "[ . 1 . 2]" 1
1085 1 45 HIS H 1 47 SER H . . 5.120 4.620 4.546 4.718 . 0 0 "[ . 1 . 2]" 1
1086 1 45 HIS H 1 48 GLN H . . 4.780 3.732 3.659 3.844 . 0 0 "[ . 1 . 2]" 1
1087 1 45 HIS H 1 48 GLN HB2 . . 4.520 3.354 3.224 3.557 . 0 0 "[ . 1 . 2]" 1
1088 1 45 HIS H 1 77 ALA MB . . 4.600 4.084 3.852 4.263 . 0 0 "[ . 1 . 2]" 1
1089 1 45 HIS HA 1 45 HIS HD2 . . 4.170 4.170 4.118 4.191 0.021 5 0 "[ . 1 . 2]" 1
1090 1 45 HIS HA 1 46 CYS H . . 2.610 2.210 2.197 2.227 . 0 0 "[ . 1 . 2]" 1
1091 1 45 HIS HA 1 46 CYS QB . . 4.630 4.290 4.125 4.438 . 0 0 "[ . 1 . 2]" 1
1092 1 45 HIS HB2 1 46 CYS H . . 4.560 4.295 4.267 4.318 . 0 0 "[ . 1 . 2]" 1
1093 1 45 HIS HB2 1 47 SER H . . 4.200 4.078 4.027 4.147 . 0 0 "[ . 1 . 2]" 1
1094 1 45 HIS HB2 1 48 GLN H . . 4.100 4.113 4.094 4.133 0.033 4 0 "[ . 1 . 2]" 1
1095 1 45 HIS HB2 1 48 GLN HG2 . . 4.740 2.935 2.882 3.000 . 0 0 "[ . 1 . 2]" 1
1096 1 45 HIS HB3 1 45 HIS HD2 . . 3.950 3.583 3.570 3.615 . 0 0 "[ . 1 . 2]" 1
1097 1 45 HIS HB3 1 46 CYS H . . 4.740 3.634 3.572 3.679 . 0 0 "[ . 1 . 2]" 1
1098 1 45 HIS HB3 1 47 SER H . . 4.220 2.471 2.396 2.556 . 0 0 "[ . 1 . 2]" 1
1099 1 45 HIS HB3 1 48 GLN H . . 4.830 2.634 2.593 2.685 . 0 0 "[ . 1 . 2]" 1
1100 1 45 HIS HB3 1 48 GLN HG2 . . 4.740 2.248 2.163 2.346 . 0 0 "[ . 1 . 2]" 1
1101 1 45 HIS HD2 1 46 CYS H . . 5.440 5.376 5.325 5.420 . 0 0 "[ . 1 . 2]" 1
1102 1 45 HIS HD2 1 76 ILE MD . . 5.190 5.018 4.782 5.195 0.005 13 0 "[ . 1 . 2]" 1
1103 1 45 HIS HE1 1 47 SER H . . 4.740 4.532 4.428 4.644 . 0 0 "[ . 1 . 2]" 1
1104 1 45 HIS HE1 1 47 SER QB . . 4.730 4.539 4.358 4.735 0.005 7 0 "[ . 1 . 2]" 1
1105 1 46 CYS H 1 46 CYS HB2 . . 3.690 2.993 2.261 3.571 . 0 0 "[ . 1 . 2]" 1
1106 1 46 CYS H 1 46 CYS QB . . 2.980 2.279 2.188 2.399 . 0 0 "[ . 1 . 2]" 1
1107 1 46 CYS H 1 46 CYS HB3 . . 3.690 2.799 2.210 3.585 . 0 0 "[ . 1 . 2]" 1
1108 1 46 CYS H 1 47 SER H . . 3.570 2.753 2.734 2.781 . 0 0 "[ . 1 . 2]" 1
1109 1 46 CYS H 1 47 SER QB . . 4.620 4.512 4.472 4.589 . 0 0 "[ . 1 . 2]" 1
1110 1 46 CYS H 1 53 LEU MD1 . . 5.500 4.631 4.457 4.831 . 0 0 "[ . 1 . 2]" 1
1111 1 46 CYS H 1 53 LEU MD2 . . 5.120 4.505 4.283 4.811 . 0 0 "[ . 1 . 2]" 1
1112 1 46 CYS H 1 53 LEU HG . . 5.500 5.178 4.897 5.500 0.000 10 0 "[ . 1 . 2]" 1
1113 1 46 CYS HA 1 47 SER HA . . 4.850 4.716 4.698 4.741 . 0 0 "[ . 1 . 2]" 1
1114 1 46 CYS HA 1 48 GLN H . . 4.150 4.125 4.074 4.167 0.017 4 0 "[ . 1 . 2]" 1
1115 1 46 CYS HA 1 49 TYR H . . 3.900 3.709 3.622 3.806 . 0 0 "[ . 1 . 2]" 1
1116 1 46 CYS HA 1 49 TYR HB2 . . 4.400 3.909 3.696 4.134 . 0 0 "[ . 1 . 2]" 1
1117 1 46 CYS HA 1 49 TYR HB3 . . 4.260 3.705 3.579 3.832 . 0 0 "[ . 1 . 2]" 1
1118 1 46 CYS HA 1 53 LEU MD1 . . 3.800 2.979 2.765 3.166 . 0 0 "[ . 1 . 2]" 1
1119 1 46 CYS HA 1 53 LEU MD2 . . 3.140 2.211 1.973 2.564 . 0 0 "[ . 1 . 2]" 1
1120 1 46 CYS HA 1 53 LEU HG . . 4.150 3.395 3.123 3.704 . 0 0 "[ . 1 . 2]" 1
1121 1 46 CYS QB 1 47 SER H . . 3.810 3.390 3.010 3.708 . 0 0 "[ . 1 . 2]" 1
1122 1 46 CYS QB 1 53 LEU MD1 . . 3.530 3.198 2.665 3.509 . 0 0 "[ . 1 . 2]" 1
1123 1 46 CYS QB 1 53 LEU MD2 . . 3.400 2.278 1.945 2.999 . 0 0 "[ . 1 . 2]" 1
1124 1 46 CYS HB2 1 47 SER H . . 4.370 3.853 3.131 4.338 . 0 0 "[ . 1 . 2]" 1
1125 1 46 CYS HB2 1 53 LEU MD1 . . 4.360 3.719 2.693 4.361 0.001 6 0 "[ . 1 . 2]" 1
1126 1 46 CYS HB2 1 53 LEU MD2 . . 4.020 2.888 1.960 3.966 . 0 0 "[ . 1 . 2]" 1
1127 1 46 CYS HB2 1 53 LEU HG . . 4.660 2.971 1.998 4.200 . 0 0 "[ . 1 . 2]" 1
1128 1 46 CYS HB3 1 47 SER H . . 4.370 3.901 3.260 4.076 . 0 0 "[ . 1 . 2]" 1
1129 1 46 CYS HB3 1 53 LEU MD1 . . 4.360 3.677 3.371 4.361 0.001 3 0 "[ . 1 . 2]" 1
1130 1 46 CYS HB3 1 53 LEU MD2 . . 4.020 3.037 2.013 4.022 0.002 7 0 "[ . 1 . 2]" 1
1131 1 46 CYS HB3 1 53 LEU HG . . 4.660 3.050 2.440 3.984 . 0 0 "[ . 1 . 2]" 1
1132 1 47 SER H 1 47 SER QB . . 3.220 2.261 2.168 2.362 . 0 0 "[ . 1 . 2]" 1
1133 1 47 SER H 1 48 GLN H . . 3.410 2.412 2.363 2.477 . 0 0 "[ . 1 . 2]" 1
1134 1 47 SER H 1 49 TYR H . . 4.640 4.340 4.212 4.445 . 0 0 "[ . 1 . 2]" 1
1135 1 47 SER HA 1 49 TYR H . . 4.660 4.586 4.400 4.662 0.002 19 0 "[ . 1 . 2]" 1
1136 1 47 SER QB 1 48 GLN H . . 3.990 2.835 2.743 3.489 . 0 0 "[ . 1 . 2]" 1
1137 1 47 SER HB2 1 48 GLN H . . 4.720 3.835 3.007 4.120 . 0 0 "[ . 1 . 2]" 1
1138 1 47 SER HB3 1 48 GLN H . . 4.720 2.999 2.802 3.780 . 0 0 "[ . 1 . 2]" 1
1139 1 48 GLN H 1 48 GLN HB2 . . 3.040 2.631 2.558 2.676 . 0 0 "[ . 1 . 2]" 1
1140 1 48 GLN H 1 48 GLN HB3 . . 3.790 3.587 3.581 3.591 . 0 0 "[ . 1 . 2]" 1
1141 1 48 GLN H 1 48 GLN HG2 . . 3.310 1.998 1.902 2.106 . 0 0 "[ . 1 . 2]" 1
1142 1 48 GLN H 1 48 GLN HG3 . . 3.790 3.536 3.461 3.619 . 0 0 "[ . 1 . 2]" 1
1143 1 48 GLN H 1 49 TYR H . . 2.990 2.763 2.661 2.842 . 0 0 "[ . 1 . 2]" 1
1144 1 48 GLN H 1 78 VAL MG1 . . 5.500 5.497 5.457 5.510 0.010 12 0 "[ . 1 . 2]" 1
1145 1 48 GLN H 1 80 LEU MD1 . . 5.500 5.512 5.485 5.523 0.023 13 0 "[ . 1 . 2]" 1
1146 1 48 GLN HA 1 48 GLN HE21 . . 4.490 4.305 3.997 4.486 . 0 0 "[ . 1 . 2]" 1
1147 1 48 GLN HA 1 48 GLN HE22 . . 4.490 4.200 3.960 4.372 . 0 0 "[ . 1 . 2]" 1
1148 1 48 GLN HA 1 48 GLN HG2 . . 3.760 3.240 3.147 3.326 . 0 0 "[ . 1 . 2]" 1
1149 1 48 GLN HA 1 48 GLN HG3 . . 4.150 3.785 3.743 3.827 . 0 0 "[ . 1 . 2]" 1
1150 1 48 GLN HA 1 78 VAL HA . . 4.740 3.715 3.533 3.825 . 0 0 "[ . 1 . 2]" 1
1151 1 48 GLN HA 1 79 LYS H . . 4.260 2.766 2.526 2.935 . 0 0 "[ . 1 . 2]" 1
1152 1 48 GLN HA 1 79 LYS QG . . 5.340 4.710 4.295 5.112 . 0 0 "[ . 1 . 2]" 1
1153 1 48 GLN HA 1 80 LEU H . . 4.690 3.645 3.430 3.837 . 0 0 "[ . 1 . 2]" 1
1154 1 48 GLN HA 1 80 LEU HB2 . . 5.500 4.768 4.608 4.895 . 0 0 "[ . 1 . 2]" 1
1155 1 48 GLN HB2 1 49 TYR H . . 4.010 2.370 2.271 2.532 . 0 0 "[ . 1 . 2]" 1
1156 1 48 GLN HB2 1 78 VAL HA . . 4.220 3.445 3.308 3.577 . 0 0 "[ . 1 . 2]" 1
1157 1 48 GLN HB2 1 79 LYS H . . 4.080 4.022 3.871 4.092 0.012 12 0 "[ . 1 . 2]" 1
1158 1 48 GLN HB2 1 80 LEU H . . 4.310 3.095 2.975 3.304 . 0 0 "[ . 1 . 2]" 1
1159 1 48 GLN HB2 1 80 LEU MD1 . . 3.820 3.367 3.297 3.442 . 0 0 "[ . 1 . 2]" 1
1160 1 48 GLN HB3 1 48 GLN QE . . 4.500 4.090 4.053 4.122 . 0 0 "[ . 1 . 2]" 1
1161 1 48 GLN HB3 1 49 TYR H . . 4.200 3.586 3.512 3.721 . 0 0 "[ . 1 . 2]" 1
1162 1 48 GLN HB3 1 78 VAL HA . . 4.120 2.063 1.997 2.136 . 0 0 "[ . 1 . 2]" 1
1163 1 48 GLN HB3 1 78 VAL HB . . 4.520 3.970 3.764 4.110 . 0 0 "[ . 1 . 2]" 1
1164 1 48 GLN HB3 1 78 VAL MG1 . . 4.460 3.888 3.807 4.027 . 0 0 "[ . 1 . 2]" 1
1165 1 48 GLN HB3 1 79 LYS H . . 3.360 2.315 2.153 2.431 . 0 0 "[ . 1 . 2]" 1
1166 1 48 GLN HB3 1 79 LYS HA . . 4.580 3.658 3.510 3.813 . 0 0 "[ . 1 . 2]" 1
1167 1 48 GLN HB3 1 80 LEU MD1 . . 4.310 3.597 3.407 3.699 . 0 0 "[ . 1 . 2]" 1
1168 1 48 GLN QE 1 48 GLN HG2 . . 3.210 2.260 2.133 2.348 . 0 0 "[ . 1 . 2]" 1
1169 1 48 GLN QE 1 78 VAL HB . . 4.730 3.992 3.564 4.509 . 0 0 "[ . 1 . 2]" 1
1170 1 48 GLN QE 1 78 VAL MG1 . . 4.080 2.537 2.123 3.061 . 0 0 "[ . 1 . 2]" 1
1171 1 48 GLN QE 1 79 LYS H . . 5.200 4.445 4.277 4.662 . 0 0 "[ . 1 . 2]" 1
1172 1 48 GLN HE21 1 78 VAL MG1 . . 4.690 3.226 2.905 3.800 . 0 0 "[ . 1 . 2]" 1
1173 1 48 GLN HE22 1 48 GLN HG2 . . 3.690 3.504 3.450 3.542 . 0 0 "[ . 1 . 2]" 1
1174 1 48 GLN HE22 1 48 GLN HG3 . . 4.060 3.749 3.691 3.856 . 0 0 "[ . 1 . 2]" 1
1175 1 48 GLN HE22 1 78 VAL MG1 . . 4.690 2.657 2.179 3.229 . 0 0 "[ . 1 . 2]" 1
1176 1 48 GLN HG2 1 78 VAL HA . . 4.400 3.643 3.549 3.746 . 0 0 "[ . 1 . 2]" 1
1177 1 48 GLN HG2 1 78 VAL MG1 . . 4.220 4.047 3.893 4.171 . 0 0 "[ . 1 . 2]" 1
1178 1 48 GLN HG2 1 79 LYS H . . 4.770 4.688 4.509 4.767 . 0 0 "[ . 1 . 2]" 1
1179 1 48 GLN HG3 1 78 VAL HA . . 4.080 2.299 2.213 2.439 . 0 0 "[ . 1 . 2]" 1
1180 1 48 GLN HG3 1 78 VAL HB . . 4.740 4.493 4.352 4.695 . 0 0 "[ . 1 . 2]" 1
1181 1 48 GLN HG3 1 78 VAL MG1 . . 3.670 3.068 2.884 3.240 . 0 0 "[ . 1 . 2]" 1
1182 1 48 GLN HG3 1 79 LYS H . . 4.100 4.075 3.978 4.108 0.008 17 0 "[ . 1 . 2]" 1
1183 1 48 GLN HG3 1 80 LEU MD1 . . 4.740 4.090 3.931 4.206 . 0 0 "[ . 1 . 2]" 1
1184 1 49 TYR H 1 49 TYR HB2 . . 3.060 2.406 2.357 2.439 . 0 0 "[ . 1 . 2]" 1
1185 1 49 TYR H 1 49 TYR HB3 . . 2.930 2.664 2.624 2.725 . 0 0 "[ . 1 . 2]" 1
1186 1 49 TYR H 1 49 TYR QD . . 4.350 4.137 4.105 4.154 . 0 0 "[ . 1 . 2]" 1
1187 1 49 TYR H 1 53 LEU MD2 . . 4.370 3.845 3.673 4.097 . 0 0 "[ . 1 . 2]" 1
1188 1 49 TYR H 1 80 LEU HB2 . . 4.560 3.277 3.176 3.402 . 0 0 "[ . 1 . 2]" 1
1189 1 49 TYR H 1 80 LEU MD1 . . 4.780 4.425 4.306 4.595 . 0 0 "[ . 1 . 2]" 1
1190 1 49 TYR H 1 80 LEU MD2 . . 4.840 4.111 3.866 4.307 . 0 0 "[ . 1 . 2]" 1
1191 1 49 TYR HA 1 49 TYR QD . . 3.280 2.068 1.996 2.167 . 0 0 "[ . 1 . 2]" 1
1192 1 49 TYR HA 1 50 ASN H . . 2.760 2.154 2.139 2.220 . 0 0 "[ . 1 . 2]" 1
1193 1 49 TYR HA 1 50 ASN QB . . 4.560 4.145 4.014 4.516 . 0 0 "[ . 1 . 2]" 1
1194 1 49 TYR HA 1 80 LEU HB2 . . 3.950 2.810 2.700 2.908 . 0 0 "[ . 1 . 2]" 1
1195 1 49 TYR HA 1 80 LEU HB3 . . 3.820 2.007 1.991 2.054 . 0 0 "[ . 1 . 2]" 1
1196 1 49 TYR HA 1 80 LEU MD2 . . 4.350 3.457 3.348 3.562 . 0 0 "[ . 1 . 2]" 1
1197 1 49 TYR HB2 1 50 ASN H . . 4.870 4.277 4.119 4.394 . 0 0 "[ . 1 . 2]" 1
1198 1 49 TYR HB2 1 53 LEU MD1 . . 4.660 3.621 3.246 4.051 . 0 0 "[ . 1 . 2]" 1
1199 1 49 TYR HB2 1 53 LEU MD2 . . 4.260 2.941 2.631 3.414 . 0 0 "[ . 1 . 2]" 1
1200 1 49 TYR HB2 1 56 LEU MD1 . . 5.330 4.955 4.628 5.288 . 0 0 "[ . 1 . 2]" 1
1201 1 49 TYR HB2 1 56 LEU QD . . 4.290 3.213 2.911 3.466 . 0 0 "[ . 1 . 2]" 1
1202 1 49 TYR HB2 1 56 LEU MD2 . . 5.330 3.255 2.942 3.545 . 0 0 "[ . 1 . 2]" 1
