NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
617685 |
5mww   |
34089 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5mww
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 1869
_Distance_constraint_stats_list.Viol_count 2621
_Distance_constraint_stats_list.Viol_total 2606.833
_Distance_constraint_stats_list.Viol_max 0.275
_Distance_constraint_stats_list.Viol_rms 0.0170
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0035
_Distance_constraint_stats_list.Viol_average_violations_only 0.0497
_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 3 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 4 GLN 2.104 0.187 1 0 "[ . 1 . 2]"
1 5 THR 0.591 0.159 7 0 "[ . 1 . 2]"
1 7 GLU 0.613 0.178 6 0 "[ . 1 . 2]"
1 8 THR 2.869 0.217 9 0 "[ . 1 . 2]"
1 9 GLU 3.050 0.137 6 0 "[ . 1 . 2]"
1 10 LEU 5.846 0.121 15 0 "[ . 1 . 2]"
1 11 THR 5.630 0.165 19 0 "[ . 1 . 2]"
1 12 PHE 3.849 0.103 15 0 "[ . 1 . 2]"
1 13 ASP 1.819 0.109 1 0 "[ . 1 . 2]"
1 14 GLN 4.044 0.187 1 0 "[ . 1 . 2]"
1 15 VAL 11.620 0.222 14 0 "[ . 1 . 2]"
1 16 LYS 7.676 0.202 12 0 "[ . 1 . 2]"
1 17 GLU 1.275 0.070 3 0 "[ . 1 . 2]"
1 18 GLN 12.348 0.275 5 0 "[ . 1 . 2]"
1 19 LEU 6.323 0.237 14 0 "[ . 1 . 2]"
1 20 THR 3.482 0.139 19 0 "[ . 1 . 2]"
1 21 GLU 3.860 0.139 19 0 "[ . 1 . 2]"
1 22 SER 3.144 0.180 16 0 "[ . 1 . 2]"
1 23 GLY 0.855 0.083 16 0 "[ . 1 . 2]"
1 24 LYS 8.379 0.180 16 0 "[ . 1 . 2]"
1 25 LYS 1.415 0.129 12 0 "[ . 1 . 2]"
1 26 ARG 2.870 0.129 12 0 "[ . 1 . 2]"
1 27 GLY 3.743 0.106 13 0 "[ . 1 . 2]"
1 28 VAL 10.289 0.112 6 0 "[ . 1 . 2]"
1 29 LEU 5.115 0.112 6 0 "[ . 1 . 2]"
1 30 THR 7.023 0.186 13 0 "[ . 1 . 2]"
1 31 TYR 1.371 0.141 9 0 "[ . 1 . 2]"
1 32 GLU 0.123 0.051 4 0 "[ . 1 . 2]"
1 33 GLU 1.702 0.102 8 0 "[ . 1 . 2]"
1 34 ILE 2.048 0.085 20 0 "[ . 1 . 2]"
1 35 ALA 1.460 0.109 13 0 "[ . 1 . 2]"
1 36 GLU 0.368 0.069 6 0 "[ . 1 . 2]"
1 37 ARG 2.681 0.094 6 0 "[ . 1 . 2]"
1 38 MET 1.255 0.073 16 0 "[ . 1 . 2]"
1 39 SER 0.174 0.040 9 0 "[ . 1 . 2]"
1 40 SER 0.405 0.033 4 0 "[ . 1 . 2]"
1 41 PHE 3.644 0.125 6 0 "[ . 1 . 2]"
1 42 GLU 0.542 0.125 6 0 "[ . 1 . 2]"
1 43 ILE 8.578 0.136 12 0 "[ . 1 . 2]"
1 44 GLU 3.608 0.136 12 0 "[ . 1 . 2]"
1 45 SER 0.591 0.105 3 0 "[ . 1 . 2]"
1 46 ASP 0.987 0.133 15 0 "[ . 1 . 2]"
1 47 GLN 2.457 0.231 13 0 "[ . 1 . 2]"
1 48 MET 2.857 0.119 18 0 "[ . 1 . 2]"
1 49 ASP 2.101 0.113 1 0 "[ . 1 . 2]"
1 50 GLU 1.000 0.089 13 0 "[ . 1 . 2]"
1 51 TYR 4.454 0.093 12 0 "[ . 1 . 2]"
1 52 TYR 5.805 0.164 3 0 "[ . 1 . 2]"
1 53 GLU 0.002 0.002 8 0 "[ . 1 . 2]"
1 54 PHE 5.644 0.098 11 0 "[ . 1 . 2]"
1 55 LEU 1.843 0.098 11 0 "[ . 1 . 2]"
1 56 GLY 0.543 0.046 2 0 "[ . 1 . 2]"
1 57 GLU 2.445 0.105 5 0 "[ . 1 . 2]"
1 58 GLN 1.544 0.070 14 0 "[ . 1 . 2]"
1 59 GLY 1.952 0.116 1 0 "[ . 1 . 2]"
1 60 VAL 4.702 0.104 13 0 "[ . 1 . 2]"
1 61 GLU 2.231 0.165 4 0 "[ . 1 . 2]"
1 62 LEU 7.996 0.177 8 0 "[ . 1 . 2]"
1 63 ILE 7.766 0.190 12 0 "[ . 1 . 2]"
1 64 SER 6.713 0.190 12 0 "[ . 1 . 2]"
1 65 GLU 1.897 0.133 8 0 "[ . 1 . 2]"
1 66 ASN 2.442 0.133 8 0 "[ . 1 . 2]"
1 67 GLU 6.412 0.249 6 0 "[ . 1 . 2]"
1 68 GLU 4.141 0.249 6 0 "[ . 1 . 2]"
1 69 THR 5.077 0.198 5 0 "[ . 1 . 2]"
1 70 GLU 4.527 0.198 5 0 "[ . 1 . 2]"
1 71 ASP 3.806 0.153 20 0 "[ . 1 . 2]"
1 72 LEU 1.944 0.153 20 0 "[ . 1 . 2]"
1 73 GLU 0.308 0.129 16 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 3 LYS HA 1 3 LYS QG 3.720 . 3.720 2.808 2.410 3.422 . 0 0 "[ . 1 . 2]" 1
2 1 4 GLN H 1 4 GLN QG 4.980 . 4.980 3.149 1.915 4.566 . 0 0 "[ . 1 . 2]" 1
3 1 4 GLN HA 1 4 GLN QG 3.970 . 3.970 3.109 2.359 3.532 . 0 0 "[ . 1 . 2]" 1
4 1 4 GLN HA 1 5 THR MG 4.780 . 4.780 4.046 3.544 4.939 0.159 7 0 "[ . 1 . 2]" 1
5 1 4 GLN HA 1 10 LEU HB3 5.310 . 5.310 4.751 3.887 5.386 0.076 2 0 "[ . 1 . 2]" 1
6 1 4 GLN HA 1 10 LEU MD2 5.270 . 5.270 4.766 3.603 5.352 0.082 14 0 "[ . 1 . 2]" 1
7 1 4 GLN QB 1 4 GLN QE 3.390 . 3.390 2.905 1.731 3.449 0.059 16 0 "[ . 1 . 2]" 1
8 1 4 GLN QB 1 5 THR H 3.960 . 3.960 3.048 1.912 3.991 0.031 15 0 "[ . 1 . 2]" 1
9 1 4 GLN QB 1 10 LEU HA 4.390 . 4.390 2.782 1.881 4.221 . 0 0 "[ . 1 . 2]" 1
10 1 4 GLN QB 1 10 LEU HB2 4.390 . 4.390 4.143 3.943 4.422 0.032 2 0 "[ . 1 . 2]" 1
11 1 4 GLN QB 1 10 LEU HB3 3.770 . 3.770 2.689 2.367 3.073 . 0 0 "[ . 1 . 2]" 1
12 1 4 GLN QB 1 10 LEU MD2 3.070 . 3.070 2.668 2.025 3.132 0.062 15 0 "[ . 1 . 2]" 1
13 1 4 GLN QB 1 11 THR H 4.320 . 4.320 3.682 3.044 4.334 0.014 10 0 "[ . 1 . 2]" 1
14 1 4 GLN QB 1 11 THR MG 4.800 . 4.800 4.083 3.189 4.891 0.091 2 0 "[ . 1 . 2]" 1
15 1 4 GLN QB 1 14 GLN QB 3.000 . 3.000 2.705 1.935 3.118 0.118 4 0 "[ . 1 . 2]" 1
16 1 4 GLN QB 1 14 GLN QE 4.270 . 4.270 3.314 1.891 4.457 0.187 1 0 "[ . 1 . 2]" 1
17 1 4 GLN QE 1 10 LEU HA 5.130 . 5.130 4.076 1.694 5.184 0.054 1 0 "[ . 1 . 2]" 1
18 1 4 GLN QG 1 5 THR MG 5.500 . 5.500 4.878 2.564 5.554 0.054 6 0 "[ . 1 . 2]" 1
19 1 5 THR HA 1 5 THR MG 3.060 . 3.060 2.297 2.060 3.171 0.111 18 0 "[ . 1 . 2]" 1
20 1 7 GLU HA 1 7 GLU QG 3.150 . 3.150 2.591 2.288 3.328 0.178 6 0 "[ . 1 . 2]" 1
21 1 7 GLU HA 1 8 THR H 3.040 . 3.040 2.547 2.051 3.189 0.149 8 0 "[ . 1 . 2]" 1
22 1 7 GLU QB 1 8 THR H 5.390 . 5.390 2.980 1.781 3.985 . 0 0 "[ . 1 . 2]" 1
23 1 7 GLU QG 1 8 THR H 4.690 . 4.690 4.007 3.156 4.743 0.053 4 0 "[ . 1 . 2]" 1
24 1 8 THR H 1 8 THR HB 4.010 . 4.010 3.076 2.555 3.778 . 0 0 "[ . 1 . 2]" 1
25 1 8 THR H 1 8 THR MG 3.880 . 3.880 3.587 2.083 3.928 0.048 2 0 "[ . 1 . 2]" 1
26 1 8 THR H 1 9 GLU H 4.110 . 4.110 3.136 2.114 4.241 0.131 15 0 "[ . 1 . 2]" 1
27 1 8 THR HA 1 8 THR MG 2.890 . 2.890 2.356 2.190 3.107 0.217 9 0 "[ . 1 . 2]" 1
28 1 8 THR HA 1 9 GLU H 3.020 . 3.020 2.757 1.974 3.152 0.132 7 0 "[ . 1 . 2]" 1
29 1 8 THR HA 1 9 GLU QB 4.970 . 4.970 4.883 4.387 5.107 0.137 6 0 "[ . 1 . 2]" 1
30 1 8 THR HA 1 9 GLU QG 5.110 . 5.110 4.625 3.656 5.210 0.100 19 0 "[ . 1 . 2]" 1
31 1 8 THR HA 1 10 LEU MD1 5.500 . 5.500 4.777 3.253 5.488 . 0 0 "[ . 1 . 2]" 1
32 1 8 THR HA 1 10 LEU HG 5.500 . 5.500 4.845 3.664 5.581 0.081 15 0 "[ . 1 . 2]" 1
33 1 8 THR HB 1 9 GLU H 4.600 . 4.600 3.893 2.995 4.535 . 0 0 "[ . 1 . 2]" 1
34 1 8 THR MG 1 9 GLU H 4.260 . 4.260 3.489 1.669 4.313 0.053 19 0 "[ . 1 . 2]" 1
35 1 8 THR MG 1 9 GLU HA 5.500 . 5.500 4.387 3.854 5.502 0.002 3 0 "[ . 1 . 2]" 1
36 1 9 GLU H 1 9 GLU HB2 4.040 . 4.040 3.013 2.296 3.992 . 0 0 "[ . 1 . 2]" 1
37 1 9 GLU H 1 9 GLU QB 3.200 . 3.200 2.681 2.270 3.295 0.095 15 0 "[ . 1 . 2]" 1
38 1 9 GLU H 1 9 GLU HB3 4.040 . 4.040 3.487 2.649 4.077 0.037 15 0 "[ . 1 . 2]" 1
39 1 9 GLU H 1 9 GLU QG 3.990 . 3.990 2.666 2.015 3.568 . 0 0 "[ . 1 . 2]" 1
40 1 9 GLU H 1 10 LEU H 4.740 . 4.740 4.288 3.809 4.638 . 0 0 "[ . 1 . 2]" 1
41 1 9 GLU H 1 10 LEU MD1 4.810 . 4.810 4.418 3.132 4.778 . 0 0 "[ . 1 . 2]" 1
42 1 9 GLU H 1 10 LEU HG 5.000 . 5.000 4.531 3.369 5.009 0.009 20 0 "[ . 1 . 2]" 1
43 1 9 GLU HA 1 9 GLU QG 3.390 . 3.390 2.914 2.244 3.482 0.092 4 0 "[ . 1 . 2]" 1
44 1 9 GLU HA 1 10 LEU H 2.620 . 2.620 2.161 1.962 2.401 . 0 0 "[ . 1 . 2]" 1
45 1 9 GLU HA 1 10 LEU HB2 5.340 . 5.340 4.899 4.583 5.193 . 0 0 "[ . 1 . 2]" 1
46 1 9 GLU HA 1 10 LEU MD1 4.620 . 4.620 2.646 2.143 2.953 . 0 0 "[ . 1 . 2]" 1
47 1 9 GLU HA 1 10 LEU MD2 5.340 . 5.340 5.039 4.786 5.175 . 0 0 "[ . 1 . 2]" 1
48 1 9 GLU HA 1 10 LEU HG 3.820 . 3.820 3.826 3.595 3.880 0.060 8 0 "[ . 1 . 2]" 1
49 1 9 GLU HA 1 15 VAL MG2 5.500 . 5.500 5.179 4.777 5.531 0.031 11 0 "[ . 1 . 2]" 1
50 1 9 GLU QB 1 10 LEU H 3.650 . 3.650 3.012 2.446 3.398 . 0 0 "[ . 1 . 2]" 1
51 1 10 LEU H 1 10 LEU HB2 3.280 . 3.280 2.937 2.766 3.247 . 0 0 "[ . 1 . 2]" 1
52 1 10 LEU H 1 10 LEU HB3 3.910 . 3.910 3.743 3.637 3.831 . 0 0 "[ . 1 . 2]" 1
53 1 10 LEU H 1 10 LEU MD1 3.560 . 3.560 1.819 1.572 2.030 . 0 0 "[ . 1 . 2]" 1
54 1 10 LEU H 1 10 LEU MD2 4.160 . 4.160 4.133 3.947 4.235 0.075 16 0 "[ . 1 . 2]" 1
55 1 10 LEU H 1 10 LEU HG 3.260 . 3.260 3.099 2.801 3.301 0.041 12 0 "[ . 1 . 2]" 1
56 1 10 LEU H 1 11 THR H 4.840 . 4.840 4.389 4.317 4.494 . 0 0 "[ . 1 . 2]" 1
57 1 10 LEU H 1 15 VAL MG2 4.120 . 4.120 3.679 3.427 3.861 . 0 0 "[ . 1 . 2]" 1
58 1 10 LEU HA 1 10 LEU MD1 4.370 . 4.370 3.564 3.465 3.632 . 0 0 "[ . 1 . 2]" 1
59 1 10 LEU HA 1 10 LEU MD2 3.770 . 3.770 3.691 3.547 3.785 0.015 2 0 "[ . 1 . 2]" 1
60 1 10 LEU HA 1 10 LEU HG 3.580 . 3.580 2.910 2.806 3.122 . 0 0 "[ . 1 . 2]" 1
61 1 10 LEU HA 1 11 THR H 2.920 . 2.920 2.552 2.403 2.700 . 0 0 "[ . 1 . 2]" 1
62 1 10 LEU HA 1 11 THR MG 4.030 . 4.030 3.319 3.163 3.466 . 0 0 "[ . 1 . 2]" 1
63 1 10 LEU HA 1 14 GLN QB 4.190 . 4.190 3.372 3.059 3.656 . 0 0 "[ . 1 . 2]" 1
64 1 10 LEU HA 1 14 GLN HG3 4.710 . 4.710 3.546 3.172 4.177 . 0 0 "[ . 1 . 2]" 1
65 1 10 LEU HA 1 15 VAL MG2 5.300 . 5.300 4.445 4.320 4.544 . 0 0 "[ . 1 . 2]" 1
66 1 10 LEU HB2 1 10 LEU MD1 2.650 . 2.650 2.218 2.141 2.324 . 0 0 "[ . 1 . 2]" 1
67 1 10 LEU HB2 1 11 THR H 4.120 . 4.120 2.817 2.689 2.964 . 0 0 "[ . 1 . 2]" 1
68 1 10 LEU HB2 1 14 GLN HA 5.300 . 5.300 5.234 4.925 5.328 0.028 18 0 "[ . 1 . 2]" 1
69 1 10 LEU HB2 1 14 GLN QB 3.810 . 3.810 2.543 2.257 2.741 . 0 0 "[ . 1 . 2]" 1
70 1 10 LEU HB2 1 15 VAL H 4.730 . 4.730 3.540 3.316 3.742 . 0 0 "[ . 1 . 2]" 1
71 1 10 LEU HB2 1 15 VAL HA 5.470 . 5.470 3.809 3.578 4.061 . 0 0 "[ . 1 . 2]" 1
72 1 10 LEU HB2 1 15 VAL MG2 2.970 . 2.970 1.937 1.864 2.079 . 0 0 "[ . 1 . 2]" 1
73 1 10 LEU HB2 1 41 PHE HZ 4.350 . 4.350 3.488 3.298 3.690 . 0 0 "[ . 1 . 2]" 1
74 1 10 LEU HB3 1 10 LEU MD1 3.220 . 3.220 3.141 3.095 3.196 . 0 0 "[ . 1 . 2]" 1
75 1 10 LEU HB3 1 10 LEU MD2 2.740 . 2.740 2.172 2.076 2.236 . 0 0 "[ . 1 . 2]" 1
76 1 10 LEU HB3 1 11 THR H 3.880 . 3.880 2.332 2.168 2.527 . 0 0 "[ . 1 . 2]" 1
77 1 10 LEU HB3 1 11 THR HA 5.360 . 5.360 4.850 4.730 5.078 . 0 0 "[ . 1 . 2]" 1
78 1 10 LEU HB3 1 11 THR MG 4.180 . 4.180 4.095 3.792 4.249 0.069 5 0 "[ . 1 . 2]" 1
79 1 10 LEU HB3 1 14 GLN H 5.490 . 5.490 4.393 4.092 4.564 . 0 0 "[ . 1 . 2]" 1
80 1 10 LEU HB3 1 14 GLN QB 3.750 . 3.750 1.830 1.709 1.984 . 0 0 "[ . 1 . 2]" 1
81 1 10 LEU HB3 1 14 GLN QE 5.340 . 5.340 4.382 2.840 5.298 . 0 0 "[ . 1 . 2]" 1
82 1 10 LEU HB3 1 14 GLN HG3 4.620 . 4.620 2.965 2.755 3.265 . 0 0 "[ . 1 . 2]" 1
83 1 10 LEU HB3 1 15 VAL H 5.500 . 5.500 4.093 3.738 4.376 . 0 0 "[ . 1 . 2]" 1
84 1 10 LEU HB3 1 15 VAL HA 5.500 . 5.500 4.558 4.242 4.834 . 0 0 "[ . 1 . 2]" 1
85 1 10 LEU HB3 1 15 VAL MG2 3.790 . 3.790 3.322 3.152 3.470 . 0 0 "[ . 1 . 2]" 1
86 1 10 LEU HB3 1 41 PHE HZ 5.090 . 5.090 4.940 4.751 5.129 0.039 2 0 "[ . 1 . 2]" 1
87 1 10 LEU MD1 1 11 THR H 5.080 . 5.080 4.475 4.394 4.553 . 0 0 "[ . 1 . 2]" 1