1203 1 49 TYR HB2 1 80 LEU H . . 4.910 4.804 4.671 4.903 . 0 0 "[ . 1 . 2]" 1
1204 1 49 TYR HB2 1 80 LEU HB2 . . 4.260 3.505 3.291 3.673 . 0 0 "[ . 1 . 2]" 1
1205 1 49 TYR HB2 1 80 LEU HB3 . . 4.580 2.859 2.678 3.043 . 0 0 "[ . 1 . 2]" 1
1206 1 49 TYR HB2 1 80 LEU MD2 . . 3.680 2.763 2.388 3.086 . 0 0 "[ . 1 . 2]" 1
1207 1 49 TYR HB3 1 50 ASN H . . 4.530 4.138 3.899 4.263 . 0 0 "[ . 1 . 2]" 1
1208 1 49 TYR HB3 1 51 GLY H . . 4.970 4.421 3.391 4.733 . 0 0 "[ . 1 . 2]" 1
1209 1 49 TYR HB3 1 53 LEU MD1 . . 4.260 3.725 3.244 4.211 . 0 0 "[ . 1 . 2]" 1
1210 1 49 TYR HB3 1 53 LEU MD2 . . 4.020 2.220 2.034 2.416 . 0 0 "[ . 1 . 2]" 1
1211 1 49 TYR HB3 1 56 LEU QD . . 4.790 4.008 3.667 4.292 . 0 0 "[ . 1 . 2]" 1
1212 1 49 TYR HB3 1 80 LEU HB2 . . 5.140 4.874 4.678 5.011 . 0 0 "[ . 1 . 2]" 1
1213 1 49 TYR HB3 1 80 LEU MD2 . . 4.670 4.269 3.979 4.529 . 0 0 "[ . 1 . 2]" 1
1214 1 49 TYR QD 1 50 ASN H . . 3.400 2.738 2.411 3.095 . 0 0 "[ . 1 . 2]" 1
1215 1 49 TYR QD 1 51 GLY QA . . 5.010 3.890 3.695 4.005 . 0 0 "[ . 1 . 2]" 1
1216 1 49 TYR QD 1 52 ASN H . . 5.020 3.972 3.695 4.356 . 0 0 "[ . 1 . 2]" 1
1217 1 49 TYR QD 1 53 LEU H . . 4.460 2.676 2.478 2.994 . 0 0 "[ . 1 . 2]" 1
1218 1 49 TYR QD 1 53 LEU HA . . 3.620 2.789 2.549 2.935 . 0 0 "[ . 1 . 2]" 1
1219 1 49 TYR QD 1 53 LEU HB2 . . 4.660 4.275 4.206 4.426 . 0 0 "[ . 1 . 2]" 1
1220 1 49 TYR QD 1 53 LEU HB3 . . 4.950 4.898 4.784 4.952 0.002 11 0 "[ . 1 . 2]" 1
1221 1 49 TYR QD 1 53 LEU MD1 . . 4.190 3.383 2.933 3.821 . 0 0 "[ . 1 . 2]" 1
1222 1 49 TYR QD 1 53 LEU MD2 . . 3.650 1.907 1.778 1.957 . 0 0 "[ . 1 . 2]" 1
1223 1 49 TYR QD 1 53 LEU HG . . 4.660 4.621 4.458 4.676 0.016 13 0 "[ . 1 . 2]" 1
1224 1 49 TYR QD 1 56 LEU MD1 . . 4.450 3.991 3.774 4.339 . 0 0 "[ . 1 . 2]" 1
1225 1 49 TYR QD 1 56 LEU QD . . 3.680 3.102 2.845 3.291 . 0 0 "[ . 1 . 2]" 1
1226 1 49 TYR QD 1 56 LEU MD2 . . 4.450 3.239 2.929 3.442 . 0 0 "[ . 1 . 2]" 1
1227 1 49 TYR QD 1 62 VAL MG1 . . 4.580 4.219 3.947 4.487 . 0 0 "[ . 1 . 2]" 1
1228 1 49 TYR QD 1 80 LEU H . . 4.890 4.507 4.366 4.658 . 0 0 "[ . 1 . 2]" 1
1229 1 49 TYR QD 1 80 LEU HB2 . . 3.740 3.691 3.638 3.741 0.001 5 0 "[ . 1 . 2]" 1
1230 1 49 TYR QD 1 80 LEU HB3 . . 3.330 2.021 1.995 2.126 . 0 0 "[ . 1 . 2]" 1
1231 1 49 TYR QD 1 80 LEU MD2 . . 3.620 2.705 2.414 2.996 . 0 0 "[ . 1 . 2]" 1
1232 1 49 TYR QD 1 80 LEU HG . . 4.350 4.133 3.945 4.318 . 0 0 "[ . 1 . 2]" 1
1233 1 49 TYR QD 1 81 VAL H . . 4.600 3.761 3.603 3.864 . 0 0 "[ . 1 . 2]" 1
1234 1 49 TYR QD 1 81 VAL HA . . 4.260 2.988 2.829 3.085 . 0 0 "[ . 1 . 2]" 1
1235 1 49 TYR QD 1 81 VAL MG1 . . 5.240 4.287 3.830 5.177 . 0 0 "[ . 1 . 2]" 1
1236 1 49 TYR QD 1 81 VAL MG2 . . 5.240 4.986 4.728 5.217 . 0 0 "[ . 1 . 2]" 1
1237 1 49 TYR QD 1 82 LYS H . . 4.310 3.863 3.763 3.984 . 0 0 "[ . 1 . 2]" 1
1238 1 49 TYR QE 1 50 ASN H . . 4.390 4.081 3.663 4.384 . 0 0 "[ . 1 . 2]" 1
1239 1 49 TYR QE 1 51 GLY H . . 4.220 3.285 3.014 3.610 . 0 0 "[ . 1 . 2]" 1
1240 1 49 TYR QE 1 51 GLY HA2 . . 4.350 4.306 4.210 4.363 0.013 13 0 "[ . 1 . 2]" 1
1241 1 49 TYR QE 1 51 GLY HA3 . . 4.350 2.998 2.889 3.082 . 0 0 "[ . 1 . 2]" 1
1242 1 49 TYR QE 1 52 ASN H . . 4.460 2.261 1.907 2.796 . 0 0 "[ . 1 . 2]" 1
1243 1 49 TYR QE 1 53 LEU H . . 4.780 3.456 3.323 3.695 . 0 0 "[ . 1 . 2]" 1
1244 1 49 TYR QE 1 53 LEU HA . . 3.710 3.141 2.941 3.249 . 0 0 "[ . 1 . 2]" 1
1245 1 49 TYR QE 1 53 LEU MD1 . . 5.500 4.503 4.230 4.823 . 0 0 "[ . 1 . 2]" 1
1246 1 49 TYR QE 1 53 LEU MD2 . . 4.500 3.671 3.412 3.834 . 0 0 "[ . 1 . 2]" 1
1247 1 49 TYR QE 1 54 GLN H . . 5.210 4.781 4.599 5.008 . 0 0 "[ . 1 . 2]" 1
1248 1 49 TYR QE 1 55 ASP QB . . 4.090 3.378 3.155 3.601 . 0 0 "[ . 1 . 2]" 1
1249 1 49 TYR QE 1 56 LEU H . . 4.600 3.346 2.952 3.542 . 0 0 "[ . 1 . 2]" 1
1250 1 49 TYR QE 1 56 LEU HB2 . . 4.750 3.005 2.478 3.270 . 0 0 "[ . 1 . 2]" 1
1251 1 49 TYR QE 1 56 LEU QB . . 3.970 2.961 2.454 3.214 . 0 0 "[ . 1 . 2]" 1
1252 1 49 TYR QE 1 56 LEU HB3 . . 4.750 4.477 3.969 4.736 . 0 0 "[ . 1 . 2]" 1
1253 1 49 TYR QE 1 56 LEU MD1 . . 3.970 3.245 2.958 3.594 . 0 0 "[ . 1 . 2]" 1
1254 1 49 TYR QE 1 56 LEU QD . . 3.470 3.010 2.831 3.248 . 0 0 "[ . 1 . 2]" 1
1255 1 49 TYR QE 1 56 LEU MD2 . . 3.970 3.586 3.434 3.755 . 0 0 "[ . 1 . 2]" 1
1256 1 49 TYR QE 1 62 VAL MG1 . . 4.150 3.540 3.228 3.967 . 0 0 "[ . 1 . 2]" 1
1257 1 49 TYR QE 1 80 LEU HB3 . . 4.740 4.184 4.123 4.234 . 0 0 "[ . 1 . 2]" 1
1258 1 49 TYR QE 1 81 VAL H . . 4.560 4.358 4.169 4.507 . 0 0 "[ . 1 . 2]" 1
1259 1 49 TYR QE 1 81 VAL HA . . 3.780 2.557 2.285 2.769 . 0 0 "[ . 1 . 2]" 1
1260 1 49 TYR QE 1 81 VAL MG1 . . 5.360 4.388 3.733 5.109 . 0 0 "[ . 1 . 2]" 1
1261 1 49 TYR QE 1 81 VAL QG . . 4.390 3.932 3.638 4.201 . 0 0 "[ . 1 . 2]" 1
1262 1 49 TYR QE 1 81 VAL MG2 . . 5.360 4.767 3.759 5.202 . 0 0 "[ . 1 . 2]" 1
1263 1 49 TYR QE 1 82 LYS H . . 3.240 1.929 1.894 2.048 . 0 0 "[ . 1 . 2]" 1
1264 1 49 TYR QE 1 82 LYS HB2 . . 3.640 2.646 2.328 2.851 . 0 0 "[ . 1 . 2]" 1
1265 1 49 TYR QE 1 82 LYS HG3 . . 4.940 4.714 4.364 4.948 0.008 20 0 "[ . 1 . 2]" 1
1266 1 50 ASN H 1 50 ASN QB . . 2.870 2.279 2.155 2.557 . 0 0 "[ . 1 . 2]" 1
1267 1 50 ASN H 1 50 ASN QD . . 4.220 3.750 1.937 4.221 0.001 11 0 "[ . 1 . 2]" 1
1268 1 50 ASN H 1 51 GLY H . . 3.660 2.453 2.348 2.606 . 0 0 "[ . 1 . 2]" 1
1269 1 50 ASN H 1 80 LEU HB2 . . 4.770 4.691 4.559 4.776 0.006 14 0 "[ . 1 . 2]" 1
1270 1 50 ASN H 1 80 LEU HB3 . . 3.940 3.684 3.610 3.813 . 0 0 "[ . 1 . 2]" 1
1271 1 50 ASN H 1 80 LEU MD2 . . 5.120 4.910 4.734 5.119 . 0 0 "[ . 1 . 2]" 1
1272 1 50 ASN H 1 81 VAL H . . 5.310 5.098 4.870 5.227 . 0 0 "[ . 1 . 2]" 1
1273 1 50 ASN H 1 81 VAL HA . . 4.390 3.581 3.297 3.817 . 0 0 "[ . 1 . 2]" 1
1274 1 50 ASN H 1 81 VAL QG . . 4.490 3.469 2.821 4.451 . 0 0 "[ . 1 . 2]" 1
1275 1 50 ASN QB 1 50 ASN QD . . 3.020 2.131 2.065 2.391 . 0 0 "[ . 1 . 2]" 1
1276 1 50 ASN QB 1 51 GLY H . . 4.020 2.913 2.528 3.589 . 0 0 "[ . 1 . 2]" 1
1277 1 50 ASN QB 1 81 VAL QG . . 3.540 2.772 2.165 3.550 0.010 12 0 "[ . 1 . 2]" 1
1278 1 50 ASN QD 1 81 VAL QG . . 4.030 3.257 1.957 3.816 . 0 0 "[ . 1 . 2]" 1
1279 1 51 GLY H 1 52 ASN H . . 4.520 4.164 3.969 4.304 . 0 0 "[ . 1 . 2]" 1
1280 1 51 GLY H 1 81 VAL HA . . 5.120 4.027 3.815 4.622 . 0 0 "[ . 1 . 2]" 1
1281 1 51 GLY H 1 81 VAL QG . . 5.440 4.169 3.741 4.664 . 0 0 "[ . 1 . 2]" 1
1282 1 51 GLY QA 1 52 ASN QB . . 4.450 3.865 3.702 4.171 . 0 0 "[ . 1 . 2]" 1
1283 1 52 ASN H 1 52 ASN HB2 . . 3.740 3.010 2.487 3.717 . 0 0 "[ . 1 . 2]" 1
1284 1 52 ASN H 1 52 ASN HB3 . . 3.740 3.057 2.661 3.652 . 0 0 "[ . 1 . 2]" 1
1285 1 52 ASN H 1 53 LEU H . . 4.900 4.170 4.035 4.409 . 0 0 "[ . 1 . 2]" 1
1286 1 52 ASN H 1 53 LEU MD2 . . 5.440 4.933 4.782 5.075 . 0 0 "[ . 1 . 2]" 1
1287 1 52 ASN HA 1 53 LEU H . . 2.900 2.148 2.140 2.169 . 0 0 "[ . 1 . 2]" 1
1288 1 52 ASN HA 1 53 LEU HA . . 4.580 4.408 4.367 4.446 . 0 0 "[ . 1 . 2]" 1
1289 1 52 ASN HA 1 53 LEU HB2 . . 4.740 4.227 4.203 4.259 . 0 0 "[ . 1 . 2]" 1
1290 1 52 ASN HA 1 53 LEU HB3 . . 5.500 5.563 5.547 5.581 0.081 11 0 "[ . 1 . 2]" 1
1291 1 52 ASN HA 1 54 GLN H . . 3.980 3.831 3.740 3.950 . 0 0 "[ . 1 . 2]" 1
1292 1 52 ASN QB 1 52 ASN QD . . 2.940 2.181 2.063 2.543 . 0 0 "[ . 1 . 2]" 1
1293 1 52 ASN QB 1 53 LEU H . . 3.980 3.722 3.404 3.919 . 0 0 "[ . 1 . 2]" 1
1294 1 52 ASN QB 1 54 GLN H . . 3.830 3.283 2.659 3.783 . 0 0 "[ . 1 . 2]" 1
1295 1 52 ASN QB 1 55 ASP H . . 4.370 2.875 2.645 3.229 . 0 0 "[ . 1 . 2]" 1
1296 1 52 ASN HB2 1 53 LEU H . . 4.580 4.289 3.656 4.559 . 0 0 "[ . 1 . 2]" 1
1297 1 52 ASN HB3 1 53 LEU H . . 4.580 4.150 3.534 4.351 . 0 0 "[ . 1 . 2]" 1
1298 1 52 ASN QD 1 54 GLN H . . 4.500 3.716 1.825 4.399 . 0 0 "[ . 1 . 2]" 1
1299 1 52 ASN QD 1 54 GLN QB . . 3.840 2.783 1.872 3.845 0.005 16 0 "[ . 1 . 2]" 1
1300 1 53 LEU H 1 53 LEU HB2 . . 2.860 2.286 2.208 2.314 . 0 0 "[ . 1 . 2]" 1
1301 1 53 LEU H 1 53 LEU HB3 . . 3.590 3.555 3.510 3.570 . 0 0 "[ . 1 . 2]" 1
1302 1 53 LEU H 1 53 LEU MD1 . . 4.460 3.858 3.696 4.043 . 0 0 "[ . 1 . 2]" 1
1303 1 53 LEU H 1 53 LEU MD2 . . 4.140 1.871 1.865 1.878 . 0 0 "[ . 1 . 2]" 1
1304 1 53 LEU H 1 53 LEU HG . . 4.140 3.895 3.725 4.018 . 0 0 "[ . 1 . 2]" 1
1305 1 53 LEU H 1 54 GLN H . . 3.160 2.992 2.849 3.073 . 0 0 "[ . 1 . 2]" 1
1306 1 53 LEU H 1 55 ASP H . . 4.840 4.620 4.439 4.729 . 0 0 "[ . 1 . 2]" 1
1307 1 53 LEU HA 1 53 LEU MD1 . . 3.580 2.238 1.951 2.547 . 0 0 "[ . 1 . 2]" 1
1308 1 53 LEU HA 1 53 LEU MD2 . . 3.320 2.406 2.126 2.597 . 0 0 "[ . 1 . 2]" 1
1309 1 53 LEU HA 1 55 ASP H . . 4.350 4.291 4.069 4.364 0.014 12 0 "[ . 1 . 2]" 1
1310 1 53 LEU HA 1 56 LEU H . . 3.710 3.121 3.008 3.188 . 0 0 "[ . 1 . 2]" 1
1311 1 53 LEU HA 1 56 LEU HB2 . . 4.180 2.640 2.434 2.773 . 0 0 "[ . 1 . 2]" 1
1312 1 53 LEU HA 1 56 LEU HB3 . . 4.180 2.808 2.660 2.984 . 0 0 "[ . 1 . 2]" 1
1313 1 53 LEU HA 1 56 LEU MD1 . . 4.740 4.543 4.348 4.661 . 0 0 "[ . 1 . 2]" 1
1314 1 53 LEU HA 1 56 LEU QD . . 4.020 3.047 2.939 3.187 . 0 0 "[ . 1 . 2]" 1
1315 1 53 LEU HA 1 56 LEU MD2 . . 4.740 3.097 2.988 3.246 . 0 0 "[ . 1 . 2]" 1
1316 1 53 LEU HA 1 56 LEU HG . . 5.330 4.978 4.857 5.126 . 0 0 "[ . 1 . 2]" 1
1317 1 53 LEU HB2 1 53 LEU MD2 . . 3.250 2.366 2.244 2.510 . 0 0 "[ . 1 . 2]" 1
1318 1 53 LEU HB2 1 54 GLN H . . 3.750 2.841 2.713 2.988 . 0 0 "[ . 1 . 2]" 1
1319 1 53 LEU HB2 1 55 ASP H . . 5.500 5.366 5.160 5.485 . 0 0 "[ . 1 . 2]" 1
1320 1 53 LEU HB3 1 53 LEU MD1 . . 3.020 2.231 2.046 2.379 . 0 0 "[ . 1 . 2]" 1
1321 1 53 LEU HB3 1 54 GLN H . . 3.610 3.254 3.112 3.405 . 0 0 "[ . 1 . 2]" 1
1322 1 53 LEU HB3 1 54 GLN HA . . 4.310 4.017 3.961 4.069 . 0 0 "[ . 1 . 2]" 1
1323 1 53 LEU HB3 1 54 GLN QG . . 5.010 4.504 4.194 4.927 . 0 0 "[ . 1 . 2]" 1
1324 1 53 LEU HB3 1 56 LEU H . . 4.910 4.869 4.799 4.925 0.015 12 0 "[ . 1 . 2]" 1
1325 1 53 LEU MD1 1 56 LEU QD . . 4.060 2.272 1.964 2.611 . 0 0 "[ . 1 . 2]" 1
1326 1 53 LEU MD2 1 54 GLN H . . 4.220 4.179 4.142 4.213 . 0 0 "[ . 1 . 2]" 1
1327 1 53 LEU MD2 1 56 LEU H . . 5.140 4.963 4.647 5.146 0.006 14 0 "[ . 1 . 2]" 1
1328 1 53 LEU MD2 1 56 LEU QB . . 4.610 3.745 3.265 4.008 . 0 0 "[ . 1 . 2]" 1
1329 1 53 LEU MD2 1 56 LEU QD . . 3.440 3.174 2.632 3.445 0.005 15 0 "[ . 1 . 2]" 1
1330 1 53 LEU HG 1 54 GLN H . . 5.500 5.117 4.971 5.260 . 0 0 "[ . 1 . 2]" 1
1331 1 54 GLN H 1 54 GLN QB . . 2.720 2.421 2.278 2.628 . 0 0 "[ . 1 . 2]" 1
1332 1 54 GLN H 1 54 GLN QG . . 3.300 2.369 1.932 3.164 . 0 0 "[ . 1 . 2]" 1
1333 1 54 GLN H 1 55 ASP H . . 3.100 2.947 2.811 3.013 . 0 0 "[ . 1 . 2]" 1
1334 1 54 GLN H 1 55 ASP QB . . 5.080 4.751 4.593 4.957 . 0 0 "[ . 1 . 2]" 1
1335 1 54 GLN H 1 56 LEU H . . 4.150 4.140 4.008 4.165 0.015 13 0 "[ . 1 . 2]" 1
1336 1 54 GLN HA 1 54 GLN HG2 . . 3.790 2.831 2.352 3.712 . 0 0 "[ . 1 . 2]" 1
1337 1 54 GLN HA 1 54 GLN HG3 . . 3.790 3.301 2.232 3.800 0.010 5 0 "[ . 1 . 2]" 1
1338 1 54 GLN HA 1 56 LEU H . . 4.580 4.420 4.252 4.536 . 0 0 "[ . 1 . 2]" 1
1339 1 54 GLN HB2 1 55 ASP H . . 4.220 2.586 2.421 3.460 . 0 0 "[ . 1 . 2]" 1
1340 1 54 GLN HB3 1 55 ASP H . . 4.220 3.394 3.163 4.020 . 0 0 "[ . 1 . 2]" 1
1341 1 54 GLN QG 1 55 ASP H . . 4.590 4.039 1.888 4.407 . 0 0 "[ . 1 . 2]" 1
1342 1 54 GLN HG2 1 55 ASP H . . 5.440 4.622 3.110 5.123 . 0 0 "[ . 1 . 2]" 1
1343 1 54 GLN HG3 1 55 ASP H . . 5.440 4.551 1.904 5.002 . 0 0 "[ . 1 . 2]" 1
1344 1 55 ASP H 1 55 ASP HB2 . . 3.610 2.421 2.180 2.926 . 0 0 "[ . 1 . 2]" 1
1345 1 55 ASP H 1 55 ASP QB . . 3.120 2.249 2.155 2.450 . 0 0 "[ . 1 . 2]" 1
1346 1 55 ASP H 1 55 ASP HB3 . . 3.610 3.043 2.218 3.592 . 0 0 "[ . 1 . 2]" 1
1347 1 55 ASP H 1 56 LEU H . . 2.820 2.579 2.453 2.648 . 0 0 "[ . 1 . 2]" 1
1348 1 55 ASP QB 1 56 LEU H . . 3.570 2.711 2.615 2.856 . 0 0 "[ . 1 . 2]" 1
1349 1 55 ASP HB2 1 56 LEU H . . 4.250 3.377 2.709 4.151 . 0 0 "[ . 1 . 2]" 1
1350 1 55 ASP HB3 1 56 LEU H . . 4.250 3.147 2.659 3.742 . 0 0 "[ . 1 . 2]" 1
1351 1 56 LEU H 1 56 LEU HB2 . . 3.190 2.219 2.171 2.253 . 0 0 "[ . 1 . 2]" 1
1352 1 56 LEU H 1 56 LEU QB . . 2.720 2.146 2.113 2.168 . 0 0 "[ . 1 . 2]" 1
1353 1 56 LEU H 1 56 LEU HB3 . . 3.190 2.849 2.809 2.899 . 0 0 "[ . 1 . 2]" 1
1354 1 56 LEU H 1 56 LEU MD1 . . 4.310 3.616 3.490 3.723 . 0 0 "[ . 1 . 2]" 1
1355 1 56 LEU H 1 56 LEU MD2 . . 4.310 4.166 4.139 4.210 . 0 0 "[ . 1 . 2]" 1
1356 1 56 LEU H 1 56 LEU HG . . 4.590 4.585 4.562 4.605 0.015 14 0 "[ . 1 . 2]" 1
1357 1 56 LEU H 1 57 LYS H . . 4.870 4.627 4.616 4.639 . 0 0 "[ . 1 . 2]" 1
1358 1 56 LEU H 1 82 LYS HD2 . . 5.440 4.824 4.366 5.158 . 0 0 "[ . 1 . 2]" 1
1359 1 56 LEU H 1 82 LYS HD3 . . 5.500 5.475 5.253 5.508 0.008 2 0 "[ . 1 . 2]" 1
1360 1 56 LEU HA 1 56 LEU MD1 . . 3.970 1.998 1.920 2.087 . 0 0 "[ . 1 . 2]" 1
1361 1 56 LEU HA 1 56 LEU QD . . 3.020 1.991 1.915 2.078 . 0 0 "[ . 1 . 2]" 1
1362 1 56 LEU HA 1 56 LEU MD2 . . 3.970 3.802 3.772 3.821 . 0 0 "[ . 1 . 2]" 1
1363 1 56 LEU HA 1 56 LEU HG . . 4.080 2.892 2.787 2.990 . 0 0 "[ . 1 . 2]" 1
1364 1 56 LEU HA 1 57 LYS H . . 2.630 2.318 2.229 2.419 . 0 0 "[ . 1 . 2]" 1
1365 1 56 LEU HA 1 57 LYS QB . . 4.910 4.401 4.279 4.592 . 0 0 "[ . 1 . 2]" 1
1366 1 56 LEU HA 1 57 LYS HG2 . . 4.940 3.539 3.348 4.932 . 0 0 "[ . 1 . 2]" 1
1367 1 56 LEU HA 1 57 LYS HG3 . . 4.940 4.387 3.601 4.900 . 0 0 "[ . 1 . 2]" 1
1368 1 56 LEU HA 1 82 LYS HD2 . . 4.140 3.049 2.898 3.138 . 0 0 "[ . 1 . 2]" 1
1369 1 56 LEU HA 1 82 LYS HE2 . . 4.830 4.516 3.464 4.831 0.001 5 0 "[ . 1 . 2]" 1
1370 1 56 LEU HA 1 82 LYS QE . . 4.220 3.548 3.011 4.214 . 0 0 "[ . 1 . 2]" 1
1371 1 56 LEU HA 1 82 LYS HE3 . . 4.830 3.868 3.069 4.835 0.005 2 0 "[ . 1 . 2]" 1
1372 1 56 LEU QB 1 56 LEU QD . . 2.670 1.919 1.909 1.937 . 0 0 "[ . 1 . 2]" 1
1373 1 56 LEU QB 1 57 LYS H . . 3.650 3.263 3.059 3.435 . 0 0 "[ . 1 . 2]" 1
1374 1 56 LEU HB2 1 56 LEU MD1 . . 3.600 2.348 2.287 2.399 . 0 0 "[ . 1 . 2]" 1
1375 1 56 LEU HB2 1 56 LEU MD2 . . 3.600 2.337 2.275 2.427 . 0 0 "[ . 1 . 2]" 1
1376 1 56 LEU HB3 1 56 LEU MD1 . . 3.600 3.184 3.177 3.195 . 0 0 "[ . 1 . 2]" 1
1377 1 56 LEU HB3 1 56 LEU MD2 . . 3.600 2.295 2.193 2.381 . 0 0 "[ . 1 . 2]" 1
1378 1 56 LEU QD 1 57 LYS H . . 3.160 2.657 2.387 2.894 . 0 0 "[ . 1 . 2]" 1
1379 1 56 LEU QD 1 60 ASP H . . 5.440 4.806 4.468 5.017 . 0 0 "[ . 1 . 2]" 1
1380 1 56 LEU QD 1 60 ASP HB2 . . 3.930 3.378 3.009 3.636 . 0 0 "[ . 1 . 2]" 1
1381 1 56 LEU QD 1 60 ASP HB3 . . 4.240 3.624 3.162 3.948 . 0 0 "[ . 1 . 2]" 1
1382 1 56 LEU QD 1 62 VAL MG1 . . 2.810 1.813 1.681 2.097 . 0 0 "[ . 1 . 2]" 1
1383 1 56 LEU QD 1 80 LEU MD2 . . 3.530 2.225 2.037 2.400 . 0 0 "[ . 1 . 2]" 1
1384 1 56 LEU QD 1 82 LYS H . . 4.710 4.085 3.766 4.353 . 0 0 "[ . 1 . 2]" 1
1385 1 56 LEU QD 1 82 LYS HA . . 4.700 3.627 3.474 3.766 . 0 0 "[ . 1 . 2]" 1
1386 1 56 LEU QD 1 82 LYS HB2 . . 3.780 3.143 2.936 3.378 . 0 0 "[ . 1 . 2]" 1
1387 1 56 LEU QD 1 82 LYS HD2 . . 3.430 1.978 1.870 2.226 . 0 0 "[ . 1 . 2]" 1
1388 1 56 LEU QD 1 82 LYS QE . . 3.490 3.138 2.633 3.498 0.008 14 0 "[ . 1 . 2]" 1
1389 1 56 LEU QD 1 82 LYS HG3 . . 4.200 3.023 2.758 3.133 . 0 0 "[ . 1 . 2]" 1
1390 1 56 LEU MD1 1 57 LYS H . . 4.180 2.705 2.406 3.000 . 0 0 "[ . 1 . 2]" 1
1391 1 56 LEU MD1 1 62 VAL MG1 . . 3.840 1.830 1.690 2.132 . 0 0 "[ . 1 . 2]" 1
1392 1 56 LEU MD1 1 80 LEU MD2 . . 4.080 3.062 2.776 3.300 . 0 0 "[ . 1 . 2]" 1
1393 1 56 LEU MD1 1 82 LYS H . . 5.500 4.253 3.873 4.601 . 0 0 "[ . 1 . 2]" 1
1394 1 56 LEU MD1 1 82 LYS HB2 . . 4.950 3.182 2.961 3.439 . 0 0 "[ . 1 . 2]" 1
1395 1 56 LEU MD1 1 82 LYS HD2 . . 4.600 1.981 1.872 2.231 . 0 0 "[ . 1 . 2]" 1
1396 1 56 LEU MD1 1 82 LYS HG3 . . 5.330 3.043 2.770 3.155 . 0 0 "[ . 1 . 2]" 1
1397 1 56 LEU MD2 1 57 LYS H . . 4.180 3.960 3.646 4.191 0.011 14 0 "[ . 1 . 2]" 1
1398 1 56 LEU MD2 1 62 VAL MG1 . . 3.840 2.950 2.709 3.220 . 0 0 "[ . 1 . 2]" 1
1399 1 56 LEU MD2 1 80 LEU MD2 . . 4.080 2.287 2.074 2.503 . 0 0 "[ . 1 . 2]" 1
1400 1 56 LEU MD2 1 82 LYS H . . 5.500 5.303 5.134 5.424 . 0 0 "[ . 1 . 2]" 1
1401 1 56 LEU MD2 1 82 LYS HB2 . . 4.950 4.907 4.789 4.954 0.004 13 0 "[ . 1 . 2]" 1
1402 1 56 LEU MD2 1 82 LYS HD2 . . 4.600 4.446 4.179 4.605 0.005 12 0 "[ . 1 . 2]" 1
1403 1 56 LEU MD2 1 82 LYS HG3 . . 5.330 5.203 4.938 5.338 0.008 8 0 "[ . 1 . 2]" 1
1404 1 56 LEU HG 1 57 LYS H . . 4.040 2.299 1.955 2.607 . 0 0 "[ . 1 . 2]" 1
1405 1 57 LYS H 1 57 LYS HG2 . . 3.740 2.869 2.461 3.755 0.015 6 0 "[ . 1 . 2]" 1
1406 1 57 LYS H 1 57 LYS QG . . 3.230 2.529 2.185 2.750 . 0 0 "[ . 1 . 2]" 1
1407 1 57 LYS H 1 57 LYS HG3 . . 3.740 2.900 2.199 3.150 . 0 0 "[ . 1 . 2]" 1
1408 1 57 LYS H 1 58 VAL H . . 4.460 4.371 4.339 4.415 . 0 0 "[ . 1 . 2]" 1
1409 1 57 LYS H 1 60 ASP H . . 5.420 4.698 4.105 4.926 . 0 0 "[ . 1 . 2]" 1
1410 1 57 LYS H 1 60 ASP HB2 . . 3.670 3.126 2.801 3.408 . 0 0 "[ . 1 . 2]" 1
1411 1 57 LYS H 1 60 ASP HB3 . . 5.080 4.385 4.030 4.664 . 0 0 "[ . 1 . 2]" 1
1412 1 57 LYS HA 1 57 LYS HG2 . . 4.170 3.705 2.799 4.204 0.034 6 0 "[ . 1 . 2]" 1
1413 1 57 LYS HA 1 57 LYS HG3 . . 4.170 3.729 3.609 3.818 . 0 0 "[ . 1 . 2]" 1
1414 1 57 LYS HA 1 58 VAL H . . 2.700 2.419 2.288 2.552 . 0 0 "[ . 1 . 2]" 1
1415 1 57 LYS HA 1 58 VAL HB . . 5.280 4.789 4.689 4.904 . 0 0 "[ . 1 . 2]" 1
1416 1 57 LYS HA 1 58 VAL QG . . 3.860 3.643 3.444 3.844 . 0 0 "[ . 1 . 2]" 1
1417 1 57 LYS QB 1 57 LYS QE . . 4.400 2.946 1.976 3.668 . 0 0 "[ . 1 . 2]" 1
1418 1 57 LYS QB 1 58 VAL H . . 2.950 2.378 2.092 2.676 . 0 0 "[ . 1 . 2]" 1
1419 1 57 LYS QB 1 58 VAL QG . . 4.370 4.065 3.884 4.199 . 0 0 "[ . 1 . 2]" 1
1420 1 57 LYS QB 1 60 ASP H . . 5.340 5.250 3.791 5.352 0.012 13 0 "[ . 1 . 2]" 1
1421 1 57 LYS QE 1 57 LYS QG . . 3.310 2.219 2.052 2.682 . 0 0 "[ . 1 . 2]" 1
1422 1 57 LYS QG 1 58 VAL H . . 4.430 3.864 3.591 4.308 . 0 0 "[ . 1 . 2]" 1
1423 1 57 LYS QG 1 60 ASP H . . 5.010 4.089 3.640 5.029 0.019 14 0 "[ . 1 . 2]" 1
1424 1 57 LYS HG2 1 58 VAL H . . 5.250 4.857 4.669 4.987 . 0 0 "[ . 1 . 2]" 1
1425 1 57 LYS HG3 1 58 VAL H . . 5.250 4.077 3.732 5.037 . 0 0 "[ . 1 . 2]" 1
1426 1 58 VAL H 1 58 VAL HB . . 3.160 2.417 2.341 2.502 . 0 0 "[ . 1 . 2]" 1
1427 1 58 VAL H 1 58 VAL MG1 . . 3.940 3.743 3.710 3.774 . 0 0 "[ . 1 . 2]" 1
1428 1 58 VAL H 1 58 VAL QG . . 2.730 2.383 2.183 2.564 . 0 0 "[ . 1 . 2]" 1
1429 1 58 VAL H 1 58 VAL MG2 . . 3.940 2.413 2.197 2.613 . 0 0 "[ . 1 . 2]" 1
1430 1 58 VAL H 1 59 GLY H . . 4.690 4.459 4.242 4.562 . 0 0 "[ . 1 . 2]" 1
1431 1 58 VAL HA 1 58 VAL MG1 . . 3.210 2.459 2.441 2.493 . 0 0 "[ . 1 . 2]" 1
1432 1 58 VAL HA 1 58 VAL MG2 . . 3.210 2.315 2.149 2.435 . 0 0 "[ . 1 . 2]" 1
1433 1 58 VAL HA 1 59 GLY H . . 2.770 2.153 2.144 2.196 . 0 0 "[ . 1 . 2]" 1
1434 1 58 VAL HA 1 59 GLY HA2 . . 4.560 4.388 4.333 4.421 . 0 0 "[ . 1 . 2]" 1
1435 1 58 VAL HA 1 59 GLY HA3 . . 4.490 4.399 4.391 4.412 . 0 0 "[ . 1 . 2]" 1
1436 1 58 VAL HA 1 60 ASP H . . 4.000 3.553 3.433 3.668 . 0 0 "[ . 1 . 2]" 1
1437 1 58 VAL HB 1 59 GLY H . . 4.500 4.330 4.188 4.508 0.008 14 0 "[ . 1 . 2]" 1
1438 1 58 VAL QG 1 59 GLY H . . 3.000 2.609 2.311 3.006 0.006 14 0 "[ . 1 . 2]" 1