88 1 10 LEU MD1 1 11 THR HA 5.370 . 5.370 5.441 5.323 5.491 0.121 15 0 "[ . 1 . 2]" 1
89 1 10 LEU MD1 1 14 GLN QB 3.910 . 3.910 3.924 3.832 3.992 0.082 19 0 "[ . 1 . 2]" 1
90 1 10 LEU MD1 1 15 VAL HA 3.770 . 3.770 3.672 3.384 3.825 0.055 17 0 "[ . 1 . 2]" 1
91 1 10 LEU MD1 1 15 VAL MG2 2.720 . 2.720 1.998 1.845 2.125 . 0 0 "[ . 1 . 2]" 1
92 1 10 LEU MD1 1 18 GLN HE21 3.800 . 3.800 3.039 2.500 3.826 0.026 13 0 "[ . 1 . 2]" 1
93 1 10 LEU MD1 1 18 GLN QE 3.320 . 3.320 2.334 2.061 2.790 . 0 0 "[ . 1 . 2]" 1
94 1 10 LEU MD1 1 18 GLN HE22 3.800 . 3.800 2.439 2.127 2.867 . 0 0 "[ . 1 . 2]" 1
95 1 10 LEU MD1 1 18 GLN QG 4.800 . 4.800 4.417 4.046 4.802 0.002 5 0 "[ . 1 . 2]" 1
96 1 10 LEU MD1 1 41 PHE HZ 4.850 . 4.850 4.076 3.863 4.290 . 0 0 "[ . 1 . 2]" 1
97 1 10 LEU MD2 1 11 THR H 4.100 . 4.100 4.077 3.905 4.155 0.055 2 0 "[ . 1 . 2]" 1
98 1 10 LEU MD2 1 11 THR MG 5.500 . 5.500 5.292 4.970 5.497 . 0 0 "[ . 1 . 2]" 1
99 1 10 LEU MD2 1 14 GLN QB 3.160 . 3.160 2.384 2.224 2.561 . 0 0 "[ . 1 . 2]" 1
100 1 10 LEU MD2 1 14 GLN HG3 4.280 . 4.280 3.991 3.750 4.318 0.038 2 0 "[ . 1 . 2]" 1
101 1 10 LEU MD2 1 15 VAL HA 4.640 . 4.640 2.877 2.341 3.237 . 0 0 "[ . 1 . 2]" 1
102 1 10 LEU MD2 1 15 VAL MG2 3.260 . 3.260 2.772 2.468 2.949 . 0 0 "[ . 1 . 2]" 1
103 1 10 LEU MD2 1 18 GLN HE21 3.840 . 3.840 2.459 1.856 3.462 . 0 0 "[ . 1 . 2]" 1
104 1 10 LEU MD2 1 18 GLN QE 3.340 . 3.340 2.304 1.831 3.066 . 0 0 "[ . 1 . 2]" 1
105 1 10 LEU MD2 1 18 GLN HE22 3.840 . 3.840 2.868 2.322 3.422 . 0 0 "[ . 1 . 2]" 1
106 1 10 LEU MD2 1 18 GLN QG 5.180 . 5.180 3.776 3.386 4.122 . 0 0 "[ . 1 . 2]" 1
107 1 10 LEU MD2 1 37 ARG QD 5.340 . 5.340 5.338 5.029 5.421 0.081 7 0 "[ . 1 . 2]" 1
108 1 10 LEU MD2 1 41 PHE HZ 5.500 . 5.500 5.323 5.022 5.501 0.001 19 0 "[ . 1 . 2]" 1
109 1 10 LEU HG 1 11 THR H 5.500 . 5.500 4.614 4.532 4.746 . 0 0 "[ . 1 . 2]" 1
110 1 10 LEU HG 1 14 GLN QB 4.570 . 4.570 3.946 3.721 4.115 . 0 0 "[ . 1 . 2]" 1
111 1 10 LEU HG 1 15 VAL MG2 4.270 . 4.270 4.168 4.040 4.290 0.020 7 0 "[ . 1 . 2]" 1
112 1 11 THR H 1 11 THR MG 3.030 . 3.030 2.285 2.069 2.478 . 0 0 "[ . 1 . 2]" 1
113 1 11 THR H 1 14 GLN H 4.770 . 4.770 3.169 2.968 3.349 . 0 0 "[ . 1 . 2]" 1
114 1 11 THR H 1 14 GLN HA 4.920 . 4.920 4.575 4.437 4.768 . 0 0 "[ . 1 . 2]" 1
115 1 11 THR H 1 14 GLN QB 3.480 . 3.480 1.797 1.655 2.024 . 0 0 "[ . 1 . 2]" 1
116 1 11 THR H 1 14 GLN HG2 4.790 . 4.790 2.717 2.124 3.278 . 0 0 "[ . 1 . 2]" 1
117 1 11 THR H 1 14 GLN HG3 4.270 . 4.270 2.518 2.220 3.062 . 0 0 "[ . 1 . 2]" 1
118 1 11 THR H 1 15 VAL H 4.620 . 4.620 3.867 3.759 4.077 . 0 0 "[ . 1 . 2]" 1
119 1 11 THR H 1 15 VAL MG2 4.200 . 4.200 3.732 3.644 3.831 . 0 0 "[ . 1 . 2]" 1
120 1 11 THR HA 1 11 THR MG 2.980 . 2.980 2.492 2.384 2.629 . 0 0 "[ . 1 . 2]" 1
121 1 11 THR HA 1 12 PHE H 3.150 . 3.150 2.536 2.484 2.607 . 0 0 "[ . 1 . 2]" 1
122 1 11 THR HA 1 12 PHE HA 4.890 . 4.890 4.232 4.139 4.309 . 0 0 "[ . 1 . 2]" 1
123 1 11 THR HA 1 12 PHE HB2 5.480 . 5.480 4.721 4.577 4.815 . 0 0 "[ . 1 . 2]" 1
124 1 11 THR HA 1 12 PHE HB3 5.130 . 5.130 5.002 4.919 5.128 . 0 0 "[ . 1 . 2]" 1
125 1 11 THR HA 1 13 ASP H 4.440 . 4.440 4.422 4.320 4.491 0.051 2 0 "[ . 1 . 2]" 1
126 1 11 THR HA 1 15 VAL HB 5.500 . 5.500 5.591 5.534 5.645 0.145 1 0 "[ . 1 . 2]" 1
127 1 11 THR HA 1 41 PHE QE 3.790 . 3.790 2.701 2.317 2.927 . 0 0 "[ . 1 . 2]" 1
128 1 11 THR HA 1 41 PHE HZ 4.090 . 4.090 3.102 2.878 3.385 . 0 0 "[ . 1 . 2]" 1
129 1 11 THR HB 1 12 PHE H 3.400 . 3.400 2.267 2.128 2.462 . 0 0 "[ . 1 . 2]" 1
130 1 11 THR HB 1 12 PHE HA 5.160 . 5.160 4.815 4.674 5.015 . 0 0 "[ . 1 . 2]" 1
131 1 11 THR HB 1 12 PHE HB2 5.140 . 5.140 4.794 4.535 5.053 . 0 0 "[ . 1 . 2]" 1
132 1 11 THR HB 1 12 PHE HB3 4.540 . 4.540 4.221 4.055 4.462 . 0 0 "[ . 1 . 2]" 1
133 1 11 THR HB 1 13 ASP H 3.730 . 3.730 3.138 2.923 3.431 . 0 0 "[ . 1 . 2]" 1
134 1 11 THR HB 1 14 GLN H 4.960 . 4.960 3.824 3.616 4.168 . 0 0 "[ . 1 . 2]" 1
135 1 11 THR HB 1 14 GLN HG3 5.500 . 5.500 5.086 4.801 5.517 0.017 6 0 "[ . 1 . 2]" 1
136 1 11 THR MG 1 12 PHE H 3.950 . 3.950 3.770 3.632 3.945 . 0 0 "[ . 1 . 2]" 1
137 1 11 THR MG 1 13 ASP H 4.410 . 4.410 4.402 4.338 4.447 0.037 17 0 "[ . 1 . 2]" 1
138 1 11 THR MG 1 14 GLN H 4.360 . 4.360 3.974 3.710 4.211 . 0 0 "[ . 1 . 2]" 1
139 1 11 THR MG 1 14 GLN QE 4.520 . 4.520 4.423 3.746 4.685 0.165 19 0 "[ . 1 . 2]" 1
140 1 11 THR MG 1 14 GLN HG2 4.390 . 4.390 2.972 2.395 3.482 . 0 0 "[ . 1 . 2]" 1
141 1 11 THR MG 1 14 GLN HG3 4.100 . 4.100 2.931 2.393 3.752 . 0 0 "[ . 1 . 2]" 1
142 1 12 PHE H 1 12 PHE HB2 3.480 . 3.480 2.603 2.486 2.704 . 0 0 "[ . 1 . 2]" 1
143 1 12 PHE H 1 12 PHE HB3 3.510 . 3.510 2.476 2.412 2.556 . 0 0 "[ . 1 . 2]" 1
144 1 12 PHE H 1 12 PHE QD 4.400 . 4.400 4.181 4.121 4.227 . 0 0 "[ . 1 . 2]" 1
145 1 12 PHE H 1 13 ASP H 3.870 . 3.870 2.525 2.452 2.611 . 0 0 "[ . 1 . 2]" 1
146 1 12 PHE H 1 13 ASP QB 5.220 . 5.220 4.396 3.991 4.586 . 0 0 "[ . 1 . 2]" 1
147 1 12 PHE H 1 14 GLN H 5.150 . 5.150 3.886 3.787 3.996 . 0 0 "[ . 1 . 2]" 1
148 1 12 PHE H 1 15 VAL MG2 5.070 . 5.070 4.806 4.658 4.964 . 0 0 "[ . 1 . 2]" 1
149 1 12 PHE H 1 41 PHE QD 4.820 . 4.820 4.522 4.172 4.745 . 0 0 "[ . 1 . 2]" 1