1439 1 58 VAL QG 1 59 GLY HA2 . . 4.540 3.371 3.257 3.505 . 0 0 "[ . 1 . 2]" 1
1440 1 58 VAL QG 1 60 ASP H . . 4.620 4.215 4.062 4.388 . 0 0 "[ . 1 . 2]" 1
1441 1 59 GLY H 1 60 ASP H . . 3.300 2.040 1.866 2.167 . 0 0 "[ . 1 . 2]" 1
1442 1 59 GLY H 1 60 ASP HB2 . . 4.900 4.216 4.025 4.352 . 0 0 "[ . 1 . 2]" 1
1443 1 60 ASP H 1 60 ASP HB2 . . 3.540 2.469 2.307 2.573 . 0 0 "[ . 1 . 2]" 1
1444 1 60 ASP H 1 60 ASP HB3 . . 3.780 3.638 3.561 3.739 . 0 0 "[ . 1 . 2]" 1
1445 1 60 ASP H 1 61 ASP H . . 5.120 4.446 4.340 4.572 . 0 0 "[ . 1 . 2]" 1
1446 1 60 ASP HA 1 61 ASP H . . 3.230 2.226 2.153 2.346 . 0 0 "[ . 1 . 2]" 1
1447 1 60 ASP HA 1 61 ASP HA . . 4.830 4.330 4.322 4.350 . 0 0 "[ . 1 . 2]" 1
1448 1 60 ASP HA 1 61 ASP HB2 . . 4.460 4.422 4.353 4.464 0.004 19 0 "[ . 1 . 2]" 1
1449 1 60 ASP HA 1 62 VAL MG2 . . 5.500 5.490 5.397 5.540 0.040 8 0 "[ . 1 . 2]" 1
1450 1 60 ASP HB2 1 61 ASP H . . 4.400 4.168 3.910 4.288 . 0 0 "[ . 1 . 2]" 1
1451 1 60 ASP HB2 1 62 VAL MG1 . . 4.530 3.968 3.704 4.127 . 0 0 "[ . 1 . 2]" 1
1452 1 60 ASP HB2 1 82 LYS HG3 . . 5.330 5.065 4.634 5.340 0.010 9 0 "[ . 1 . 2]" 1
1453 1 60 ASP HB3 1 61 ASP H . . 3.970 2.998 2.597 3.284 . 0 0 "[ . 1 . 2]" 1
1454 1 60 ASP HB3 1 62 VAL MG1 . . 3.970 3.651 3.484 3.882 . 0 0 "[ . 1 . 2]" 1
1455 1 60 ASP HB3 1 82 LYS HD2 . . 5.500 4.463 3.859 4.987 . 0 0 "[ . 1 . 2]" 1
1456 1 60 ASP HB3 1 82 LYS QE . . 4.180 2.844 2.133 3.879 . 0 0 "[ . 1 . 2]" 1
1457 1 60 ASP HB3 1 82 LYS HG2 . . 5.500 4.747 4.457 5.053 . 0 0 "[ . 1 . 2]" 1
1458 1 60 ASP HB3 1 82 LYS HG3 . . 4.400 3.939 3.624 4.157 . 0 0 "[ . 1 . 2]" 1
1459 1 61 ASP H 1 61 ASP HB2 . . 3.630 2.241 2.185 2.309 . 0 0 "[ . 1 . 2]" 1
1460 1 61 ASP H 1 62 VAL H . . 4.810 4.603 4.571 4.623 . 0 0 "[ . 1 . 2]" 1
1461 1 61 ASP HA 1 62 VAL H . . 2.620 2.213 2.181 2.243 . 0 0 "[ . 1 . 2]" 1
1462 1 61 ASP HA 1 62 VAL MG2 . . 4.150 3.209 3.076 3.410 . 0 0 "[ . 1 . 2]" 1
1463 1 61 ASP HA 1 83 ILE MD . . 4.310 3.970 3.691 4.189 . 0 0 "[ . 1 . 2]" 1
1464 1 61 ASP HB2 1 62 VAL MG1 . . 5.500 4.964 4.899 5.033 . 0 0 "[ . 1 . 2]" 1
1465 1 61 ASP HB2 1 83 ILE HB . . 4.150 3.676 3.371 3.914 . 0 0 "[ . 1 . 2]" 1
1466 1 61 ASP HB2 1 84 SER H . . 5.010 4.385 4.096 4.689 . 0 0 "[ . 1 . 2]" 1
1467 1 61 ASP HB2 1 84 SER QB . . 4.630 4.462 4.082 4.647 0.017 14 0 "[ . 1 . 2]" 1
1468 1 61 ASP HB3 1 62 VAL H . . 3.570 3.038 2.911 3.199 . 0 0 "[ . 1 . 2]" 1
1469 1 61 ASP HB3 1 62 VAL MG1 . . 5.500 4.773 4.700 4.818 . 0 0 "[ . 1 . 2]" 1
1470 1 61 ASP HB3 1 62 VAL MG2 . . 5.140 4.680 4.572 4.851 . 0 0 "[ . 1 . 2]" 1
1471 1 61 ASP HB3 1 83 ILE H . . 4.530 4.369 4.172 4.530 0.000 2 0 "[ . 1 . 2]" 1
1472 1 61 ASP HB3 1 83 ILE HB . . 4.290 3.336 3.098 3.516 . 0 0 "[ . 1 . 2]" 1
1473 1 61 ASP HB3 1 83 ILE MD . . 3.400 2.295 2.010 2.549 . 0 0 "[ . 1 . 2]" 1
1474 1 61 ASP HB3 1 83 ILE HG12 . . 4.310 4.259 4.078 4.320 0.010 14 0 "[ . 1 . 2]" 1
1475 1 61 ASP HB3 1 83 ILE HG13 . . 4.230 2.792 2.599 2.956 . 0 0 "[ . 1 . 2]" 1
1476 1 61 ASP HB3 1 83 ILE MG . . 4.080 3.986 3.692 4.087 0.007 5 0 "[ . 1 . 2]" 1
1477 1 61 ASP HB3 1 84 SER H . . 5.490 4.764 4.295 5.036 . 0 0 "[ . 1 . 2]" 1
1478 1 62 VAL H 1 62 VAL MG1 . . 3.830 3.519 3.449 3.560 . 0 0 "[ . 1 . 2]" 1
1479 1 62 VAL H 1 62 VAL MG2 . . 3.050 2.189 2.033 2.343 . 0 0 "[ . 1 . 2]" 1
1480 1 62 VAL H 1 63 GLU H . . 4.640 4.304 4.265 4.410 . 0 0 "[ . 1 . 2]" 1
1481 1 62 VAL H 1 63 GLU HB2 . . 5.500 5.533 5.512 5.551 0.051 1 0 "[ . 1 . 2]" 1
1482 1 62 VAL H 1 83 ILE HB . . 5.500 5.253 5.105 5.365 . 0 0 "[ . 1 . 2]" 1
1483 1 62 VAL H 1 83 ILE MD . . 4.310 3.030 2.830 3.236 . 0 0 "[ . 1 . 2]" 1
1484 1 62 VAL H 1 83 ILE HG12 . . 4.730 4.464 4.272 4.658 . 0 0 "[ . 1 . 2]" 1
1485 1 62 VAL H 1 83 ILE HG13 . . 4.170 3.263 3.106 3.350 . 0 0 "[ . 1 . 2]" 1
1486 1 62 VAL HA 1 62 VAL MG1 . . 3.010 2.062 2.040 2.112 . 0 0 "[ . 1 . 2]" 1
1487 1 62 VAL HA 1 63 GLU H . . 2.810 2.242 2.214 2.416 . 0 0 "[ . 1 . 2]" 1
1488 1 62 VAL HA 1 63 GLU HB2 . . 4.720 4.263 4.178 4.321 . 0 0 "[ . 1 . 2]" 1
1489 1 62 VAL HA 1 81 VAL H . . 4.770 4.727 4.620 4.778 0.008 12 0 "[ . 1 . 2]" 1
1490 1 62 VAL HA 1 82 LYS HA . . 3.360 2.450 2.176 2.634 . 0 0 "[ . 1 . 2]" 1
1491 1 62 VAL HA 1 83 ILE H . . 3.240 2.170 1.936 2.358 . 0 0 "[ . 1 . 2]" 1
1492 1 62 VAL HA 1 83 ILE HB . . 4.580 4.181 3.984 4.330 . 0 0 "[ . 1 . 2]" 1
1493 1 62 VAL HA 1 83 ILE MD . . 4.480 3.448 3.260 3.672 . 0 0 "[ . 1 . 2]" 1
1494 1 62 VAL HA 1 83 ILE HG12 . . 3.970 2.936 2.691 3.335 . 0 0 "[ . 1 . 2]" 1
1495 1 62 VAL HA 1 83 ILE HG13 . . 3.760 2.126 1.992 2.325 . 0 0 "[ . 1 . 2]" 1
1496 1 62 VAL HA 1 83 ILE MG . . 5.010 4.753 4.634 4.894 . 0 0 "[ . 1 . 2]" 1
1497 1 62 VAL HA 1 84 SER H . . 5.040 4.718 4.607 4.845 . 0 0 "[ . 1 . 2]" 1
1498 1 62 VAL HB 1 63 GLU H . . 2.950 2.884 2.374 2.968 0.018 2 0 "[ . 1 . 2]" 1
1499 1 62 VAL HB 1 64 PHE QD . . 4.220 3.484 3.257 4.009 . 0 0 "[ . 1 . 2]" 1
1500 1 62 VAL HB 1 80 LEU HA . . 4.740 4.778 4.758 4.796 0.056 20 0 "[ . 1 . 2]" 1
1501 1 62 VAL HB 1 80 LEU HB3 . . 4.740 4.737 4.677 4.760 0.020 12 0 "[ . 1 . 2]" 1
1502 1 62 VAL HB 1 80 LEU MD1 . . 4.370 3.955 3.860 4.083 . 0 0 "[ . 1 . 2]" 1
1503 1 62 VAL HB 1 80 LEU MD2 . . 4.080 2.471 2.271 2.658 . 0 0 "[ . 1 . 2]" 1
1504 1 62 VAL HB 1 80 LEU HG . . 4.220 2.902 2.862 3.000 . 0 0 "[ . 1 . 2]" 1
1505 1 62 VAL HB 1 81 VAL H . . 3.710 3.409 3.262 3.546 . 0 0 "[ . 1 . 2]" 1
1506 1 62 VAL HB 1 82 LYS HA . . 4.580 3.520 3.277 3.649 . 0 0 "[ . 1 . 2]" 1
1507 1 62 VAL MG1 1 63 GLU H . . 3.640 3.501 3.353 3.568 . 0 0 "[ . 1 . 2]" 1
1508 1 62 VAL MG1 1 63 GLU HA . . 5.500 5.424 5.358 5.456 . 0 0 "[ . 1 . 2]" 1
1509 1 62 VAL MG1 1 80 LEU HA . . 5.500 5.501 5.434 5.536 0.036 8 0 "[ . 1 . 2]" 1
1510 1 62 VAL MG1 1 80 LEU HB3 . . 4.740 4.619 4.539 4.676 . 0 0 "[ . 1 . 2]" 1
1511 1 62 VAL MG1 1 80 LEU MD2 . . 3.300 2.594 2.437 2.696 . 0 0 "[ . 1 . 2]" 1
1512 1 62 VAL MG1 1 80 LEU HG . . 4.830 3.975 3.923 4.037 . 0 0 "[ . 1 . 2]" 1
1513 1 62 VAL MG1 1 81 VAL H . . 4.390 4.038 3.910 4.158 . 0 0 "[ . 1 . 2]" 1
1514 1 62 VAL MG1 1 82 LYS H . . 4.330 3.599 3.323 3.765 . 0 0 "[ . 1 . 2]" 1
1515 1 62 VAL MG1 1 82 LYS HA . . 3.130 1.917 1.859 1.937 . 0 0 "[ . 1 . 2]" 1
1516 1 62 VAL MG1 1 82 LYS HB2 . . 3.900 3.232 2.982 3.399 . 0 0 "[ . 1 . 2]" 1
1517 1 62 VAL MG1 1 82 LYS QE . . 4.630 3.750 3.445 4.251 . 0 0 "[ . 1 . 2]" 1
1518 1 62 VAL MG1 1 82 LYS HG3 . . 4.120 2.097 1.951 2.268 . 0 0 "[ . 1 . 2]" 1
1519 1 62 VAL MG1 1 83 ILE H . . 3.780 2.905 2.791 3.064 . 0 0 "[ . 1 . 2]" 1
1520 1 62 VAL MG1 1 83 ILE HG13 . . 4.000 3.627 3.484 3.867 . 0 0 "[ . 1 . 2]" 1
1521 1 62 VAL MG2 1 63 GLU H . . 4.160 4.034 3.727 4.091 . 0 0 "[ . 1 . 2]" 1
1522 1 62 VAL MG2 1 64 PHE HB3 . . 4.660 4.528 4.392 4.647 . 0 0 "[ . 1 . 2]" 1
1523 1 62 VAL MG2 1 64 PHE QD . . 3.210 2.938 2.749 3.182 . 0 0 "[ . 1 . 2]" 1
1524 1 62 VAL MG2 1 64 PHE QE . . 3.780 3.116 2.678 3.768 . 0 0 "[ . 1 . 2]" 1
1525 1 62 VAL MG2 1 80 LEU HG . . 4.350 3.574 3.474 3.759 . 0 0 "[ . 1 . 2]" 1
1526 1 62 VAL MG2 1 81 VAL H . . 4.930 4.762 4.602 4.899 . 0 0 "[ . 1 . 2]" 1
1527 1 63 GLU H 1 63 GLU HB2 . . 3.290 2.669 2.575 2.891 . 0 0 "[ . 1 . 2]" 1
1528 1 63 GLU H 1 63 GLU HB3 . . 3.630 2.699 2.633 2.774 . 0 0 "[ . 1 . 2]" 1
1529 1 63 GLU H 1 63 GLU QG . . 4.480 4.049 4.024 4.110 . 0 0 "[ . 1 . 2]" 1
1530 1 63 GLU H 1 64 PHE H . . 4.670 4.491 4.403 4.527 . 0 0 "[ . 1 . 2]" 1
1531 1 63 GLU H 1 64 PHE QD . . 4.890 4.357 4.078 4.637 . 0 0 "[ . 1 . 2]" 1
1532 1 63 GLU H 1 80 LEU MD1 . . 5.500 5.443 5.098 5.521 0.021 10 0 "[ . 1 . 2]" 1
1533 1 63 GLU H 1 81 VAL QG . . 3.470 2.957 2.766 3.180 . 0 0 "[ . 1 . 2]" 1
1534 1 63 GLU H 1 82 LYS H . . 5.450 4.711 4.445 4.860 . 0 0 "[ . 1 . 2]" 1
1535 1 63 GLU H 1 82 LYS HA . . 4.200 3.359 3.113 3.549 . 0 0 "[ . 1 . 2]" 1
1536 1 63 GLU H 1 83 ILE H . . 4.200 3.298 3.148 3.563 . 0 0 "[ . 1 . 2]" 1
1537 1 63 GLU H 1 83 ILE HA . . 5.040 4.297 4.181 4.673 . 0 0 "[ . 1 . 2]" 1
1538 1 63 GLU H 1 83 ILE MD . . 4.220 3.735 3.489 4.097 . 0 0 "[ . 1 . 2]" 1
1539 1 63 GLU H 1 83 ILE HG12 . . 4.150 2.681 2.385 3.102 . 0 0 "[ . 1 . 2]" 1
1540 1 63 GLU H 1 83 ILE HG13 . . 4.660 3.246 2.954 3.780 . 0 0 "[ . 1 . 2]" 1
1541 1 63 GLU H 1 83 ILE MG . . 5.140 4.779 4.509 5.136 . 0 0 "[ . 1 . 2]" 1
1542 1 63 GLU HA 1 63 GLU HG2 . . 4.020 2.628 2.545 2.871 . 0 0 "[ . 1 . 2]" 1
1543 1 63 GLU HA 1 63 GLU QG . . 3.350 2.384 2.354 2.413 . 0 0 "[ . 1 . 2]" 1
1544 1 63 GLU HA 1 63 GLU HG3 . . 4.020 2.747 2.535 2.833 . 0 0 "[ . 1 . 2]" 1
1545 1 63 GLU HA 1 64 PHE H . . 2.770 2.177 2.154 2.199 . 0 0 "[ . 1 . 2]" 1
1546 1 63 GLU HA 1 64 PHE HA . . 4.520 4.424 4.407 4.437 . 0 0 "[ . 1 . 2]" 1
1547 1 63 GLU HA 1 64 PHE QD . . 4.260 3.380 2.997 3.654 . 0 0 "[ . 1 . 2]" 1
1548 1 63 GLU HA 1 64 PHE QE . . 4.830 4.357 3.993 4.812 . 0 0 "[ . 1 . 2]" 1
1549 1 63 GLU HA 1 81 VAL QG . . 4.490 4.055 3.938 4.190 . 0 0 "[ . 1 . 2]" 1
1550 1 63 GLU HA 1 83 ILE MD . . 4.580 3.564 3.380 3.724 . 0 0 "[ . 1 . 2]" 1
1551 1 63 GLU HB2 1 64 PHE H . . 4.630 4.265 4.214 4.337 . 0 0 "[ . 1 . 2]" 1
1552 1 63 GLU HB2 1 83 ILE MD . . 3.360 2.802 2.579 3.060 . 0 0 "[ . 1 . 2]" 1
1553 1 63 GLU HB2 1 83 ILE HG12 . . 3.500 2.305 2.093 2.450 . 0 0 "[ . 1 . 2]" 1
1554 1 63 GLU HB3 1 64 PHE H . . 4.130 3.943 3.833 4.048 . 0 0 "[ . 1 . 2]" 1
1555 1 63 GLU HB3 1 81 VAL H . . 4.100 3.913 3.737 4.122 0.022 7 0 "[ . 1 . 2]" 1
1556 1 63 GLU HB3 1 81 VAL QG . . 3.280 1.938 1.851 2.054 . 0 0 "[ . 1 . 2]" 1
1557 1 63 GLU QG 1 64 PHE H . . 3.060 2.438 2.330 2.599 . 0 0 "[ . 1 . 2]" 1
1558 1 63 GLU QG 1 64 PHE HA . . 4.630 3.898 3.786 4.035 . 0 0 "[ . 1 . 2]" 1
1559 1 63 GLU QG 1 81 VAL QG . . 3.920 3.465 3.315 3.546 . 0 0 "[ . 1 . 2]" 1
1560 1 63 GLU QG 1 83 ILE MD . . 4.040 3.540 3.268 3.785 . 0 0 "[ . 1 . 2]" 1
1561 1 63 GLU QG 1 83 ILE MG . . 4.850 4.580 4.272 4.823 . 0 0 "[ . 1 . 2]" 1
1562 1 64 PHE H 1 64 PHE HB2 . . 4.150 3.838 3.799 3.889 . 0 0 "[ . 1 . 2]" 1
1563 1 64 PHE H 1 64 PHE HB3 . . 4.100 3.457 3.343 3.536 . 0 0 "[ . 1 . 2]" 1
1564 1 64 PHE H 1 64 PHE QD . . 3.530 2.966 2.759 3.082 . 0 0 "[ . 1 . 2]" 1
1565 1 64 PHE H 1 64 PHE QE . . 4.520 4.182 4.081 4.327 . 0 0 "[ . 1 . 2]" 1
1566 1 64 PHE H 1 65 GLU H . . 4.600 4.399 4.391 4.410 . 0 0 "[ . 1 . 2]" 1
1567 1 64 PHE H 1 77 ALA MB . . 5.500 5.257 5.096 5.372 . 0 0 "[ . 1 . 2]" 1
1568 1 64 PHE H 1 83 ILE MD . . 5.500 5.358 5.182 5.510 0.010 12 0 "[ . 1 . 2]" 1
1569 1 64 PHE HA 1 64 PHE QD . . 4.020 3.692 3.637 3.727 . 0 0 "[ . 1 . 2]" 1
1570 1 64 PHE HA 1 65 GLU H . . 3.070 2.551 2.527 2.555 . 0 0 "[ . 1 . 2]" 1
1571 1 64 PHE HA 1 80 LEU HG . . 4.660 3.823 3.739 3.872 . 0 0 "[ . 1 . 2]" 1
1572 1 64 PHE HA 1 81 VAL H . . 4.460 3.738 3.593 3.907 . 0 0 "[ . 1 . 2]" 1
1573 1 64 PHE HA 1 81 VAL QG . . 4.790 3.458 3.237 3.662 . 0 0 "[ . 1 . 2]" 1
1574 1 64 PHE HB2 1 65 GLU H . . 3.030 2.117 2.109 2.165 . 0 0 "[ . 1 . 2]" 1
1575 1 64 PHE HB2 1 66 VAL H . . 5.500 5.252 5.018 5.483 . 0 0 "[ . 1 . 2]" 1
1576 1 64 PHE HB2 1 66 VAL QG . . 5.440 4.739 4.530 4.921 . 0 0 "[ . 1 . 2]" 1
1577 1 64 PHE HB2 1 77 ALA MB . . 3.540 2.385 2.245 2.541 . 0 0 "[ . 1 . 2]" 1
1578 1 64 PHE HB2 1 78 VAL H . . 3.830 2.751 2.642 2.900 . 0 0 "[ . 1 . 2]" 1
1579 1 64 PHE HB2 1 80 LEU HA . . 4.120 3.543 3.425 3.599 . 0 0 "[ . 1 . 2]" 1
1580 1 64 PHE HB2 1 80 LEU HB2 . . 4.830 4.640 4.520 4.696 . 0 0 "[ . 1 . 2]" 1
1581 1 64 PHE HB2 1 80 LEU MD1 . . 3.730 2.590 2.482 2.661 . 0 0 "[ . 1 . 2]" 1
1582 1 64 PHE HB2 1 80 LEU HG . . 4.080 4.045 3.963 4.088 0.008 14 0 "[ . 1 . 2]" 1
1583 1 64 PHE HB2 1 81 VAL H . . 5.500 5.304 5.234 5.404 . 0 0 "[ . 1 . 2]" 1
1584 1 64 PHE HB3 1 65 GLU H . . 3.740 3.490 3.414 3.598 . 0 0 "[ . 1 . 2]" 1
1585 1 64 PHE HB3 1 77 ALA MB . . 3.740 3.154 3.036 3.239 . 0 0 "[ . 1 . 2]" 1
1586 1 64 PHE HB3 1 78 VAL H . . 4.800 4.270 4.124 4.412 . 0 0 "[ . 1 . 2]" 1
1587 1 64 PHE HB3 1 80 LEU HA . . 3.920 2.523 2.355 2.778 . 0 0 "[ . 1 . 2]" 1
1588 1 64 PHE HB3 1 80 LEU HB2 . . 4.830 3.827 3.691 3.977 . 0 0 "[ . 1 . 2]" 1
1589 1 64 PHE HB3 1 80 LEU HB3 . . 4.830 4.491 4.383 4.631 . 0 0 "[ . 1 . 2]" 1
1590 1 64 PHE HB3 1 80 LEU MD1 . . 3.650 1.855 1.845 1.865 . 0 0 "[ . 1 . 2]" 1
1591 1 64 PHE HB3 1 80 LEU MD2 . . 4.260 3.784 3.747 3.808 . 0 0 "[ . 1 . 2]" 1
1592 1 64 PHE HB3 1 80 LEU HG . . 3.640 2.372 2.314 2.422 . 0 0 "[ . 1 . 2]" 1
1593 1 64 PHE HB3 1 81 VAL H . . 4.310 3.833 3.729 4.040 . 0 0 "[ . 1 . 2]" 1
1594 1 64 PHE QD 1 65 GLU H . . 3.670 3.284 2.898 3.503 . 0 0 "[ . 1 . 2]" 1
1595 1 64 PHE QD 1 65 GLU HA . . 4.740 3.879 3.437 4.199 . 0 0 "[ . 1 . 2]" 1
1596 1 64 PHE QD 1 66 VAL H . . 4.460 3.851 3.408 4.080 . 0 0 "[ . 1 . 2]" 1
1597 1 64 PHE QD 1 66 VAL QG . . 3.430 2.886 2.650 3.055 . 0 0 "[ . 1 . 2]" 1
1598 1 64 PHE QD 1 77 ALA H . . 5.270 5.262 5.146 5.281 0.011 11 0 "[ . 1 . 2]" 1
1599 1 64 PHE QD 1 77 ALA HA . . 3.970 3.043 2.895 3.160 . 0 0 "[ . 1 . 2]" 1
1600 1 64 PHE QD 1 77 ALA MB . . 3.210 2.360 2.228 2.650 . 0 0 "[ . 1 . 2]" 1
1601 1 64 PHE QD 1 78 VAL H . . 3.980 3.710 3.481 3.823 . 0 0 "[ . 1 . 2]" 1
1602 1 64 PHE QD 1 80 LEU HA . . 4.660 4.277 4.039 4.579 . 0 0 "[ . 1 . 2]" 1
1603 1 64 PHE QD 1 80 LEU MD1 . . 4.040 2.623 2.522 2.830 . 0 0 "[ . 1 . 2]" 1
1604 1 64 PHE QD 1 80 LEU HG . . 4.260 3.107 2.827 3.427 . 0 0 "[ . 1 . 2]" 1
1605 1 64 PHE QE 1 66 VAL H . . 5.120 4.864 4.037 5.127 0.007 16 0 "[ . 1 . 2]" 1
1606 1 64 PHE QE 1 66 VAL QG . . 3.040 2.555 1.999 2.782 . 0 0 "[ . 1 . 2]" 1
1607 1 64 PHE QE 1 77 ALA MB . . 4.220 3.462 3.324 3.638 . 0 0 "[ . 1 . 2]" 1
1608 1 64 PHE QE 1 80 LEU MD1 . . 4.460 4.055 3.872 4.247 . 0 0 "[ . 1 . 2]" 1
1609 1 64 PHE HZ 1 66 VAL QG . . 4.760 4.430 3.790 4.690 . 0 0 "[ . 1 . 2]" 1
1610 1 65 GLU H 1 65 GLU HB3 . . 3.250 2.474 2.435 2.505 . 0 0 "[ . 1 . 2]" 1
1611 1 65 GLU H 1 65 GLU HG2 . . 4.710 4.348 3.994 4.706 . 0 0 "[ . 1 . 2]" 1
1612 1 65 GLU H 1 65 GLU QG . . 3.870 3.807 3.730 3.883 0.013 20 0 "[ . 1 . 2]" 1
1613 1 65 GLU H 1 65 GLU HG3 . . 4.710 4.294 4.027 4.519 . 0 0 "[ . 1 . 2]" 1
1614 1 65 GLU H 1 66 VAL H . . 4.900 4.277 4.184 4.345 . 0 0 "[ . 1 . 2]" 1
1615 1 65 GLU H 1 78 VAL H . . 3.360 2.394 2.175 2.538 . 0 0 "[ . 1 . 2]" 1
1616 1 65 GLU H 1 78 VAL MG2 . . 3.560 2.949 2.830 3.148 . 0 0 "[ . 1 . 2]" 1
1617 1 65 GLU H 1 79 LYS H . . 5.500 5.257 5.148 5.348 . 0 0 "[ . 1 . 2]" 1
1618 1 65 GLU H 1 79 LYS HB2 . . 4.290 4.025 3.843 4.168 . 0 0 "[ . 1 . 2]" 1
1619 1 65 GLU H 1 79 LYS QG . . 5.340 5.100 4.775 5.365 0.025 12 0 "[ . 1 . 2]" 1
1620 1 65 GLU H 1 80 LEU HA . . 4.830 4.205 4.153 4.332 . 0 0 "[ . 1 . 2]" 1
1621 1 65 GLU H 1 80 LEU MD1 . . 4.310 4.101 4.030 4.162 . 0 0 "[ . 1 . 2]" 1
1622 1 65 GLU H 1 80 LEU HG . . 5.500 5.560 5.546 5.572 0.072 8 0 "[ . 1 . 2]" 1
1623 1 65 GLU HA 1 65 GLU HG2 . . 4.220 3.787 3.600 3.942 . 0 0 "[ . 1 . 2]" 1
1624 1 65 GLU HA 1 65 GLU QG . . 3.690 2.887 2.634 3.172 . 0 0 "[ . 1 . 2]" 1
1625 1 65 GLU HA 1 65 GLU HG3 . . 4.220 3.000 2.708 3.344 . 0 0 "[ . 1 . 2]" 1
1626 1 65 GLU HA 1 66 VAL H . . 2.750 2.142 2.138 2.155 . 0 0 "[ . 1 . 2]" 1
1627 1 65 GLU HA 1 66 VAL HB . . 5.080 4.604 4.497 4.658 . 0 0 "[ . 1 . 2]" 1
1628 1 65 GLU HA 1 66 VAL QG . . 3.900 3.667 3.528 3.898 . 0 0 "[ . 1 . 2]" 1
1629 1 65 GLU HA 1 78 VAL H . . 5.010 4.657 4.539 4.769 . 0 0 "[ . 1 . 2]" 1
1630 1 65 GLU HB2 1 66 VAL H . . 4.590 4.082 3.950 4.213 . 0 0 "[ . 1 . 2]" 1
1631 1 65 GLU HB3 1 66 VAL H . . 5.070 4.428 4.324 4.505 . 0 0 "[ . 1 . 2]" 1
1632 1 65 GLU HB3 1 78 VAL H . . 4.260 3.688 3.462 3.893 . 0 0 "[ . 1 . 2]" 1
1633 1 65 GLU HB3 1 78 VAL MG1 . . 5.440 4.914 4.645 5.152 . 0 0 "[ . 1 . 2]" 1
1634 1 65 GLU HB3 1 78 VAL MG2 . . 3.100 2.255 1.977 2.527 . 0 0 "[ . 1 . 2]" 1
1635 1 65 GLU QG 1 66 VAL H . . 4.150 3.062 2.668 3.400 . 0 0 "[ . 1 . 2]" 1
1636 1 65 GLU QG 1 67 SER H . . 4.810 4.155 3.941 4.333 . 0 0 "[ . 1 . 2]" 1
1637 1 65 GLU QG 1 67 SER QB . . 4.160 3.127 2.796 3.737 . 0 0 "[ . 1 . 2]" 1
1638 1 65 GLU QG 1 78 VAL H . . 4.280 4.171 3.991 4.284 0.004 14 0 "[ . 1 . 2]" 1
1639 1 65 GLU QG 1 78 VAL MG2 . . 3.170 2.286 2.000 2.612 . 0 0 "[ . 1 . 2]" 1
1640 1 65 GLU HG2 1 66 VAL H . . 4.740 4.339 3.919 4.753 0.013 16 0 "[ . 1 . 2]" 1
1641 1 65 GLU HG2 1 78 VAL MG2 . . 3.710 2.537 2.018 3.129 . 0 0 "[ . 1 . 2]" 1
1642 1 65 GLU HG3 1 66 VAL H . . 4.740 3.131 2.708 3.488 . 0 0 "[ . 1 . 2]" 1
1643 1 65 GLU HG3 1 78 VAL MG2 . . 3.710 3.078 2.449 3.615 . 0 0 "[ . 1 . 2]" 1
1644 1 66 VAL H 1 66 VAL HB . . 2.850 2.485 2.393 2.542 . 0 0 "[ . 1 . 2]" 1
1645 1 66 VAL H 1 66 VAL QG . . 2.930 2.261 2.076 2.507 . 0 0 "[ . 1 . 2]" 1
1646 1 66 VAL H 1 78 VAL MG2 . . 4.940 4.601 4.427 4.825 . 0 0 "[ . 1 . 2]" 1
1647 1 66 VAL HB 1 67 SER H . . 4.400 4.291 4.216 4.355 . 0 0 "[ . 1 . 2]" 1
1648 1 66 VAL QG 1 67 SER H . . 3.020 2.665 2.446 2.866 . 0 0 "[ . 1 . 2]" 1
1649 1 66 VAL QG 1 67 SER QB . . 4.660 4.243 4.120 4.529 . 0 0 "[ . 1 . 2]" 1
1650 1 66 VAL QG 1 75 PRO HA . . 3.840 2.997 2.835 3.207 . 0 0 "[ . 1 . 2]" 1
1651 1 66 VAL QG 1 75 PRO HB2 . . 3.510 2.517 2.311 2.692 . 0 0 "[ . 1 . 2]" 1
1652 1 66 VAL QG 1 75 PRO HB3 . . 3.340 2.850 2.657 3.016 . 0 0 "[ . 1 . 2]" 1
1653 1 66 VAL QG 1 75 PRO HG2 . . 4.490 4.355 4.135 4.491 0.001 17 0 "[ . 1 . 2]" 1
1654 1 66 VAL QG 1 75 PRO HG3 . . 4.550 4.333 4.098 4.487 . 0 0 "[ . 1 . 2]" 1
1655 1 66 VAL QG 1 76 ILE H . . 3.940 3.587 3.307 3.856 . 0 0 "[ . 1 . 2]" 1
1656 1 66 VAL QG 1 77 ALA HA . . 4.010 3.649 3.508 3.805 . 0 0 "[ . 1 . 2]" 1
1657 1 66 VAL QG 1 77 ALA MB . . 4.650 3.824 3.662 4.010 . 0 0 "[ . 1 . 2]" 1
1658 1 66 VAL QG 1 78 VAL H . . 5.440 4.812 4.660 4.940 . 0 0 "[ . 1 . 2]" 1
1659 1 66 VAL MG1 1 77 ALA HA . . 4.870 4.529 4.371 4.653 . 0 0 "[ . 1 . 2]" 1
1660 1 66 VAL MG2 1 77 ALA HA . . 4.870 3.853 3.645 4.085 . 0 0 "[ . 1 . 2]" 1
1661 1 67 SER H 1 67 SER HB2 . . 3.620 2.807 2.483 3.586 . 0 0 "[ . 1 . 2]" 1
1662 1 67 SER H 1 67 SER QB . . 3.130 2.594 2.441 3.138 0.008 14 0 "[ . 1 . 2]" 1
1663 1 67 SER H 1 67 SER HB3 . . 3.620 3.199 2.881 3.625 0.005 12 0 "[ . 1 . 2]" 1
1664 1 67 SER H 1 68 SER H . . 4.580 4.429 4.402 4.458 . 0 0 "[ . 1 . 2]" 1
1665 1 67 SER H 1 75 PRO HA . . 4.060 4.018 3.941 4.072 0.012 11 0 "[ . 1 . 2]" 1
1666 1 67 SER H 1 75 PRO HB3 . . 5.500 5.470 5.383 5.509 0.009 10 0 "[ . 1 . 2]" 1
1667 1 67 SER H 1 76 ILE H . . 3.390 3.137 2.972 3.269 . 0 0 "[ . 1 . 2]" 1
1668 1 67 SER H 1 76 ILE MD . . 4.950 4.716 4.638 4.803 . 0 0 "[ . 1 . 2]" 1
1669 1 67 SER H 1 76 ILE HG12 . . 4.830 4.477 4.287 4.630 . 0 0 "[ . 1 . 2]" 1
1670 1 67 SER H 1 76 ILE HG13 . . 3.910 3.316 3.220 3.414 . 0 0 "[ . 1 . 2]" 1
1671 1 67 SER H 1 76 ILE MG . . 5.330 5.190 5.079 5.267 . 0 0 "[ . 1 . 2]" 1
1672 1 67 SER H 1 77 ALA HA . . 3.750 3.585 3.432 3.704 . 0 0 "[ . 1 . 2]" 1
1673 1 67 SER H 1 78 VAL MG2 . . 3.970 3.585 3.323 3.967 . 0 0 "[ . 1 . 2]" 1
1674 1 67 SER QB 1 68 SER H . . 3.050 2.609 2.095 3.050 . 0 0 "[ . 1 . 2]" 1
1675 1 67 SER QB 1 76 ILE H . . 4.220 4.103 3.978 4.262 0.042 14 0 "[ . 1 . 2]" 1