150 1 12 PHE H 1 41 PHE QE 4.180 . 4.180 3.561 3.291 3.761 . 0 0 "[ . 1 . 2]" 1
151 1 12 PHE H 1 41 PHE HZ 4.740 . 4.740 3.872 3.724 3.974 . 0 0 "[ . 1 . 2]" 1
152 1 12 PHE HA 1 12 PHE QD 3.360 . 3.360 2.345 2.238 2.563 . 0 0 "[ . 1 . 2]" 1
153 1 12 PHE HA 1 12 PHE QE 4.640 . 4.640 4.487 4.368 4.608 . 0 0 "[ . 1 . 2]" 1
154 1 12 PHE HA 1 15 VAL H 4.360 . 4.360 3.419 3.306 3.508 . 0 0 "[ . 1 . 2]" 1
155 1 12 PHE HA 1 15 VAL HB 3.720 . 3.720 2.741 2.616 2.918 . 0 0 "[ . 1 . 2]" 1
156 1 12 PHE HA 1 15 VAL MG1 4.790 . 4.790 4.194 4.086 4.355 . 0 0 "[ . 1 . 2]" 1
157 1 12 PHE HA 1 15 VAL MG2 3.870 . 3.870 3.533 3.433 3.678 . 0 0 "[ . 1 . 2]" 1
158 1 12 PHE HA 1 16 LYS H 4.820 . 4.820 3.917 3.832 4.013 . 0 0 "[ . 1 . 2]" 1
159 1 12 PHE HA 1 38 MET ME 4.780 . 4.780 4.096 3.723 4.407 . 0 0 "[ . 1 . 2]" 1
160 1 12 PHE HA 1 41 PHE QE 4.130 . 4.130 2.824 2.671 3.031 . 0 0 "[ . 1 . 2]" 1
161 1 12 PHE HA 1 41 PHE HZ 3.980 . 3.980 3.167 2.945 3.281 . 0 0 "[ . 1 . 2]" 1
162 1 12 PHE HB2 1 13 ASP H 4.160 . 4.160 3.821 3.764 3.892 . 0 0 "[ . 1 . 2]" 1
163 1 12 PHE HB2 1 41 PHE QB 5.340 . 5.340 3.681 3.245 4.023 . 0 0 "[ . 1 . 2]" 1
164 1 12 PHE HB2 1 41 PHE QE 5.230 . 5.230 3.940 3.730 4.093 . 0 0 "[ . 1 . 2]" 1
165 1 12 PHE HB2 1 43 ILE MD 4.600 . 4.600 3.454 3.126 4.542 . 0 0 "[ . 1 . 2]" 1
166 1 12 PHE HB3 1 13 ASP H 4.050 . 4.050 2.567 2.507 2.653 . 0 0 "[ . 1 . 2]" 1
167 1 12 PHE HB3 1 41 PHE QE 5.160 . 5.160 4.981 4.803 5.117 . 0 0 "[ . 1 . 2]" 1
168 1 12 PHE HB3 1 43 ILE MD 5.500 . 5.500 4.464 4.181 5.520 0.020 5 0 "[ . 1 . 2]" 1
169 1 12 PHE QD 1 13 ASP H 4.450 . 4.450 3.838 3.586 3.997 . 0 0 "[ . 1 . 2]" 1
170 1 12 PHE QD 1 13 ASP HA 4.790 . 4.790 4.339 4.087 4.562 . 0 0 "[ . 1 . 2]" 1
171 1 12 PHE QD 1 13 ASP QB 5.340 . 5.340 4.961 4.459 5.402 0.062 20 0 "[ . 1 . 2]" 1
172 1 12 PHE QD 1 15 VAL HB 4.940 . 4.940 3.749 3.491 4.038 . 0 0 "[ . 1 . 2]" 1
173 1 12 PHE QD 1 15 VAL MG1 4.750 . 4.750 4.258 4.076 4.420 . 0 0 "[ . 1 . 2]" 1
174 1 12 PHE QD 1 15 VAL MG2 5.010 . 5.010 4.639 4.452 4.973 . 0 0 "[ . 1 . 2]" 1
175 1 12 PHE QD 1 38 MET ME 3.910 . 3.910 3.246 3.014 3.482 . 0 0 "[ . 1 . 2]" 1
176 1 12 PHE QD 1 41 PHE HB2 4.920 . 4.920 3.948 3.651 4.227 . 0 0 "[ . 1 . 2]" 1
177 1 12 PHE QD 1 41 PHE QB 4.280 . 4.280 3.639 3.351 3.873 . 0 0 "[ . 1 . 2]" 1
178 1 12 PHE QD 1 41 PHE HB3 4.920 . 4.920 4.267 3.900 4.496 . 0 0 "[ . 1 . 2]" 1
179 1 12 PHE QD 1 41 PHE QD 3.950 . 3.950 2.804 2.545 3.078 . 0 0 "[ . 1 . 2]" 1
180 1 12 PHE QD 1 41 PHE QE 4.590 . 4.590 3.317 3.054 3.729 . 0 0 "[ . 1 . 2]" 1
181 1 12 PHE QD 1 41 PHE HZ 5.010 . 5.010 4.758 4.453 5.010 . 0 0 "[ . 1 . 2]" 1
182 1 12 PHE QD 1 43 ILE HB 5.500 . 5.500 5.425 5.175 5.570 0.070 5 0 "[ . 1 . 2]" 1
183 1 12 PHE QD 1 43 ILE MD 4.230 . 4.230 2.869 2.419 3.148 . 0 0 "[ . 1 . 2]" 1
184 1 12 PHE QD 1 43 ILE QG 4.710 . 4.710 3.017 2.844 3.201 . 0 0 "[ . 1 . 2]" 1
185 1 12 PHE QD 1 43 ILE MG 5.220 . 5.220 4.347 4.065 4.537 . 0 0 "[ . 1 . 2]" 1
186 1 12 PHE QE 1 13 ASP HA 5.500 . 5.500 5.353 4.976 5.528 0.028 7 0 "[ . 1 . 2]" 1
187 1 12 PHE QE 1 16 LYS HA 5.500 . 5.500 5.481 5.167 5.567 0.067 4 0 "[ . 1 . 2]" 1
188 1 12 PHE QE 1 16 LYS HB2 5.500 . 5.500 5.390 5.250 5.529 0.029 13 0 "[ . 1 . 2]" 1
189 1 12 PHE QE 1 16 LYS QD 3.980 . 3.980 3.001 2.771 3.203 . 0 0 "[ . 1 . 2]" 1
190 1 12 PHE QE 1 16 LYS HE2 5.060 . 5.060 3.213 2.906 3.538 . 0 0 "[ . 1 . 2]" 1
191 1 12 PHE QE 1 16 LYS QE 4.190 . 4.190 3.126 2.868 3.443 . 0 0 "[ . 1 . 2]" 1
192 1 12 PHE QE 1 16 LYS HE3 5.060 . 5.060 4.425 3.631 4.767 . 0 0 "[ . 1 . 2]" 1
193 1 12 PHE QE 1 16 LYS QG 4.270 . 4.270 3.325 3.055 3.517 . 0 0 "[ . 1 . 2]" 1
194 1 12 PHE QE 1 38 MET HB2 5.500 . 5.500 4.961 4.681 5.523 0.023 5 0 "[ . 1 . 2]" 1
195 1 12 PHE QE 1 38 MET HB3 5.170 . 5.170 3.720 3.388 4.257 . 0 0 "[ . 1 . 2]" 1
196 1 12 PHE QE 1 38 MET ME 3.160 . 3.160 2.456 2.263 2.642 . 0 0 "[ . 1 . 2]" 1
197 1 12 PHE QE 1 38 MET QG 4.270 . 4.270 3.138 2.791 3.710 . 0 0 "[ . 1 . 2]" 1
198 1 12 PHE QE 1 41 PHE HB2 5.500 . 5.500 4.906 4.751 5.150 . 0 0 "[ . 1 . 2]" 1
199 1 12 PHE QE 1 41 PHE HB3 5.500 . 5.500 5.504 5.299 5.578 0.078 8 0 "[ . 1 . 2]" 1
200 1 12 PHE QE 1 41 PHE QD 4.550 . 4.550 4.135 3.930 4.549 . 0 0 "[ . 1 . 2]" 1
201 1 12 PHE QE 1 43 ILE HA 5.500 . 5.500 5.360 5.082 5.573 0.073 5 0 "[ . 1 . 2]" 1
202 1 12 PHE QE 1 43 ILE HB 5.410 . 5.410 4.264 4.015 4.410 . 0 0 "[ . 1 . 2]" 1
203 1 12 PHE QE 1 43 ILE MD 3.760 . 3.760 2.781 1.708 2.992 . 0 0 "[ . 1 . 2]" 1
204 1 12 PHE QE 1 43 ILE HG12 4.660 . 4.660 3.977 3.278 4.235 . 0 0 "[ . 1 . 2]" 1
205 1 12 PHE QE 1 43 ILE QG 4.030 . 4.030 2.362 2.130 3.162 . 0 0 "[ . 1 . 2]" 1
206 1 12 PHE QE 1 43 ILE HG13 4.660 . 4.660 2.426 2.140 4.155 . 0 0 "[ . 1 . 2]" 1
207 1 12 PHE QE 1 43 ILE MG 3.930 . 3.930 2.802 2.677 2.925 . 0 0 "[ . 1 . 2]" 1
208 1 12 PHE QE 1 47 GLN HB2 5.500 . 5.500 5.033 4.157 5.504 0.004 13 0 "[ . 1 . 2]" 1
209 1 12 PHE QE 1 47 GLN QB 4.830 . 4.830 4.036 3.345 4.487 . 0 0 "[ . 1 . 2]" 1
210 1 12 PHE QE 1 47 GLN HB3 5.500 . 5.500 4.260 3.527 4.805 . 0 0 "[ . 1 . 2]" 1
211 1 12 PHE QE 1 48 MET ME 4.430 . 4.430 3.068 2.822 3.322 . 0 0 "[ . 1 . 2]" 1
212 1 12 PHE HZ 1 16 LYS QD 3.860 . 3.860 2.961 2.784 3.330 . 0 0 "[ . 1 . 2]" 1
213 1 12 PHE HZ 1 16 LYS HE2 5.500 . 5.500 4.345 4.095 4.957 . 0 0 "[ . 1 . 2]" 1
214 1 12 PHE HZ 1 16 LYS QE 4.780 . 4.780 4.148 3.990 4.425 . 0 0 "[ . 1 . 2]" 1
215 1 12 PHE HZ 1 16 LYS HE3 5.500 . 5.500 5.429 4.826 5.603 0.103 15 0 "[ . 1 . 2]" 1
216 1 12 PHE HZ 1 16 LYS QG 4.280 . 4.280 3.723 3.573 3.860 . 0 0 "[ . 1 . 2]" 1
217 1 12 PHE HZ 1 38 MET ME 3.960 . 3.960 3.730 3.482 3.922 . 0 0 "[ . 1 . 2]" 1
218 1 12 PHE HZ 1 43 ILE HB 5.500 . 5.500 5.558 5.522 5.593 0.093 15 0 "[ . 1 . 2]" 1
219 1 12 PHE HZ 1 43 ILE MD 4.270 . 4.270 3.238 2.948 3.637 . 0 0 "[ . 1 . 2]" 1
220 1 12 PHE HZ 1 43 ILE QG 4.530 . 4.530 4.035 3.817 4.592 0.062 5 0 "[ . 1 . 2]" 1
221 1 12 PHE HZ 1 43 ILE MG 4.140 . 4.140 3.104 2.953 3.339 . 0 0 "[ . 1 . 2]" 1
222 1 12 PHE HZ 1 47 GLN QB 4.500 . 4.500 3.458 2.465 3.969 . 0 0 "[ . 1 . 2]" 1
223 1 12 PHE HZ 1 48 MET HA 4.920 . 4.920 4.687 4.324 4.952 0.032 20 0 "[ . 1 . 2]" 1
224 1 12 PHE HZ 1 48 MET ME 5.010 . 5.010 3.563 3.224 4.086 . 0 0 "[ . 1 . 2]" 1
225 1 12 PHE HZ 1 51 TYR HB2 4.910 . 4.910 3.577 3.154 3.920 . 0 0 "[ . 1 . 2]" 1
226 1 13 ASP H 1 13 ASP HB2 3.660 . 3.660 2.434 2.144 2.732 . 0 0 "[ . 1 . 2]" 1
227 1 13 ASP H 1 13 ASP QB 3.020 . 3.020 2.369 2.119 2.662 . 0 0 "[ . 1 . 2]" 1
228 1 13 ASP H 1 13 ASP HB3 3.660 . 3.660 3.390 2.510 3.671 0.011 9 0 "[ . 1 . 2]" 1
229 1 13 ASP H 1 14 GLN H 3.720 . 3.720 2.634 2.591 2.693 . 0 0 "[ . 1 . 2]" 1
230 1 13 ASP H 1 41 PHE HZ 5.500 . 5.500 5.507 5.404 5.544 0.044 14 0 "[ . 1 . 2]" 1
231 1 13 ASP HA 1 15 VAL H 5.080 . 5.080 4.307 4.152 4.495 . 0 0 "[ . 1 . 2]" 1
232 1 13 ASP HA 1 16 LYS H 4.120 . 4.120 3.566 3.314 3.810 . 0 0 "[ . 1 . 2]" 1
233 1 13 ASP HA 1 16 LYS HB2 3.550 . 3.550 2.573 2.310 2.792 . 0 0 "[ . 1 . 2]" 1
234 1 13 ASP HA 1 16 LYS HB3 4.140 . 4.140 4.026 3.793 4.170 0.030 19 0 "[ . 1 . 2]" 1
235 1 13 ASP HA 1 16 LYS QD 4.700 . 4.700 4.026 3.818 4.339 . 0 0 "[ . 1 . 2]" 1
236 1 13 ASP HA 1 16 LYS HE2 4.280 . 4.280 2.689 2.162 3.425 . 0 0 "[ . 1 . 2]" 1
237 1 13 ASP HA 1 16 LYS QE 3.560 . 3.560 2.001 1.790 2.299 . 0 0 "[ . 1 . 2]" 1
238 1 13 ASP HA 1 16 LYS HE3 4.280 . 4.280 2.090 1.891 2.487 . 0 0 "[ . 1 . 2]" 1
239 1 13 ASP HA 1 16 LYS HG2 5.320 . 5.320 4.990 4.755 5.291 . 0 0 "[ . 1 . 2]" 1
240 1 13 ASP HA 1 16 LYS HG3 5.320 . 5.320 3.713 3.415 4.102 . 0 0 "[ . 1 . 2]" 1
241 1 13 ASP HA 1 17 GLU H 4.880 . 4.880 4.148 3.888 4.465 . 0 0 "[ . 1 . 2]" 1
242 1 13 ASP QB 1 14 GLN H 3.310 . 3.310 2.684 2.342 2.915 . 0 0 "[ . 1 . 2]" 1
243 1 13 ASP QB 1 14 GLN HA 4.400 . 4.400 3.826 3.524 3.981 . 0 0 "[ . 1 . 2]" 1
244 1 13 ASP QB 1 15 VAL H 4.700 . 4.700 4.608 4.415 4.713 0.013 2 0 "[ . 1 . 2]" 1
245 1 13 ASP QB 1 16 LYS HB2 4.790 . 4.790 4.401 4.126 4.691 . 0 0 "[ . 1 . 2]" 1
246 1 13 ASP HB2 1 14 GLN H 4.020 . 4.020 3.065 2.504 3.776 . 0 0 "[ . 1 . 2]" 1
247 1 13 ASP HB2 1 14 GLN HA 5.210 . 5.210 4.692 3.808 5.319 0.109 1 0 "[ . 1 . 2]" 1
248 1 13 ASP HB2 1 15 VAL H 5.500 . 5.500 5.177 4.721 5.573 0.073 4 0 "[ . 1 . 2]" 1
249 1 13 ASP HB2 1 16 LYS HB2 5.500 . 5.500 5.262 4.873 5.475 . 0 0 "[ . 1 . 2]" 1
250 1 13 ASP HB3 1 14 GLN H 4.020 . 4.020 3.335 2.372 3.778 . 0 0 "[ . 1 . 2]" 1
251 1 13 ASP HB3 1 14 GLN HA 5.210 . 5.210 4.120 3.769 4.410 . 0 0 "[ . 1 . 2]" 1
252 1 13 ASP HB3 1 15 VAL H 5.500 . 5.500 5.267 4.635 5.526 0.026 12 0 "[ . 1 . 2]" 1
253 1 13 ASP HB3 1 16 LYS HB2 5.500 . 5.500 4.751 4.338 5.319 . 0 0 "[ . 1 . 2]" 1
254 1 14 GLN H 1 14 GLN QB 3.510 . 3.510 2.451 2.250 2.609 . 0 0 "[ . 1 . 2]" 1
255 1 14 GLN H 1 14 GLN HG2 2.930 . 2.930 2.472 2.158 2.706 . 0 0 "[ . 1 . 2]" 1
256 1 14 GLN H 1 15 VAL H 3.540 . 3.540 2.363 2.301 2.439 . 0 0 "[ . 1 . 2]" 1
257 1 14 GLN H 1 15 VAL HB 4.840 . 4.840 4.519 4.445 4.620 . 0 0 "[ . 1 . 2]" 1
258 1 14 GLN H 1 15 VAL MG2 4.620 . 4.620 4.171 4.080 4.267 . 0 0 "[ . 1 . 2]" 1
259 1 14 GLN HA 1 14 GLN QB 2.800 . 2.800 2.373 2.334 2.416 . 0 0 "[ . 1 . 2]" 1
260 1 14 GLN HA 1 14 GLN QE 5.340 . 5.340 3.040 2.204 4.242 . 0 0 "[ . 1 . 2]" 1
261 1 14 GLN HA 1 14 GLN HG2 3.170 . 3.170 3.015 2.606 3.235 0.065 4 0 "[ . 1 . 2]" 1
262 1 14 GLN HA 1 15 VAL MG2 5.170 . 5.170 5.031 4.923 5.106 . 0 0 "[ . 1 . 2]" 1
263 1 14 GLN HA 1 17 GLU H 4.100 . 4.100 3.266 3.038 3.493 . 0 0 "[ . 1 . 2]" 1
264 1 14 GLN QB 1 14 GLN HE21 4.010 . 4.010 2.881 1.684 3.704 . 0 0 "[ . 1 . 2]" 1
265 1 14 GLN QB 1 14 GLN QE 3.520 . 3.520 2.760 1.678 3.449 . 0 0 "[ . 1 . 2]" 1
266 1 14 GLN QB 1 14 GLN HE22 4.010 . 4.010 3.821 3.176 4.138 0.128 10 0 "[ . 1 . 2]" 1
267 1 14 GLN QB 1 15 VAL H 3.500 . 3.500 2.687 2.503 2.822 . 0 0 "[ . 1 . 2]" 1
268 1 14 GLN QB 1 15 VAL HA 4.920 . 4.920 3.816 3.681 3.911 . 0 0 "[ . 1 . 2]" 1
269 1 14 GLN QB 1 15 VAL MG2 3.690 . 3.690 3.202 3.038 3.327 . 0 0 "[ . 1 . 2]" 1
270 1 14 GLN QB 1 17 GLU H 5.420 . 5.420 4.708 4.577 4.836 . 0 0 "[ . 1 . 2]" 1
271 1 14 GLN HG2 1 15 VAL H 4.670 . 4.670 4.297 3.945 4.486 . 0 0 "[ . 1 . 2]" 1
272 1 14 GLN HG2 1 15 VAL MG2 5.500 . 5.500 5.306 4.826 5.514 0.014 14 0 "[ . 1 . 2]" 1
273 1 14 GLN HG3 1 15 VAL MG2 5.500 . 5.500 5.327 5.127 5.549 0.049 6 0 "[ . 1 . 2]" 1
274 1 15 VAL H 1 15 VAL HB 3.050 . 3.050 2.426 2.401 2.470 . 0 0 "[ . 1 . 2]" 1
275 1 15 VAL H 1 15 VAL MG1 3.790 . 3.790 3.725 3.695 3.756 . 0 0 "[ . 1 . 2]" 1