1676 1 67 SER QB 1 76 ILE MD . . 3.720 3.647 3.512 3.734 0.014 12 0 "[ . 1 . 2]" 1
1677 1 67 SER QB 1 76 ILE HG12 . . 4.260 3.967 3.815 4.123 . 0 0 "[ . 1 . 2]" 1
1678 1 67 SER QB 1 76 ILE HG13 . . 3.640 3.116 2.981 3.266 . 0 0 "[ . 1 . 2]" 1
1679 1 67 SER QB 1 76 ILE MG . . 5.340 5.266 5.105 5.318 . 0 0 "[ . 1 . 2]" 1
1680 1 67 SER QB 1 78 VAL MG1 . . 3.090 2.636 2.372 3.041 . 0 0 "[ . 1 . 2]" 1
1681 1 67 SER QB 1 78 VAL MG2 . . 3.090 2.168 1.971 2.524 . 0 0 "[ . 1 . 2]" 1
1682 1 67 SER HB2 1 76 ILE HG13 . . 4.400 3.985 3.110 4.405 0.005 13 0 "[ . 1 . 2]" 1
1683 1 67 SER HB2 1 78 VAL MG1 . . 3.600 2.989 2.410 3.374 . 0 0 "[ . 1 . 2]" 1
1684 1 67 SER HB2 1 78 VAL MG2 . . 3.550 2.255 1.983 3.465 . 0 0 "[ . 1 . 2]" 1
1685 1 67 SER HB3 1 76 ILE HG13 . . 4.400 3.492 3.037 4.410 0.010 14 0 "[ . 1 . 2]" 1
1686 1 67 SER HB3 1 78 VAL MG1 . . 3.600 3.120 2.644 3.606 0.006 12 0 "[ . 1 . 2]" 1
1687 1 67 SER HB3 1 78 VAL MG2 . . 3.550 3.164 2.539 3.561 0.011 1 0 "[ . 1 . 2]" 1
1688 1 68 SER H 1 68 SER QB . . 3.320 2.808 2.337 3.070 . 0 0 "[ . 1 . 2]" 1
1689 1 68 SER H 1 69 ASP H . . 4.610 4.364 4.121 4.479 . 0 0 "[ . 1 . 2]" 1
1690 1 68 SER H 1 76 ILE H . . 5.270 4.885 4.653 5.061 . 0 0 "[ . 1 . 2]" 1
1691 1 68 SER H 1 76 ILE HG12 . . 5.500 5.074 4.477 5.470 . 0 0 "[ . 1 . 2]" 1
1692 1 68 SER H 1 76 ILE HG13 . . 5.500 5.115 4.646 5.482 . 0 0 "[ . 1 . 2]" 1
1693 1 68 SER HA 1 69 ASP H . . 3.210 2.158 2.138 2.196 . 0 0 "[ . 1 . 2]" 1
1694 1 68 SER HA 1 69 ASP HB2 . . 4.740 4.383 4.270 4.486 . 0 0 "[ . 1 . 2]" 1
1695 1 68 SER HA 1 69 ASP HB3 . . 5.040 4.833 4.691 4.997 . 0 0 "[ . 1 . 2]" 1
1696 1 68 SER HA 1 74 LYS H . . 4.780 4.680 4.404 4.783 0.003 9 0 "[ . 1 . 2]" 1
1697 1 68 SER HA 1 76 ILE H . . 4.120 3.371 3.153 3.594 . 0 0 "[ . 1 . 2]" 1
1698 1 68 SER HA 1 76 ILE HG12 . . 4.220 3.818 3.366 4.216 . 0 0 "[ . 1 . 2]" 1
1699 1 68 SER QB 1 69 ASP H . . 3.590 3.252 3.017 3.593 0.003 16 0 "[ . 1 . 2]" 1
1700 1 68 SER QB 1 69 ASP HA . . 5.340 4.760 4.545 5.006 . 0 0 "[ . 1 . 2]" 1
1701 1 68 SER QB 1 73 GLY QA . . 4.260 2.846 2.380 3.724 . 0 0 "[ . 1 . 2]" 1
1702 1 68 SER QB 1 74 LYS HA . . 5.340 5.039 4.705 5.340 0.000 5 0 "[ . 1 . 2]" 1
1703 1 68 SER HB2 1 69 ASP H . . 4.430 3.684 3.111 4.232 . 0 0 "[ . 1 . 2]" 1
1704 1 68 SER HB3 1 69 ASP H . . 4.430 3.882 3.134 4.383 . 0 0 "[ . 1 . 2]" 1
1705 1 69 ASP H 1 69 ASP HB2 . . 3.360 2.357 2.247 2.528 . 0 0 "[ . 1 . 2]" 1
1706 1 69 ASP H 1 69 ASP HB3 . . 3.380 2.737 2.561 2.873 . 0 0 "[ . 1 . 2]" 1
1707 1 69 ASP H 1 73 GLY H . . 4.260 3.804 3.460 4.181 . 0 0 "[ . 1 . 2]" 1
1708 1 69 ASP H 1 74 LYS H . . 3.640 3.276 2.921 3.586 . 0 0 "[ . 1 . 2]" 1
1709 1 69 ASP H 1 76 ILE H . . 4.200 3.886 3.614 4.201 0.001 18 0 "[ . 1 . 2]" 1
1710 1 69 ASP H 1 76 ILE MD . . 4.120 4.030 3.779 4.122 0.002 4 0 "[ . 1 . 2]" 1
1711 1 69 ASP H 1 76 ILE HG12 . . 4.240 3.116 2.918 3.318 . 0 0 "[ . 1 . 2]" 1
1712 1 69 ASP H 1 76 ILE HG13 . . 4.940 4.597 4.285 4.846 . 0 0 "[ . 1 . 2]" 1
1713 1 69 ASP H 1 76 ILE MG . . 3.980 3.730 3.580 3.899 . 0 0 "[ . 1 . 2]" 1
1714 1 69 ASP HA 1 70 ARG H . . 2.810 2.484 2.404 2.577 . 0 0 "[ . 1 . 2]" 1
1715 1 69 ASP HA 1 70 ARG HA . . 4.740 4.383 4.360 4.411 . 0 0 "[ . 1 . 2]" 1
1716 1 69 ASP HA 1 70 ARG QB . . 4.750 4.550 4.271 4.687 . 0 0 "[ . 1 . 2]" 1
1717 1 69 ASP HA 1 70 ARG HE . . 3.030 2.736 1.901 3.037 0.007 11 0 "[ . 1 . 2]" 1
1718 1 69 ASP HA 1 70 ARG HG2 . . 5.500 3.994 3.246 5.560 0.060 17 0 "[ . 1 . 2]" 1
1719 1 69 ASP HA 1 70 ARG HG3 . . 5.500 5.155 4.375 5.505 0.005 11 0 "[ . 1 . 2]" 1
1720 1 69 ASP HA 1 71 ARG H . . 4.320 4.060 3.937 4.347 0.027 10 0 "[ . 1 . 2]" 1
1721 1 69 ASP HA 1 73 GLY H . . 4.700 4.434 4.329 4.523 . 0 0 "[ . 1 . 2]" 1
1722 1 69 ASP HA 1 76 ILE MD . . 3.560 3.023 2.770 3.438 . 0 0 "[ . 1 . 2]" 1
1723 1 69 ASP HA 1 76 ILE HG12 . . 4.580 3.642 3.305 3.954 . 0 0 "[ . 1 . 2]" 1
1724 1 69 ASP HA 1 76 ILE MG . . 4.880 4.501 4.197 4.787 . 0 0 "[ . 1 . 2]" 1
1725 1 69 ASP HB2 1 70 ARG H . . 4.370 3.818 3.723 3.951 . 0 0 "[ . 1 . 2]" 1
1726 1 69 ASP HB2 1 71 ARG H . . 4.520 4.188 4.054 4.464 . 0 0 "[ . 1 . 2]" 1
1727 1 69 ASP HB2 1 72 THR H . . 4.240 3.901 3.682 4.151 . 0 0 "[ . 1 . 2]" 1
1728 1 69 ASP HB2 1 73 GLY H . . 4.120 3.667 3.488 3.807 . 0 0 "[ . 1 . 2]" 1
1729 1 69 ASP HB2 1 74 LYS H . . 3.610 3.344 3.101 3.621 0.011 14 0 "[ . 1 . 2]" 1
1730 1 69 ASP HB2 1 74 LYS HB2 . . 4.740 3.993 3.660 4.283 . 0 0 "[ . 1 . 2]" 1
1731 1 69 ASP HB2 1 76 ILE MD . . 3.760 3.135 2.981 3.361 . 0 0 "[ . 1 . 2]" 1
1732 1 69 ASP HB2 1 76 ILE HG12 . . 4.120 2.953 2.692 3.360 . 0 0 "[ . 1 . 2]" 1
1733 1 69 ASP HB2 1 76 ILE MG . . 3.390 2.849 2.684 2.953 . 0 0 "[ . 1 . 2]" 1
1734 1 69 ASP HB3 1 70 ARG H . . 4.640 3.237 3.037 3.402 . 0 0 "[ . 1 . 2]" 1
1735 1 69 ASP HB3 1 71 ARG H . . 4.460 2.908 2.605 3.270 . 0 0 "[ . 1 . 2]" 1
1736 1 69 ASP HB3 1 72 THR H . . 3.630 2.398 2.085 2.728 . 0 0 "[ . 1 . 2]" 1
1737 1 69 ASP HB3 1 72 THR MG . . 4.530 4.047 3.754 4.342 . 0 0 "[ . 1 . 2]" 1
1738 1 69 ASP HB3 1 73 GLY H . . 3.560 1.959 1.893 2.065 . 0 0 "[ . 1 . 2]" 1
1739 1 69 ASP HB3 1 74 LYS H . . 3.140 2.665 2.547 2.925 . 0 0 "[ . 1 . 2]" 1
1740 1 69 ASP HB3 1 76 ILE MD . . 4.800 4.526 4.406 4.646 . 0 0 "[ . 1 . 2]" 1
1741 1 69 ASP HB3 1 76 ILE HG12 . . 5.030 4.575 4.343 4.796 . 0 0 "[ . 1 . 2]" 1
1742 1 69 ASP HB3 1 76 ILE MG . . 4.280 4.162 3.954 4.281 0.001 18 0 "[ . 1 . 2]" 1
1743 1 70 ARG H 1 70 ARG QB . . 2.970 2.578 2.305 3.023 0.053 10 0 "[ . 1 . 2]" 1
1744 1 70 ARG H 1 70 ARG HG2 . . 4.920 2.875 1.864 4.322 . 0 0 "[ . 1 . 2]" 1
1745 1 70 ARG H 1 70 ARG QG . . 4.150 2.709 1.856 3.858 . 0 0 "[ . 1 . 2]" 1
1746 1 70 ARG H 1 70 ARG HG3 . . 4.920 3.856 3.426 4.340 . 0 0 "[ . 1 . 2]" 1
1747 1 70 ARG H 1 71 ARG H . . 3.340 2.133 1.926 2.313 . 0 0 "[ . 1 . 2]" 1
1748 1 70 ARG H 1 72 THR H . . 4.490 3.888 3.555 4.273 . 0 0 "[ . 1 . 2]" 1
1749 1 70 ARG H 1 76 ILE MD . . 5.050 4.719 4.447 5.030 . 0 0 "[ . 1 . 2]" 1
1750 1 70 ARG HA 1 70 ARG HD2 . . 4.720 3.967 3.084 4.724 0.004 10 0 "[ . 1 . 2]" 1
1751 1 70 ARG HA 1 70 ARG QD . . 4.100 2.818 2.320 4.183 0.083 10 0 "[ . 1 . 2]" 1
1752 1 70 ARG HA 1 70 ARG HD3 . . 4.720 2.974 2.340 4.689 . 0 0 "[ . 1 . 2]" 1
1753 1 70 ARG HA 1 70 ARG HE . . 3.450 2.892 2.467 3.450 0.000 19 0 "[ . 1 . 2]" 1
1754 1 70 ARG HA 1 72 THR H . . 5.250 4.828 4.443 5.263 0.013 11 0 "[ . 1 . 2]" 1
1755 1 70 ARG HA 1 73 GLY H . . 4.370 4.108 3.931 4.308 . 0 0 "[ . 1 . 2]" 1
1756 1 70 ARG QB 1 70 ARG QD . . 3.300 2.363 2.021 2.908 . 0 0 "[ . 1 . 2]" 1
1757 1 70 ARG QB 1 71 ARG H . . 3.660 3.330 3.081 3.465 . 0 0 "[ . 1 . 2]" 1
1758 1 70 ARG QB 1 71 ARG HA . . 4.790 4.152 4.048 4.218 . 0 0 "[ . 1 . 2]" 1
1759 1 70 ARG HB2 1 71 ARG H . . 4.410 3.480 3.192 3.623 . 0 0 "[ . 1 . 2]" 1
1760 1 70 ARG HB2 1 71 ARG HA . . 5.500 4.583 4.216 4.811 . 0 0 "[ . 1 . 2]" 1
1761 1 70 ARG HB3 1 71 ARG H . . 4.410 4.254 3.868 4.417 0.007 20 0 "[ . 1 . 2]" 1
1762 1 70 ARG HB3 1 71 ARG HA . . 5.500 4.824 4.362 5.618 0.118 10 0 "[ . 1 . 2]" 1
1763 1 70 ARG HE 1 76 ILE MD . . 5.330 5.148 4.443 5.336 0.006 14 0 "[ . 1 . 2]" 1
1764 1 70 ARG HG2 1 71 ARG H . . 5.500 4.578 2.366 5.515 0.015 11 0 "[ . 1 . 2]" 1
1765 1 70 ARG HG3 1 71 ARG H . . 5.500 5.292 3.924 5.489 . 0 0 "[ . 1 . 2]" 1
1766 1 71 ARG H 1 71 ARG QB . . 2.780 2.601 2.490 2.789 0.009 2 0 "[ . 1 . 2]" 1
1767 1 71 ARG H 1 71 ARG HD2 . . 5.500 4.707 3.833 5.283 . 0 0 "[ . 1 . 2]" 1
1768 1 71 ARG H 1 71 ARG HD3 . . 5.500 4.544 3.388 5.323 . 0 0 "[ . 1 . 2]" 1
1769 1 71 ARG H 1 71 ARG HG2 . . 3.980 2.833 2.306 3.612 . 0 0 "[ . 1 . 2]" 1
1770 1 71 ARG H 1 71 ARG QG . . 3.190 2.540 2.287 2.906 . 0 0 "[ . 1 . 2]" 1
1771 1 71 ARG H 1 71 ARG HG3 . . 3.980 3.436 2.334 3.984 0.004 20 0 "[ . 1 . 2]" 1
1772 1 71 ARG H 1 72 THR H . . 2.860 2.140 1.943 2.555 . 0 0 "[ . 1 . 2]" 1
1773 1 71 ARG H 1 72 THR MG . . 4.300 4.058 3.833 4.265 . 0 0 "[ . 1 . 2]" 1
1774 1 71 ARG HA 1 71 ARG HD2 . . 5.020 3.448 2.008 4.797 . 0 0 "[ . 1 . 2]" 1
1775 1 71 ARG HA 1 71 ARG QD . . 4.270 2.907 1.998 4.150 . 0 0 "[ . 1 . 2]" 1
1776 1 71 ARG HA 1 71 ARG HD3 . . 5.020 3.482 2.085 4.893 . 0 0 "[ . 1 . 2]" 1
1777 1 71 ARG HA 1 71 ARG HG2 . . 3.910 2.883 2.396 3.276 . 0 0 "[ . 1 . 2]" 1
1778 1 71 ARG HA 1 71 ARG QG . . 3.390 2.783 2.351 3.098 . 0 0 "[ . 1 . 2]" 1
1779 1 71 ARG HA 1 71 ARG HG3 . . 3.910 3.701 3.345 3.907 . 0 0 "[ . 1 . 2]" 1
1780 1 71 ARG HA 1 73 GLY H . . 4.870 4.549 4.361 4.659 . 0 0 "[ . 1 . 2]" 1
1781 1 71 ARG QB 1 71 ARG QD . . 3.050 2.294 2.048 2.688 . 0 0 "[ . 1 . 2]" 1
1782 1 71 ARG QB 1 72 THR H . . 3.050 2.488 2.111 2.924 . 0 0 "[ . 1 . 2]" 1
1783 1 71 ARG QB 1 72 THR HA . . 4.630 4.074 3.933 4.180 . 0 0 "[ . 1 . 2]" 1
1784 1 71 ARG QB 1 72 THR MG . . 3.250 2.463 2.317 2.579 . 0 0 "[ . 1 . 2]" 1
1785 1 71 ARG QB 1 73 GLY H . . 4.560 4.251 4.025 4.557 . 0 0 "[ . 1 . 2]" 1
1786 1 71 ARG HB2 1 72 THR HA . . 5.500 4.455 4.302 4.576 . 0 0 "[ . 1 . 2]" 1
1787 1 71 ARG HB3 1 72 THR HA . . 5.500 4.728 4.539 5.119 . 0 0 "[ . 1 . 2]" 1
1788 1 71 ARG QG 1 72 THR H . . 4.300 3.821 3.638 3.963 . 0 0 "[ . 1 . 2]" 1
1789 1 71 ARG QG 1 72 THR MG . . 4.250 4.181 3.979 4.262 0.012 18 0 "[ . 1 . 2]" 1
1790 1 71 ARG QG 1 73 GLY H . . 5.340 5.103 4.907 5.263 . 0 0 "[ . 1 . 2]" 1
1791 1 71 ARG HG2 1 72 THR MG . . 5.040 4.925 4.608 5.051 0.011 10 0 "[ . 1 . 2]" 1
1792 1 71 ARG HG3 1 72 THR MG . . 5.040 4.527 4.257 4.682 . 0 0 "[ . 1 . 2]" 1
1793 1 72 THR H 1 72 THR MG . . 3.050 2.497 2.003 2.767 . 0 0 "[ . 1 . 2]" 1
1794 1 72 THR H 1 73 GLY H . . 2.790 1.994 1.797 2.242 . 0 0 "[ . 1 . 2]" 1
1795 1 72 THR H 1 73 GLY QA . . 4.560 3.952 3.771 4.172 . 0 0 "[ . 1 . 2]" 1
1796 1 72 THR H 1 74 LYS H . . 3.880 3.692 3.516 3.899 0.019 10 0 "[ . 1 . 2]" 1
1797 1 72 THR HA 1 72 THR HB . . 2.920 2.408 2.345 2.466 . 0 0 "[ . 1 . 2]" 1
1798 1 72 THR HA 1 72 THR MG . . 2.980 2.474 2.377 2.586 . 0 0 "[ . 1 . 2]" 1
1799 1 72 THR HA 1 74 LYS H . . 4.310 4.228 4.066 4.313 0.003 17 0 "[ . 1 . 2]" 1
1800 1 72 THR HB 1 73 GLY H . . 4.740 4.193 4.087 4.325 . 0 0 "[ . 1 . 2]" 1
1801 1 72 THR HB 1 74 LYS H . . 3.630 3.434 3.229 3.592 . 0 0 "[ . 1 . 2]" 1
1802 1 72 THR HB 1 74 LYS HB2 . . 4.470 3.960 3.638 4.277 . 0 0 "[ . 1 . 2]" 1
1803 1 72 THR HB 1 74 LYS HB3 . . 5.140 4.877 4.644 5.059 . 0 0 "[ . 1 . 2]" 1
1804 1 72 THR HB 1 74 LYS QD . . 4.860 3.971 3.466 4.230 . 0 0 "[ . 1 . 2]" 1
1805 1 72 THR HB 1 74 LYS HE2 . . 5.500 3.674 2.618 4.478 . 0 0 "[ . 1 . 2]" 1
1806 1 72 THR HB 1 74 LYS HE3 . . 5.500 3.374 2.354 4.765 . 0 0 "[ . 1 . 2]" 1
1807 1 72 THR HB 1 74 LYS HG2 . . 4.400 2.531 2.162 3.714 . 0 0 "[ . 1 . 2]" 1
1808 1 72 THR HB 1 74 LYS QG . . 3.800 2.140 1.980 2.307 . 0 0 "[ . 1 . 2]" 1
1809 1 72 THR HB 1 74 LYS HG3 . . 4.400 2.473 1.999 2.811 . 0 0 "[ . 1 . 2]" 1
1810 1 72 THR MG 1 73 GLY H . . 4.170 3.955 3.755 4.119 . 0 0 "[ . 1 . 2]" 1
1811 1 72 THR MG 1 74 LYS H . . 4.410 4.172 4.023 4.297 . 0 0 "[ . 1 . 2]" 1
1812 1 72 THR MG 1 74 LYS HB2 . . 4.630 4.382 4.238 4.519 . 0 0 "[ . 1 . 2]" 1
1813 1 72 THR MG 1 74 LYS HE2 . . 5.500 4.831 3.259 5.502 0.002 18 0 "[ . 1 . 2]" 1
1814 1 72 THR MG 1 74 LYS HE3 . . 5.500 4.426 3.237 5.501 0.001 14 0 "[ . 1 . 2]" 1
1815 1 73 GLY H 1 73 GLY QA . . 2.570 2.199 2.192 2.206 . 0 0 "[ . 1 . 2]" 1
1816 1 73 GLY H 1 74 LYS H . . 3.020 2.691 2.620 2.778 . 0 0 "[ . 1 . 2]" 1
1817 1 73 GLY H 1 74 LYS HB2 . . 5.500 5.009 4.825 5.134 . 0 0 "[ . 1 . 2]" 1
1818 1 73 GLY H 1 74 LYS HG2 . . 5.500 4.470 4.116 5.509 0.009 17 0 "[ . 1 . 2]" 1
1819 1 73 GLY H 1 74 LYS HG3 . . 5.500 5.352 4.637 5.516 0.016 10 0 "[ . 1 . 2]" 1
1820 1 74 LYS H 1 74 LYS HB2 . . 2.850 2.523 2.408 2.605 . 0 0 "[ . 1 . 2]" 1
1821 1 74 LYS H 1 74 LYS HB3 . . 3.640 3.617 3.596 3.644 0.004 9 0 "[ . 1 . 2]" 1
1822 1 74 LYS H 1 74 LYS HG2 . . 4.020 2.402 2.082 3.343 . 0 0 "[ . 1 . 2]" 1
1823 1 74 LYS H 1 74 LYS QG . . 3.400 2.270 2.063 2.657 . 0 0 "[ . 1 . 2]" 1
1824 1 74 LYS H 1 74 LYS HG3 . . 4.020 3.271 2.688 3.446 . 0 0 "[ . 1 . 2]" 1
1825 1 74 LYS H 1 75 PRO HD2 . . 4.850 4.790 4.778 4.805 . 0 0 "[ . 1 . 2]" 1
1826 1 74 LYS H 1 75 PRO HD3 . . 5.330 5.051 5.034 5.065 . 0 0 "[ . 1 . 2]" 1
1827 1 74 LYS H 1 76 ILE HG12 . . 5.500 5.314 5.184 5.496 . 0 0 "[ . 1 . 2]" 1
1828 1 74 LYS H 1 76 ILE MG . . 4.690 4.169 4.049 4.336 . 0 0 "[ . 1 . 2]" 1
1829 1 74 LYS HA 1 74 LYS HD2 . . 5.160 3.629 2.465 4.341 . 0 0 "[ . 1 . 2]" 1
1830 1 74 LYS HA 1 74 LYS QD . . 4.530 2.631 2.348 3.651 . 0 0 "[ . 1 . 2]" 1
1831 1 74 LYS HA 1 74 LYS HD3 . . 5.160 2.805 2.384 4.347 . 0 0 "[ . 1 . 2]" 1
1832 1 74 LYS HA 1 74 LYS HE2 . . 5.500 4.620 3.649 5.303 . 0 0 "[ . 1 . 2]" 1
1833 1 74 LYS HA 1 74 LYS HE3 . . 5.500 4.911 4.279 5.445 . 0 0 "[ . 1 . 2]" 1
1834 1 74 LYS HA 1 74 LYS QG . . 3.450 2.704 2.300 2.863 . 0 0 "[ . 1 . 2]" 1
1835 1 74 LYS HA 1 75 PRO HB3 . . 4.940 4.845 4.842 4.849 . 0 0 "[ . 1 . 2]" 1
1836 1 74 LYS HA 1 75 PRO HD2 . . 3.020 2.387 2.370 2.413 . 0 0 "[ . 1 . 2]" 1
1837 1 74 LYS HA 1 75 PRO HD3 . . 2.870 2.296 2.290 2.305 . 0 0 "[ . 1 . 2]" 1
1838 1 74 LYS HA 1 75 PRO HG2 . . 4.740 4.502 4.488 4.523 . 0 0 "[ . 1 . 2]" 1
1839 1 74 LYS HA 1 76 ILE MG . . 5.360 4.724 4.648 4.787 . 0 0 "[ . 1 . 2]" 1
1840 1 74 LYS HB2 1 75 PRO HD2 . . 3.740 3.539 3.483 3.591 . 0 0 "[ . 1 . 2]" 1
1841 1 74 LYS HB2 1 75 PRO HD3 . . 4.660 4.638 4.595 4.678 0.018 13 0 "[ . 1 . 2]" 1
1842 1 74 LYS HB2 1 76 ILE MG . . 4.740 2.967 2.857 3.069 . 0 0 "[ . 1 . 2]" 1
1843 1 74 LYS HB3 1 74 LYS HE2 . . 5.060 4.418 3.744 4.684 . 0 0 "[ . 1 . 2]" 1
1844 1 74 LYS HB3 1 74 LYS QE . . 4.400 3.828 2.274 4.051 . 0 0 "[ . 1 . 2]" 1
1845 1 74 LYS HB3 1 74 LYS HE3 . . 5.060 4.255 2.294 4.621 . 0 0 "[ . 1 . 2]" 1
1846 1 74 LYS HB3 1 75 PRO HD2 . . 3.210 2.004 1.988 2.036 . 0 0 "[ . 1 . 2]" 1
1847 1 74 LYS HB3 1 75 PRO HD3 . . 3.510 3.446 3.436 3.475 . 0 0 "[ . 1 . 2]" 1
1848 1 74 LYS QD 1 75 PRO HD2 . . 4.740 2.850 2.499 3.286 . 0 0 "[ . 1 . 2]" 1
1849 1 74 LYS HD2 1 75 PRO HD2 . . 5.500 3.374 2.599 3.951 . 0 0 "[ . 1 . 2]" 1
1850 1 74 LYS HD2 1 75 PRO HD3 . . 5.500 4.637 3.384 5.498 . 0 0 "[ . 1 . 2]" 1
1851 1 74 LYS HD3 1 75 PRO HD2 . . 5.500 3.283 2.551 4.343 . 0 0 "[ . 1 . 2]" 1
1852 1 74 LYS HD3 1 75 PRO HD3 . . 5.500 4.002 3.342 5.513 0.013 17 0 "[ . 1 . 2]" 1
1853 1 74 LYS QE 1 74 LYS QG . . 3.060 2.147 2.019 2.319 . 0 0 "[ . 1 . 2]" 1
1854 1 74 LYS QG 1 75 PRO HD2 . . 4.560 3.852 3.347 4.009 . 0 0 "[ . 1 . 2]" 1
1855 1 74 LYS QG 1 75 PRO HD3 . . 5.210 4.583 3.979 4.779 . 0 0 "[ . 1 . 2]" 1
1856 1 74 LYS QG 1 76 ILE MG . . 4.800 4.391 4.268 4.611 . 0 0 "[ . 1 . 2]" 1
1857 1 74 LYS HG2 1 75 PRO HD2 . . 5.440 4.239 3.450 4.493 . 0 0 "[ . 1 . 2]" 1
1858 1 74 LYS HG2 1 76 ILE MG . . 5.500 5.165 5.014 5.497 . 0 0 "[ . 1 . 2]" 1
1859 1 74 LYS HG3 1 75 PRO HD2 . . 5.440 4.480 4.388 4.549 . 0 0 "[ . 1 . 2]" 1
1860 1 74 LYS HG3 1 76 ILE MG . . 5.500 4.752 4.619 4.952 . 0 0 "[ . 1 . 2]" 1
1861 1 75 PRO HA 1 76 ILE H . . 2.610 2.227 2.189 2.267 . 0 0 "[ . 1 . 2]" 1
1862 1 75 PRO HB2 1 76 ILE H . . 4.150 4.020 3.923 4.095 . 0 0 "[ . 1 . 2]" 1
1863 1 75 PRO HB3 1 76 ILE H . . 4.450 4.354 4.279 4.414 . 0 0 "[ . 1 . 2]" 1
1864 1 76 ILE H 1 76 ILE HB . . 3.800 3.744 3.699 3.787 . 0 0 "[ . 1 . 2]" 1
1865 1 76 ILE H 1 76 ILE MD . . 3.960 3.872 3.797 3.943 . 0 0 "[ . 1 . 2]" 1
1866 1 76 ILE H 1 76 ILE HG12 . . 3.070 2.408 2.317 2.511 . 0 0 "[ . 1 . 2]" 1
1867 1 76 ILE H 1 76 ILE HG13 . . 3.490 2.556 2.464 2.666 . 0 0 "[ . 1 . 2]" 1
1868 1 76 ILE H 1 76 ILE MG . . 3.420 2.739 2.679 2.803 . 0 0 "[ . 1 . 2]" 1
1869 1 76 ILE H 1 77 ALA H . . 4.610 4.510 4.487 4.529 . 0 0 "[ . 1 . 2]" 1
1870 1 76 ILE HA 1 76 ILE MD . . 4.320 4.124 4.096 4.149 . 0 0 "[ . 1 . 2]" 1
1871 1 76 ILE HA 1 76 ILE HG13 . . 4.080 3.590 3.568 3.623 . 0 0 "[ . 1 . 2]" 1
1872 1 76 ILE HA 1 76 ILE MG . . 3.030 2.371 2.317 2.412 . 0 0 "[ . 1 . 2]" 1
1873 1 76 ILE HA 1 77 ALA H . . 2.770 2.399 2.265 2.463 . 0 0 "[ . 1 . 2]" 1
1874 1 76 ILE HB 1 76 ILE MD . . 3.170 2.221 2.157 2.292 . 0 0 "[ . 1 . 2]" 1
1875 1 76 ILE HB 1 77 ALA H . . 2.980 2.393 2.245 2.743 . 0 0 "[ . 1 . 2]" 1
1876 1 76 ILE HB 1 77 ALA HA . . 5.040 4.655 4.584 4.760 . 0 0 "[ . 1 . 2]" 1
1877 1 76 ILE HB 1 77 ALA MB . . 4.530 4.204 4.093 4.394 . 0 0 "[ . 1 . 2]" 1
1878 1 76 ILE HB 1 78 VAL MG1 . . 4.150 3.987 3.713 4.147 . 0 0 "[ . 1 . 2]" 1
1879 1 76 ILE MD 1 77 ALA H . . 4.410 3.939 3.777 4.411 0.001 14 0 "[ . 1 . 2]" 1
1880 1 76 ILE MD 1 78 VAL HB . . 4.830 4.813 4.739 4.842 0.012 14 0 "[ . 1 . 2]" 1
1881 1 76 ILE HG12 1 76 ILE MG . . 3.420 2.258 2.219 2.302 . 0 0 "[ . 1 . 2]" 1
1882 1 76 ILE HG12 1 77 ALA H . . 5.500 4.828 4.721 5.035 . 0 0 "[ . 1 . 2]" 1
1883 1 76 ILE HG13 1 76 ILE MG . . 3.670 3.160 3.148 3.181 . 0 0 "[ . 1 . 2]" 1
1884 1 76 ILE HG13 1 77 ALA H . . 4.240 3.781 3.630 4.044 . 0 0 "[ . 1 . 2]" 1
1885 1 76 ILE HG13 1 78 VAL H . . 5.350 5.286 5.181 5.353 0.003 1 0 "[ . 1 . 2]" 1
1886 1 76 ILE HG13 1 78 VAL MG2 . . 4.520 4.252 4.038 4.517 . 0 0 "[ . 1 . 2]" 1
1887 1 76 ILE MG 1 77 ALA H . . 3.900 3.636 3.547 3.747 . 0 0 "[ . 1 . 2]" 1
1888 1 77 ALA H 1 77 ALA MB . . 2.870 2.198 2.124 2.292 . 0 0 "[ . 1 . 2]" 1
1889 1 77 ALA H 1 78 VAL H . . 4.770 4.574 4.559 4.597 . 0 0 "[ . 1 . 2]" 1
1890 1 77 ALA H 1 78 VAL MG1 . . 4.400 4.198 4.078 4.355 . 0 0 "[ . 1 . 2]" 1
1891 1 77 ALA HA 1 78 VAL H . . 2.710 2.257 2.225 2.307 . 0 0 "[ . 1 . 2]" 1
1892 1 77 ALA HA 1 78 VAL MG1 . . 4.520 3.650 3.517 3.918 . 0 0 "[ . 1 . 2]" 1
1893 1 77 ALA HA 1 78 VAL MG2 . . 4.150 3.620 3.490 3.757 . 0 0 "[ . 1 . 2]" 1
1894 1 77 ALA MB 1 78 VAL H . . 3.420 2.817 2.621 2.902 . 0 0 "[ . 1 . 2]" 1
1895 1 77 ALA MB 1 78 VAL HA . . 4.830 3.868 3.801 3.938 . 0 0 "[ . 1 . 2]" 1
1896 1 77 ALA MB 1 80 LEU H . . 5.280 4.919 4.827 5.072 . 0 0 "[ . 1 . 2]" 1
1897 1 77 ALA MB 1 80 LEU MD1 . . 3.140 2.263 2.192 2.340 . 0 0 "[ . 1 . 2]" 1
1898 1 77 ALA MB 1 80 LEU HG . . 4.660 4.499 4.442 4.558 . 0 0 "[ . 1 . 2]" 1
1899 1 78 VAL H 1 78 VAL MG1 . . 3.380 3.163 3.027 3.297 . 0 0 "[ . 1 . 2]" 1
1900 1 78 VAL H 1 78 VAL MG2 . . 2.800 2.259 2.136 2.428 . 0 0 "[ . 1 . 2]" 1
1901 1 78 VAL H 1 80 LEU HB2 . . 5.500 5.364 5.264 5.458 . 0 0 "[ . 1 . 2]" 1
1902 1 78 VAL H 1 80 LEU MD1 . . 4.460 3.793 3.711 3.891 . 0 0 "[ . 1 . 2]" 1
1903 1 78 VAL HA 1 78 VAL MG1 . . 3.180 2.286 2.175 2.363 . 0 0 "[ . 1 . 2]" 1
1904 1 78 VAL HA 1 79 LYS H . . 3.160 2.373 2.312 2.447 . 0 0 "[ . 1 . 2]" 1
1905 1 78 VAL HA 1 79 LYS HA . . 4.520 4.467 4.445 4.491 . 0 0 "[ . 1 . 2]" 1
1906 1 78 VAL HA 1 79 LYS QE . . 4.830 4.512 3.950 4.834 0.004 13 0 "[ . 1 . 2]" 1
1907 1 78 VAL HA 1 80 LEU H . . 4.240 3.735 3.681 3.793 . 0 0 "[ . 1 . 2]" 1
1908 1 78 VAL HA 1 80 LEU MD1 . . 4.180 4.138 4.053 4.186 0.006 16 0 "[ . 1 . 2]" 1
1909 1 78 VAL HB 1 79 LYS H . . 2.990 2.450 2.281 2.604 . 0 0 "[ . 1 . 2]" 1
1910 1 78 VAL HB 1 79 LYS HA . . 4.530 4.437 4.359 4.511 . 0 0 "[ . 1 . 2]" 1