276 1 15 VAL H 1 15 VAL MG2 2.950 . 2.950 2.536 2.470 2.617 . 0 0 "[ . 1 . 2]" 1
277 1 15 VAL H 1 16 LYS H 3.400 . 3.400 2.510 2.477 2.556 . 0 0 "[ . 1 . 2]" 1
278 1 15 VAL H 1 16 LYS HA 5.460 . 5.460 4.995 4.956 5.033 . 0 0 "[ . 1 . 2]" 1
279 1 15 VAL H 1 16 LYS HB2 4.560 . 4.560 4.157 4.108 4.192 . 0 0 "[ . 1 . 2]" 1
280 1 15 VAL H 1 16 LYS HB3 5.500 . 5.500 5.682 5.652 5.702 0.202 12 0 "[ . 1 . 2]" 1
281 1 15 VAL H 1 17 GLU H 4.750 . 4.750 3.888 3.784 3.989 . 0 0 "[ . 1 . 2]" 1
282 1 15 VAL H 1 18 GLN QB 5.160 . 5.160 5.066 4.375 5.204 0.044 17 0 "[ . 1 . 2]" 1
283 1 15 VAL H 1 38 MET ME 5.500 . 5.500 4.577 4.336 4.830 . 0 0 "[ . 1 . 2]" 1
284 1 15 VAL H 1 41 PHE QE 4.840 . 4.840 4.266 4.124 4.411 . 0 0 "[ . 1 . 2]" 1
285 1 15 VAL H 1 41 PHE HZ 5.040 . 5.040 4.134 4.000 4.250 . 0 0 "[ . 1 . 2]" 1
286 1 15 VAL HA 1 15 VAL MG1 2.810 . 2.810 2.399 2.348 2.469 . 0 0 "[ . 1 . 2]" 1
287 1 15 VAL HA 1 15 VAL MG2 2.870 . 2.870 2.254 2.176 2.299 . 0 0 "[ . 1 . 2]" 1
288 1 15 VAL HA 1 17 GLU H 4.860 . 4.860 4.256 4.110 4.354 . 0 0 "[ . 1 . 2]" 1
289 1 15 VAL HA 1 17 GLU QB 5.390 . 5.390 4.899 4.621 5.086 . 0 0 "[ . 1 . 2]" 1
290 1 15 VAL HA 1 18 GLN H 3.970 . 3.970 2.862 2.747 2.972 . 0 0 "[ . 1 . 2]" 1
291 1 15 VAL HA 1 18 GLN HA 5.010 . 5.010 4.938 4.694 5.040 0.030 17 0 "[ . 1 . 2]" 1
292 1 15 VAL HA 1 18 GLN QB 3.530 . 3.530 2.770 1.993 2.950 . 0 0 "[ . 1 . 2]" 1
293 1 15 VAL HA 1 18 GLN QE 4.870 . 4.870 2.647 1.669 4.201 . 0 0 "[ . 1 . 2]" 1
294 1 15 VAL HA 1 18 GLN HG2 4.750 . 4.750 2.325 1.983 4.139 . 0 0 "[ . 1 . 2]" 1
295 1 15 VAL HA 1 18 GLN QG 4.100 . 4.100 2.293 1.975 3.897 . 0 0 "[ . 1 . 2]" 1
296 1 15 VAL HA 1 18 GLN HG3 4.750 . 4.750 3.934 3.722 4.755 0.005 5 0 "[ . 1 . 2]" 1
297 1 15 VAL HA 1 19 LEU H 4.620 . 4.620 3.897 3.714 4.086 . 0 0 "[ . 1 . 2]" 1
298 1 15 VAL HA 1 19 LEU HG 5.500 . 5.500 4.492 4.275 4.742 . 0 0 "[ . 1 . 2]" 1
299 1 15 VAL HA 1 41 PHE HZ 5.500 . 5.500 5.335 5.127 5.508 0.008 12 0 "[ . 1 . 2]" 1
300 1 15 VAL HB 1 16 LYS H 3.400 . 3.400 2.833 2.696 2.947 . 0 0 "[ . 1 . 2]" 1
301 1 15 VAL HB 1 16 LYS QG 5.280 . 5.280 4.108 3.949 4.288 . 0 0 "[ . 1 . 2]" 1
302 1 15 VAL HB 1 38 MET ME 3.590 . 3.590 3.164 2.917 3.510 . 0 0 "[ . 1 . 2]" 1
303 1 15 VAL HB 1 38 MET QG 5.210 . 5.210 5.018 4.814 5.230 0.020 19 0 "[ . 1 . 2]" 1
304 1 15 VAL HB 1 41 PHE QD 4.490 . 4.490 4.311 4.097 4.487 . 0 0 "[ . 1 . 2]" 1
305 1 15 VAL HB 1 41 PHE QE 3.960 . 3.960 2.343 2.136 2.504 . 0 0 "[ . 1 . 2]" 1
306 1 15 VAL HB 1 41 PHE HZ 4.160 . 4.160 3.456 3.148 3.648 . 0 0 "[ . 1 . 2]" 1
307 1 15 VAL MG1 1 16 LYS H 3.500 . 3.500 3.314 3.220 3.391 . 0 0 "[ . 1 . 2]" 1
308 1 15 VAL MG1 1 16 LYS HG2 5.210 . 5.210 4.632 4.391 4.801 . 0 0 "[ . 1 . 2]" 1
309 1 15 VAL MG1 1 16 LYS QG 4.360 . 4.360 3.951 3.840 4.065 . 0 0 "[ . 1 . 2]" 1
310 1 15 VAL MG1 1 16 LYS HG3 5.210 . 5.210 4.287 4.145 4.411 . 0 0 "[ . 1 . 2]" 1
311 1 15 VAL MG1 1 18 GLN H 4.880 . 4.880 4.070 3.954 4.165 . 0 0 "[ . 1 . 2]" 1
312 1 15 VAL MG1 1 18 GLN HA 5.500 . 5.500 5.672 5.595 5.722 0.222 14 0 "[ . 1 . 2]" 1
313 1 15 VAL MG1 1 18 GLN QB 4.270 . 4.270 3.842 2.975 4.003 . 0 0 "[ . 1 . 2]" 1
314 1 15 VAL MG1 1 18 GLN QG 4.270 . 4.270 2.451 2.253 3.765 . 0 0 "[ . 1 . 2]" 1
315 1 15 VAL MG1 1 19 LEU H 4.290 . 4.290 3.643 3.546 3.777 . 0 0 "[ . 1 . 2]" 1
316 1 15 VAL MG1 1 37 ARG HA 3.900 . 3.900 3.814 3.697 3.900 0.000 15 0 "[ . 1 . 2]" 1
317 1 15 VAL MG1 1 37 ARG QB 2.830 . 2.830 1.905 1.839 1.999 . 0 0 "[ . 1 . 2]" 1
318 1 15 VAL MG1 1 37 ARG QD 3.920 . 3.920 3.618 3.424 3.881 . 0 0 "[ . 1 . 2]" 1
319 1 15 VAL MG1 1 38 MET ME 2.970 . 2.970 2.200 2.065 2.297 . 0 0 "[ . 1 . 2]" 1
320 1 15 VAL MG1 1 38 MET QG 3.400 . 3.400 3.257 2.972 3.400 . 3 0 "[ . 1 . 2]" 1
321 1 15 VAL MG1 1 39 SER H 5.210 . 5.210 5.147 4.900 5.250 0.040 9 0 "[ . 1 . 2]" 1
322 1 15 VAL MG1 1 41 PHE QD 4.110 . 4.110 3.973 3.750 4.112 0.002 17 0 "[ . 1 . 2]" 1
323 1 15 VAL MG1 1 41 PHE QE 3.380 . 3.380 2.615 2.422 2.777 . 0 0 "[ . 1 . 2]" 1
324 1 15 VAL MG1 1 41 PHE HZ 4.440 . 4.440 4.236 4.000 4.426 . 0 0 "[ . 1 . 2]" 1
325 1 15 VAL MG2 1 16 LYS H 4.220 . 4.220 4.058 4.001 4.120 . 0 0 "[ . 1 . 2]" 1
326 1 15 VAL MG2 1 17 GLU H 5.500 . 5.500 5.419 5.313 5.481 . 0 0 "[ . 1 . 2]" 1
327 1 15 VAL MG2 1 18 GLN H 4.800 . 4.800 4.674 4.552 4.803 0.003 11 0 "[ . 1 . 2]" 1
328 1 15 VAL MG2 1 18 GLN QG 4.360 . 4.360 3.475 3.256 4.433 0.073 5 0 "[ . 1 . 2]" 1
329 1 15 VAL MG2 1 37 ARG HA 5.500 . 5.500 4.437 4.332 4.646 . 0 0 "[ . 1 . 2]" 1
330 1 15 VAL MG2 1 37 ARG QB 3.700 . 3.700 2.958 2.867 3.071 . 0 0 "[ . 1 . 2]" 1
331 1 15 VAL MG2 1 37 ARG HD2 5.350 . 5.350 4.328 3.915 4.574 . 0 0 "[ . 1 . 2]" 1
332 1 15 VAL MG2 1 37 ARG QD 4.600 . 4.600 4.112 3.816 4.283 . 0 0 "[ . 1 . 2]" 1
333 1 15 VAL MG2 1 37 ARG HD3 5.350 . 5.350 5.167 4.858 5.410 0.060 12 0 "[ . 1 . 2]" 1
334 1 15 VAL MG2 1 37 ARG HG2 5.500 . 5.500 5.522 5.306 5.594 0.094 6 0 "[ . 1 . 2]" 1
335 1 15 VAL MG2 1 37 ARG HG3 5.320 . 5.320 4.615 4.221 4.794 . 0 0 "[ . 1 . 2]" 1
336 1 15 VAL MG2 1 40 SER HB2 5.500 . 5.500 4.369 3.636 5.326 . 0 0 "[ . 1 . 2]" 1
337 1 15 VAL MG2 1 40 SER HB3 5.500 . 5.500 4.692 3.687 5.492 . 0 0 "[ . 1 . 2]" 1
338 1 15 VAL MG2 1 41 PHE H 5.500 . 5.500 5.515 5.432 5.556 0.056 11 0 "[ . 1 . 2]" 1