1911 1 78 VAL HB 1 79 LYS HD2 . . 5.500 4.897 4.109 5.369 . 0 0 "[ . 1 . 2]" 1
1912 1 78 VAL HB 1 79 LYS HD3 . . 5.500 4.898 3.912 5.248 . 0 0 "[ . 1 . 2]" 1
1913 1 78 VAL HB 1 79 LYS QG . . 3.830 2.512 2.379 2.590 . 0 0 "[ . 1 . 2]" 1
1914 1 78 VAL MG1 1 79 LYS H . . 3.910 3.629 3.544 3.694 . 0 0 "[ . 1 . 2]" 1
1915 1 78 VAL MG1 1 80 LEU H . . 5.500 5.427 5.366 5.473 . 0 0 "[ . 1 . 2]" 1
1916 1 78 VAL MG2 1 79 LYS H . . 3.770 3.550 3.369 3.680 . 0 0 "[ . 1 . 2]" 1
1917 1 78 VAL MG2 1 79 LYS HA . . 4.950 4.762 4.569 4.895 . 0 0 "[ . 1 . 2]" 1
1918 1 78 VAL MG2 1 79 LYS HB2 . . 3.760 3.372 3.188 3.524 . 0 0 "[ . 1 . 2]" 1
1919 1 78 VAL MG2 1 79 LYS HB3 . . 4.800 4.660 4.459 4.812 0.012 12 0 "[ . 1 . 2]" 1
1920 1 78 VAL MG2 1 79 LYS HE2 . . 4.400 3.652 1.952 4.406 0.006 1 0 "[ . 1 . 2]" 1
1921 1 78 VAL MG2 1 79 LYS HE3 . . 4.400 3.582 2.011 4.412 0.012 2 0 "[ . 1 . 2]" 1
1922 1 78 VAL MG2 1 79 LYS QG . . 3.380 2.690 1.977 3.191 . 0 0 "[ . 1 . 2]" 1
1923 1 78 VAL MG2 1 80 LEU H . . 5.500 5.098 4.999 5.212 . 0 0 "[ . 1 . 2]" 1
1924 1 79 LYS H 1 79 LYS HB2 . . 4.030 3.575 3.511 3.653 . 0 0 "[ . 1 . 2]" 1
1925 1 79 LYS H 1 79 LYS HB3 . . 4.140 3.950 3.901 4.009 . 0 0 "[ . 1 . 2]" 1
1926 1 79 LYS H 1 79 LYS QD . . 5.340 3.875 2.598 4.653 . 0 0 "[ . 1 . 2]" 1
1927 1 79 LYS H 1 79 LYS QG . . 3.270 2.491 2.328 2.664 . 0 0 "[ . 1 . 2]" 1
1928 1 79 LYS H 1 80 LEU H . . 3.250 2.946 2.854 3.043 . 0 0 "[ . 1 . 2]" 1
1929 1 79 LYS H 1 80 LEU MD1 . . 5.010 5.005 4.945 5.038 0.028 2 0 "[ . 1 . 2]" 1
1930 1 79 LYS HA 1 79 LYS QD . . 4.700 3.137 2.024 4.161 . 0 0 "[ . 1 . 2]" 1
1931 1 79 LYS HA 1 79 LYS HG2 . . 3.870 2.998 2.725 3.311 . 0 0 "[ . 1 . 2]" 1
1932 1 79 LYS HA 1 79 LYS QG . . 3.210 2.818 2.522 3.132 . 0 0 "[ . 1 . 2]" 1
1933 1 79 LYS HA 1 79 LYS HG3 . . 3.870 3.493 2.873 3.886 0.016 9 0 "[ . 1 . 2]" 1
1934 1 79 LYS HA 1 80 LEU H . . 2.890 2.684 2.654 2.727 . 0 0 "[ . 1 . 2]" 1
1935 1 79 LYS HA 1 80 LEU HB3 . . 5.500 5.385 5.370 5.397 . 0 0 "[ . 1 . 2]" 1
1936 1 79 LYS HA 1 80 LEU MD1 . . 5.500 5.505 5.467 5.523 0.023 19 0 "[ . 1 . 2]" 1
1937 1 79 LYS HB2 1 79 LYS QE . . 4.820 3.492 2.118 4.252 . 0 0 "[ . 1 . 2]" 1
1938 1 79 LYS HB2 1 80 LEU H . . 4.600 4.302 4.270 4.324 . 0 0 "[ . 1 . 2]" 1
1939 1 79 LYS HB3 1 79 LYS HE2 . . 4.840 4.058 3.412 4.800 . 0 0 "[ . 1 . 2]" 1
1940 1 79 LYS HB3 1 79 LYS QE . . 4.210 3.683 3.306 4.183 . 0 0 "[ . 1 . 2]" 1
1941 1 79 LYS HB3 1 79 LYS HE3 . . 4.840 4.413 3.530 4.659 . 0 0 "[ . 1 . 2]" 1
1942 1 79 LYS HB3 1 80 LEU H . . 4.720 4.457 4.429 4.493 . 0 0 "[ . 1 . 2]" 1
1943 1 79 LYS QE 1 79 LYS QG . . 3.130 2.168 2.050 2.291 . 0 0 "[ . 1 . 2]" 1
1944 1 79 LYS QG 1 80 LEU H . . 5.010 4.607 4.479 4.725 . 0 0 "[ . 1 . 2]" 1
1945 1 80 LEU H 1 80 LEU HB2 . . 2.900 2.082 2.070 2.092 . 0 0 "[ . 1 . 2]" 1
1946 1 80 LEU H 1 80 LEU HB3 . . 3.150 3.070 3.055 3.093 . 0 0 "[ . 1 . 2]" 1
1947 1 80 LEU H 1 80 LEU MD1 . . 3.300 3.289 3.234 3.314 0.014 16 0 "[ . 1 . 2]" 1
1948 1 80 LEU H 1 80 LEU MD2 . . 4.410 4.380 4.357 4.396 . 0 0 "[ . 1 . 2]" 1
1949 1 80 LEU H 1 80 LEU HG . . 4.320 4.310 4.290 4.325 0.005 2 0 "[ . 1 . 2]" 1
1950 1 80 LEU H 1 81 VAL H . . 5.500 4.637 4.630 4.641 . 0 0 "[ . 1 . 2]" 1
1951 1 80 LEU HA 1 80 LEU MD1 . . 3.640 2.755 2.723 2.791 . 0 0 "[ . 1 . 2]" 1
1952 1 80 LEU HA 1 80 LEU MD2 . . 4.150 3.668 3.651 3.683 . 0 0 "[ . 1 . 2]" 1
1953 1 80 LEU HA 1 80 LEU HG . . 3.560 2.283 2.264 2.297 . 0 0 "[ . 1 . 2]" 1
1954 1 80 LEU HA 1 81 VAL H . . 2.650 2.298 2.256 2.349 . 0 0 "[ . 1 . 2]" 1
1955 1 80 LEU HA 1 81 VAL HA . . 4.940 4.499 4.474 4.532 . 0 0 "[ . 1 . 2]" 1
1956 1 80 LEU HA 1 81 VAL QG . . 4.160 3.215 2.952 3.602 . 0 0 "[ . 1 . 2]" 1
1957 1 80 LEU HB2 1 80 LEU MD1 . . 3.330 2.116 2.090 2.140 . 0 0 "[ . 1 . 2]" 1
1958 1 80 LEU HB2 1 80 LEU MD2 . . 3.590 2.728 2.677 2.780 . 0 0 "[ . 1 . 2]" 1
1959 1 80 LEU HB2 1 81 VAL H . . 4.220 4.172 4.095 4.235 0.015 17 0 "[ . 1 . 2]" 1
1960 1 80 LEU HB3 1 80 LEU MD2 . . 3.000 2.033 1.958 2.163 . 0 0 "[ . 1 . 2]" 1
1961 1 80 LEU HB3 1 81 VAL H . . 3.560 3.270 3.145 3.382 . 0 0 "[ . 1 . 2]" 1
1962 1 80 LEU HB3 1 81 VAL QG . . 5.440 4.284 4.083 4.764 . 0 0 "[ . 1 . 2]" 1
1963 1 80 LEU MD1 1 81 VAL H . . 4.340 3.989 3.930 4.030 . 0 0 "[ . 1 . 2]" 1
1964 1 80 LEU MD2 1 81 VAL H . . 4.310 3.392 3.276 3.515 . 0 0 "[ . 1 . 2]" 1
1965 1 80 LEU HG 1 81 VAL H . . 3.900 2.468 2.361 2.551 . 0 0 "[ . 1 . 2]" 1
1966 1 81 VAL H 1 81 VAL HB . . 3.950 3.819 3.384 3.981 0.031 2 0 "[ . 1 . 2]" 1
1967 1 81 VAL H 1 81 VAL QG . . 3.340 2.307 2.188 2.470 . 0 0 "[ . 1 . 2]" 1
1968 1 81 VAL H 1 82 LYS H . . 4.310 4.053 3.938 4.170 . 0 0 "[ . 1 . 2]" 1
1969 1 81 VAL HA 1 81 VAL MG1 . . 3.410 2.444 2.024 3.200 . 0 0 "[ . 1 . 2]" 1
1970 1 81 VAL HA 1 81 VAL QG . . 2.760 2.199 2.001 2.417 . 0 0 "[ . 1 . 2]" 1
1971 1 81 VAL HA 1 81 VAL MG2 . . 3.410 2.982 2.217 3.202 . 0 0 "[ . 1 . 2]" 1
1972 1 81 VAL HA 1 82 LYS H . . 2.640 2.146 2.139 2.163 . 0 0 "[ . 1 . 2]" 1
1973 1 81 VAL HA 1 82 LYS HB2 . . 4.400 4.271 4.244 4.307 . 0 0 "[ . 1 . 2]" 1
1974 1 81 VAL HB 1 82 LYS H . . 4.390 3.563 3.188 4.301 . 0 0 "[ . 1 . 2]" 1
1975 1 81 VAL QG 1 82 LYS H . . 3.670 3.275 2.463 3.588 . 0 0 "[ . 1 . 2]" 1
1976 1 81 VAL QG 1 82 LYS HB2 . . 5.440 4.857 4.077 5.151 . 0 0 "[ . 1 . 2]" 1
1977 1 81 VAL QG 1 82 LYS HB3 . . 5.440 4.901 3.856 5.284 . 0 0 "[ . 1 . 2]" 1
1978 1 81 VAL MG1 1 82 LYS H . . 4.340 3.880 3.553 4.158 . 0 0 "[ . 1 . 2]" 1
1979 1 81 VAL MG2 1 82 LYS H . . 4.340 3.739 2.488 4.288 . 0 0 "[ . 1 . 2]" 1
1980 1 82 LYS H 1 82 LYS HB2 . . 2.820 2.219 2.194 2.278 . 0 0 "[ . 1 . 2]" 1
1981 1 82 LYS H 1 82 LYS HG2 . . 4.880 4.630 4.612 4.637 . 0 0 "[ . 1 . 2]" 1
1982 1 82 LYS H 1 82 LYS HG3 . . 4.530 4.192 4.163 4.263 . 0 0 "[ . 1 . 2]" 1
1983 1 82 LYS H 1 83 ILE H . . 4.600 4.541 4.480 4.578 . 0 0 "[ . 1 . 2]" 1
1984 1 82 LYS HA 1 82 LYS HG2 . . 4.150 3.163 3.046 3.218 . 0 0 "[ . 1 . 2]" 1
1985 1 82 LYS HA 1 82 LYS HG3 . . 3.900 2.194 2.175 2.236 . 0 0 "[ . 1 . 2]" 1
1986 1 82 LYS HA 1 83 ILE H . . 2.890 2.153 2.140 2.170 . 0 0 "[ . 1 . 2]" 1
1987 1 82 LYS HA 1 83 ILE HB . . 4.950 4.879 4.768 4.951 0.001 9 0 "[ . 1 . 2]" 1
1988 1 82 LYS HA 1 83 ILE HG12 . . 4.830 4.220 4.024 4.514 . 0 0 "[ . 1 . 2]" 1
1989 1 82 LYS HA 1 83 ILE MG . . 5.500 5.425 5.389 5.459 . 0 0 "[ . 1 . 2]" 1
1990 1 82 LYS HB2 1 82 LYS HD2 . . 3.320 2.542 2.379 2.702 . 0 0 "[ . 1 . 2]" 1
1991 1 82 LYS HB2 1 82 LYS QE . . 4.070 3.981 3.917 4.056 . 0 0 "[ . 1 . 2]" 1
1992 1 82 LYS HB3 1 83 ILE H . . 4.220 3.946 3.839 4.095 . 0 0 "[ . 1 . 2]" 1
1993 1 82 LYS QE 1 82 LYS HG2 . . 3.410 2.368 2.159 2.610 . 0 0 "[ . 1 . 2]" 1
1994 1 82 LYS QE 1 82 LYS HG3 . . 3.590 2.590 2.459 2.901 . 0 0 "[ . 1 . 2]" 1
1995 1 82 LYS QE 1 83 ILE H . . 5.340 5.009 4.800 5.318 . 0 0 "[ . 1 . 2]" 1
1996 1 82 LYS HE2 1 82 LYS HG2 . . 4.000 2.682 2.314 3.631 . 0 0 "[ . 1 . 2]" 1
1997 1 82 LYS HE3 1 82 LYS HG2 . . 4.000 3.021 2.181 3.663 . 0 0 "[ . 1 . 2]" 1
1998 1 82 LYS HG2 1 83 ILE H . . 4.260 3.451 3.257 3.703 . 0 0 "[ . 1 . 2]" 1
1999 1 82 LYS HG2 1 84 SER H . . 3.670 3.077 2.850 3.339 . 0 0 "[ . 1 . 2]" 1
2000 1 82 LYS HG3 1 83 ILE H . . 3.740 3.135 3.011 3.315 . 0 0 "[ . 1 . 2]" 1
2001 1 82 LYS HG3 1 83 ILE HG13 . . 4.950 4.649 4.485 4.813 . 0 0 "[ . 1 . 2]" 1
2002 1 82 LYS HG3 1 84 SER H . . 4.220 3.947 3.640 4.147 . 0 0 "[ . 1 . 2]" 1
2003 1 83 ILE H 1 83 ILE HB . . 3.300 2.758 2.668 2.848 . 0 0 "[ . 1 . 2]" 1
2004 1 83 ILE H 1 83 ILE MD . . 4.080 3.655 3.588 3.753 . 0 0 "[ . 1 . 2]" 1
2005 1 83 ILE H 1 83 ILE HG12 . . 3.150 2.614 2.402 2.862 . 0 0 "[ . 1 . 2]" 1
2006 1 83 ILE H 1 83 ILE HG13 . . 3.190 2.017 1.901 2.150 . 0 0 "[ . 1 . 2]" 1
2007 1 83 ILE H 1 83 ILE MG . . 3.860 3.745 3.714 3.769 . 0 0 "[ . 1 . 2]" 1
2008 1 83 ILE HA 1 83 ILE HG12 . . 4.000 2.578 2.495 2.657 . 0 0 "[ . 1 . 2]" 1
2009 1 83 ILE HA 1 83 ILE HG13 . . 4.050 3.471 3.325 3.551 . 0 0 "[ . 1 . 2]" 1
2010 1 83 ILE HA 1 83 ILE MG . . 3.160 2.297 2.226 2.356 . 0 0 "[ . 1 . 2]" 1
2011 1 83 ILE HB 1 83 ILE MD . . 3.480 2.570 2.476 2.613 . 0 0 "[ . 1 . 2]" 1
2012 1 83 ILE HB 1 84 SER H . . 3.220 2.233 2.042 2.449 . 0 0 "[ . 1 . 2]" 1
2013 1 83 ILE HB 1 84 SER QB . . 5.070 3.550 3.290 3.891 . 0 0 "[ . 1 . 2]" 1
2014 1 83 ILE MD 1 84 SER H . . 4.580 4.428 4.296 4.570 . 0 0 "[ . 1 . 2]" 1
2015 1 83 ILE HG12 1 83 ILE MG . . 3.550 2.523 2.424 2.568 . 0 0 "[ . 1 . 2]" 1
2016 1 83 ILE MG 1 84 SER H . . 3.780 3.501 3.373 3.750 . 0 0 "[ . 1 . 2]" 1
2017 1 83 ILE MG 1 84 SER HA . . 4.740 3.914 3.679 4.303 . 0 0 "[ . 1 . 2]" 1
2018 1 83 ILE MG 1 84 SER QB . . 4.630 4.016 3.250 4.411 . 0 0 "[ . 1 . 2]" 1
2019 1 84 SER H 1 84 SER HB2 . . 3.730 2.901 2.213 3.690 . 0 0 "[ . 1 . 2]" 1
2020 1 84 SER H 1 84 SER QB . . 3.110 2.447 2.150 2.764 . 0 0 "[ . 1 . 2]" 1
2021 1 84 SER H 1 84 SER HB3 . . 3.730 2.958 2.428 3.708 . 0 0 "[ . 1 . 2]" 1
2022 1 84 SER HB2 1 85 GLY H . . 5.500 3.945 2.748 4.580 . 0 0 "[ . 1 . 2]" 1
2023 1 84 SER HB3 1 85 GLY H . . 5.500 3.846 2.364 4.453 . 0 0 "[ . 1 . 2]" 1
2024 1 85 GLY H 1 86 PRO HA . . 4.570 4.367 4.157 4.666 0.096 10 0 "[ . 1 . 2]" 1
2025 1 85 GLY QA 1 86 PRO QG . . 4.120 3.747 3.642 3.896 . 0 0 "[ . 1 . 2]" 1
2026 1 86 PRO HA 1 87 SER H . . 3.250 2.354 2.152 3.284 0.034 20 0 "[ . 1 . 2]" 1
2027 1 86 PRO QB 1 87 SER H . . 3.830 3.180 2.340 3.737 . 0 0 "[ . 1 . 2]" 1
2028 1 87 SER H 1 87 SER QB . . 3.670 2.558 2.186 3.268 . 0 0 "[ . 1 . 2]" 1
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