339 1 15 VAL MG2 1 41 PHE QD 4.090 . 4.090 4.052 3.990 4.100 0.010 7 0 "[ . 1 . 2]" 1
340 1 15 VAL MG2 1 41 PHE QE 3.190 . 3.190 2.037 1.947 2.107 . 0 0 "[ . 1 . 2]" 1
341 1 15 VAL MG2 1 41 PHE HZ 3.010 . 3.010 2.266 2.103 2.460 . 0 0 "[ . 1 . 2]" 1
342 1 16 LYS H 1 16 LYS HB2 3.190 . 3.190 2.102 2.045 2.180 . 0 0 "[ . 1 . 2]" 1
343 1 16 LYS H 1 16 LYS HB3 3.620 . 3.620 3.385 3.348 3.425 . 0 0 "[ . 1 . 2]" 1
344 1 16 LYS H 1 16 LYS QD 5.040 . 5.040 4.346 4.283 4.425 . 0 0 "[ . 1 . 2]" 1
345 1 16 LYS H 1 16 LYS HE2 5.410 . 5.410 4.371 3.739 5.440 0.030 13 0 "[ . 1 . 2]" 1
346 1 16 LYS H 1 16 LYS QE 4.660 . 4.660 3.624 3.365 3.820 . 0 0 "[ . 1 . 2]" 1
347 1 16 LYS H 1 16 LYS HE3 5.410 . 5.410 3.939 3.811 4.215 . 0 0 "[ . 1 . 2]" 1
348 1 16 LYS H 1 16 LYS HG2 4.310 . 4.310 3.567 3.437 3.648 . 0 0 "[ . 1 . 2]" 1
349 1 16 LYS H 1 16 LYS QG 3.520 . 3.520 2.504 2.412 2.599 . 0 0 "[ . 1 . 2]" 1
350 1 16 LYS H 1 16 LYS HG3 4.310 . 4.310 2.558 2.457 2.667 . 0 0 "[ . 1 . 2]" 1
351 1 16 LYS H 1 17 GLU H 3.640 . 3.640 2.815 2.744 2.905 . 0 0 "[ . 1 . 2]" 1
352 1 16 LYS H 1 18 GLN H 4.060 . 4.060 4.100 4.072 4.126 0.066 11 0 "[ . 1 . 2]" 1
353 1 16 LYS H 1 18 GLN QB 5.500 . 5.500 5.485 4.571 5.619 0.119 9 0 "[ . 1 . 2]" 1
354 1 16 LYS H 1 19 LEU HB2 5.500 . 5.500 5.005 4.863 5.171 . 0 0 "[ . 1 . 2]" 1
355 1 16 LYS H 1 38 MET ME 3.840 . 3.840 2.952 2.747 3.242 . 0 0 "[ . 1 . 2]" 1
356 1 16 LYS H 1 41 PHE QE 5.480 . 5.480 4.961 4.787 5.221 . 0 0 "[ . 1 . 2]" 1
357 1 16 LYS HA 1 16 LYS HG2 4.180 . 4.180 2.371 2.289 2.448 . 0 0 "[ . 1 . 2]" 1
358 1 16 LYS HA 1 16 LYS QG 3.580 . 3.580 2.278 2.207 2.325 . 0 0 "[ . 1 . 2]" 1
359 1 16 LYS HA 1 16 LYS HG3 4.180 . 4.180 2.952 2.872 3.067 . 0 0 "[ . 1 . 2]" 1
360 1 16 LYS HA 1 17 GLU HA 5.280 . 5.280 4.642 4.550 4.717 . 0 0 "[ . 1 . 2]" 1
361 1 16 LYS HA 1 17 GLU QB 5.500 . 5.500 5.460 5.303 5.513 0.013 4 0 "[ . 1 . 2]" 1
362 1 16 LYS HA 1 19 LEU H 4.500 . 4.500 3.749 3.615 3.900 . 0 0 "[ . 1 . 2]" 1
363 1 16 LYS HA 1 19 LEU HB2 3.950 . 3.950 2.886 2.723 3.098 . 0 0 "[ . 1 . 2]" 1
364 1 16 LYS HA 1 19 LEU HB3 5.120 . 5.120 4.296 4.123 4.515 . 0 0 "[ . 1 . 2]" 1
365 1 16 LYS HA 1 19 LEU QD 3.740 . 3.740 3.122 2.796 3.391 . 0 0 "[ . 1 . 2]" 1
366 1 16 LYS HA 1 19 LEU HG 5.500 . 5.500 4.547 4.179 4.890 . 0 0 "[ . 1 . 2]" 1
367 1 16 LYS HA 1 20 THR H 5.440 . 5.440 3.845 3.685 3.985 . 0 0 "[ . 1 . 2]" 1
368 1 16 LYS HA 1 38 MET ME 3.430 . 3.430 2.565 2.312 2.735 . 0 0 "[ . 1 . 2]" 1
369 1 16 LYS HA 1 51 TYR QE 4.230 . 4.230 3.337 3.224 3.457 . 0 0 "[ . 1 . 2]" 1
370 1 16 LYS HB2 1 16 LYS QD 3.720 . 3.720 3.047 2.978 3.130 . 0 0 "[ . 1 . 2]" 1
371 1 16 LYS HB2 1 16 LYS HE2 4.410 . 4.410 3.217 2.862 3.979 . 0 0 "[ . 1 . 2]" 1
372 1 16 LYS HB2 1 16 LYS QE 3.610 . 3.610 2.225 1.972 2.712 . 0 0 "[ . 1 . 2]" 1
373 1 16 LYS HB2 1 16 LYS HE3 4.410 . 4.410 2.270 1.998 2.760 . 0 0 "[ . 1 . 2]" 1
374 1 16 LYS HB2 1 17 GLU H 4.020 . 4.020 2.612 2.422 2.770 . 0 0 "[ . 1 . 2]" 1
375 1 16 LYS HB2 1 38 MET ME 4.300 . 4.300 3.861 3.708 4.088 . 0 0 "[ . 1 . 2]" 1
376 1 16 LYS HB2 1 51 TYR QD 5.500 . 5.500 5.443 5.218 5.545 0.045 20 0 "[ . 1 . 2]" 1
377 1 16 LYS HB2 1 51 TYR QE 5.250 . 5.250 4.555 4.407 4.751 . 0 0 "[ . 1 . 2]" 1
378 1 16 LYS HB3 1 16 LYS QD 3.430 . 3.430 2.450 2.393 2.556 . 0 0 "[ . 1 . 2]" 1
379 1 16 LYS HB3 1 16 LYS HE2 4.550 . 4.550 3.999 3.795 4.367 . 0 0 "[ . 1 . 2]" 1
380 1 16 LYS HB3 1 16 LYS QE 3.780 . 3.780 2.863 2.554 3.549 . 0 0 "[ . 1 . 2]" 1
381 1 16 LYS HB3 1 16 LYS HE3 4.550 . 4.550 2.946 2.592 3.757 . 0 0 "[ . 1 . 2]" 1
382 1 16 LYS HB3 1 17 GLU H 4.030 . 4.030 3.178 3.025 3.348 . 0 0 "[ . 1 . 2]" 1
383 1 16 LYS HB3 1 38 MET ME 4.420 . 4.420 4.152 3.975 4.385 . 0 0 "[ . 1 . 2]" 1
384 1 16 LYS HB3 1 51 TYR QD 5.500 . 5.500 4.214 3.936 4.381 . 0 0 "[ . 1 . 2]" 1
385 1 16 LYS HB3 1 51 TYR QE 4.870 . 4.870 2.983 2.794 3.177 . 0 0 "[ . 1 . 2]" 1
386 1 16 LYS QD 1 38 MET ME 4.430 . 4.430 3.559 3.400 3.761 . 0 0 "[ . 1 . 2]" 1
387 1 16 LYS QD 1 51 TYR HB2 4.580 . 4.580 3.459 3.118 3.723 . 0 0 "[ . 1 . 2]" 1
388 1 16 LYS QD 1 51 TYR HB3 5.050 . 5.050 4.842 4.495 5.078 0.028 15 0 "[ . 1 . 2]" 1
389 1 16 LYS QD 1 51 TYR QD 3.340 . 3.340 2.891 2.661 3.126 . 0 0 "[ . 1 . 2]" 1
390 1 16 LYS QD 1 51 TYR QE 4.140 . 4.140 3.322 3.044 3.653 . 0 0 "[ . 1 . 2]" 1
391 1 16 LYS QE 1 51 TYR QD 5.340 . 5.340 4.894 4.683 5.084 . 0 0 "[ . 1 . 2]" 1
392 1 16 LYS QG 1 17 GLU H 5.340 . 5.340 4.265 4.164 4.364 . 0 0 "[ . 1 . 2]" 1
393 1 16 LYS QG 1 19 LEU QD 4.870 . 4.870 3.975 3.787 4.194 . 0 0 "[ . 1 . 2]" 1
394 1 16 LYS QG 1 38 MET ME 2.880 . 2.880 2.095 1.986 2.292 . 0 0 "[ . 1 . 2]" 1
395 1 16 LYS QG 1 38 MET QG 5.340 . 5.340 4.630 4.433 4.847 . 0 0 "[ . 1 . 2]" 1
396 1 16 LYS QG 1 51 TYR HB2 5.070 . 5.070 3.900 3.668 4.072 . 0 0 "[ . 1 . 2]" 1
397 1 16 LYS QG 1 51 TYR QD 4.620 . 4.620 3.301 3.103 3.486 . 0 0 "[ . 1 . 2]" 1
398 1 16 LYS QG 1 51 TYR QE 4.470 . 4.470 3.141 2.907 3.356 . 0 0 "[ . 1 . 2]" 1
399 1 16 LYS HG2 1 38 MET ME 3.340 . 3.340 2.445 2.180 2.764 . 0 0 "[ . 1 . 2]" 1
400 1 16 LYS HG2 1 51 TYR QD 5.430 . 5.430 3.370 3.155 3.571 . 0 0 "[ . 1 . 2]" 1
401 1 16 LYS HG2 1 51 TYR QE 5.070 . 5.070 3.199 2.951 3.429 . 0 0 "[ . 1 . 2]" 1
402 1 16 LYS HG3 1 38 MET ME 3.340 . 3.340 2.291 2.157 2.507 . 0 0 "[ . 1 . 2]" 1
403 1 16 LYS HG3 1 51 TYR QD 5.430 . 5.430 4.728 4.585 4.868 . 0 0 "[ . 1 . 2]" 1
404 1 16 LYS HG3 1 51 TYR QE 5.070 . 5.070 4.581 4.377 4.776 . 0 0 "[ . 1 . 2]" 1
405 1 17 GLU H 1 17 GLU QB 2.950 . 2.950 2.409 2.130 2.504 . 0 0 "[ . 1 . 2]" 1
406 1 17 GLU H 1 17 GLU QG 4.040 . 4.040 2.430 2.163 3.740 . 0 0 "[ . 1 . 2]" 1
407 1 17 GLU H 1 18 GLN H 3.540 . 3.540 2.864 2.786 2.910 . 0 0 "[ . 1 . 2]" 1
408 1 17 GLU HA 1 17 GLU QB 2.620 . 2.620 2.393 2.359 2.484 . 0 0 "[ . 1 . 2]" 1
409 1 17 GLU HA 1 20 THR H 4.270 . 4.270 3.308 2.968 3.435 . 0 0 "[ . 1 . 2]" 1
410 1 17 GLU HA 1 20 THR HB 4.120 . 4.120 2.141 1.980 2.224 . 0 0 "[ . 1 . 2]" 1
411 1 17 GLU HA 1 20 THR MG 3.380 . 3.380 3.393 3.322 3.450 0.070 3 0 "[ . 1 . 2]" 1
412 1 17 GLU HA 1 21 GLU H 4.680 . 4.680 3.715 3.512 3.961 . 0 0 "[ . 1 . 2]" 1
413 1 17 GLU HA 1 55 LEU QD 5.280 . 5.280 5.281 5.134 5.343 0.063 12 0 "[ . 1 . 2]" 1
414 1 17 GLU QB 1 18 GLN H 3.220 . 3.220 3.077 2.969 3.260 0.040 16 0 "[ . 1 . 2]" 1
415 1 17 GLU QG 1 20 THR HB 5.350 . 5.350 3.898 3.125 4.101 . 0 0 "[ . 1 . 2]" 1
416 1 17 GLU QG 1 20 THR MG 4.070 . 4.070 3.974 3.232 4.130 0.060 20 0 "[ . 1 . 2]" 1
417 1 17 GLU QG 1 54 PHE QE 5.500 . 5.500 5.113 4.610 5.370 . 0 0 "[ . 1 . 2]" 1
418 1 18 GLN H 1 18 GLN QB 3.140 . 3.140 2.333 1.941 2.414 . 0 0 "[ . 1 . 2]" 1
419 1 18 GLN H 1 18 GLN QG 3.320 . 3.320 2.647 2.454 3.595 0.275 5 0 "[ . 1 . 2]" 1
420 1 18 GLN H 1 19 LEU H 3.520 . 3.520 2.469 2.418 2.518 . 0 0 "[ . 1 . 2]" 1
421 1 18 GLN H 1 19 LEU HB2 5.500 . 5.500 4.141 4.094 4.179 . 0 0 "[ . 1 . 2]" 1
422 1 18 GLN H 1 19 LEU HB3 5.500 . 5.500 5.700 5.660 5.737 0.237 14 0 "[ . 1 . 2]" 1
423 1 18 GLN HA 1 18 GLN HG2 3.820 . 3.820 3.788 3.269 3.866 0.046 3 0 "[ . 1 . 2]" 1
424 1 18 GLN HA 1 18 GLN QG 3.290 . 3.290 3.270 2.549 3.363 0.073 17 0 "[ . 1 . 2]" 1
425 1 18 GLN HA 1 18 GLN HG3 3.820 . 3.820 3.584 2.659 3.723 . 0 0 "[ . 1 . 2]" 1
426 1 18 GLN HA 1 21 GLU H 3.840 . 3.840 3.695 3.458 3.890 0.050 15 0 "[ . 1 . 2]" 1
427 1 18 GLN QB 1 19 LEU H 3.820 . 3.820 3.156 2.153 3.294 . 0 0 "[ . 1 . 2]" 1
428 1 18 GLN QE 1 18 GLN QG 3.000 . 3.000 2.470 2.227 2.728 . 0 0 "[ . 1 . 2]" 1
429 1 18 GLN QG 1 19 LEU H 4.220 . 4.220 2.158 2.039 2.650 . 0 0 "[ . 1 . 2]" 1
430 1 18 GLN QG 1 19 LEU HG 5.320 . 5.320 2.291 2.086 2.915 . 0 0 "[ . 1 . 2]" 1
431 1 18 GLN QG 1 37 ARG QB 4.250 . 4.250 3.720 3.401 4.292 0.042 15 0 "[ . 1 . 2]" 1
432 1 18 GLN QG 1 37 ARG QD 4.610 . 4.610 4.060 3.614 4.517 . 0 0 "[ . 1 . 2]" 1
433 1 18 GLN QG 1 37 ARG HG2 5.340 . 5.340 4.789 4.389 5.191 . 0 0 "[ . 1 . 2]" 1
434 1 18 GLN QG 1 37 ARG HG3 4.630 . 4.630 3.247 2.833 3.629 . 0 0 "[ . 1 . 2]" 1
435 1 18 GLN HG2 1 19 LEU H 4.910 . 4.910 2.357 2.135 2.691 . 0 0 "[ . 1 . 2]" 1
436 1 18 GLN HG3 1 19 LEU H 4.910 . 4.910 2.580 2.256 3.961 . 0 0 "[ . 1 . 2]" 1
437 1 19 LEU H 1 19 LEU HB2 3.110 . 3.110 2.062 1.996 2.126 . 0 0 "[ . 1 . 2]" 1
438 1 19 LEU H 1 19 LEU HB3 3.450 . 3.450 3.379 3.343 3.412 . 0 0 "[ . 1 . 2]" 1
439 1 19 LEU H 1 19 LEU MD1 4.330 . 4.330 3.497 3.415 3.607 . 0 0 "[ . 1 . 2]" 1
440 1 19 LEU H 1 19 LEU QD 3.750 . 3.750 3.180 3.132 3.241 . 0 0 "[ . 1 . 2]" 1
441 1 19 LEU H 1 19 LEU MD2 4.330 . 4.330 3.661 3.528 3.802 . 0 0 "[ . 1 . 2]" 1
442 1 19 LEU H 1 19 LEU HG 4.320 . 4.320 2.582 2.453 2.697 . 0 0 "[ . 1 . 2]" 1
443 1 19 LEU H 1 20 THR H 3.850 . 3.850 2.616 2.581 2.657 . 0 0 "[ . 1 . 2]" 1
444 1 19 LEU H 1 20 THR HB 4.950 . 4.950 4.543 4.436 4.636 . 0 0 "[ . 1 . 2]" 1
445 1 19 LEU H 1 21 GLU H 4.960 . 4.960 4.240 4.122 4.323 . 0 0 "[ . 1 . 2]" 1
446 1 19 LEU H 1 29 LEU MD1 5.500 . 5.500 5.095 4.936 5.239 . 0 0 "[ . 1 . 2]" 1
447 1 19 LEU HA 1 19 LEU MD1 3.830 . 3.830 3.766 3.742 3.784 . 0 0 "[ . 1 . 2]" 1
448 1 19 LEU HA 1 19 LEU QD 2.730 . 2.730 1.995 1.944 2.028 . 0 0 "[ . 1 . 2]" 1
449 1 19 LEU HA 1 19 LEU MD2 3.830 . 3.830 2.002 1.951 2.036 . 0 0 "[ . 1 . 2]" 1
450 1 19 LEU HA 1 19 LEU HG 3.790 . 3.790 2.860 2.737 2.977 . 0 0 "[ . 1 . 2]" 1
451 1 19 LEU HA 1 20 THR HA 5.500 . 5.500 4.808 4.757 4.886 . 0 0 "[ . 1 . 2]" 1
452 1 19 LEU HA 1 21 GLU H 4.780 . 4.780 4.518 4.369 4.620 . 0 0 "[ . 1 . 2]" 1
453 1 19 LEU HA 1 22 SER H 5.060 . 5.060 3.609 3.441 3.785 . 0 0 "[ . 1 . 2]" 1
454 1 19 LEU HA 1 23 GLY H 5.040 . 5.040 3.854 3.701 4.025 . 0 0 "[ . 1 . 2]" 1
455 1 19 LEU HA 1 29 LEU MD1 4.210 . 4.210 3.370 3.168 3.518 . 0 0 "[ . 1 . 2]" 1
456 1 19 LEU HA 1 34 ILE HA 5.500 . 5.500 5.456 5.300 5.535 0.035 9 0 "[ . 1 . 2]" 1
457 1 19 LEU HB2 1 19 LEU QD 2.840 . 2.840 2.238 2.198 2.271 . 0 0 "[ . 1 . 2]" 1
458 1 19 LEU HB2 1 20 THR H 4.100 . 4.100 2.576 2.433 2.667 . 0 0 "[ . 1 . 2]" 1
459 1 19 LEU HB2 1 21 GLU H 5.500 . 5.500 5.090 4.987 5.154 . 0 0 "[ . 1 . 2]" 1
460 1 19 LEU HB2 1 34 ILE MG 4.890 . 4.890 4.312 4.068 4.454 . 0 0 "[ . 1 . 2]" 1
461 1 19 LEU HB2 1 51 TYR QE 4.290 . 4.290 3.205 3.057 3.286 . 0 0 "[ . 1 . 2]" 1
462 1 19 LEU HB2 1 55 LEU QD 5.280 . 5.280 3.782 3.602 3.884 . 0 0 "[ . 1 . 2]" 1
463 1 19 LEU HB3 1 19 LEU MD1 3.330 . 3.330 2.391 2.343 2.431 . 0 0 "[ . 1 . 2]" 1
464 1 19 LEU HB3 1 19 LEU QD 2.860 . 2.860 2.145 2.120 2.163 . 0 0 "[ . 1 . 2]" 1
465 1 19 LEU HB3 1 19 LEU MD2 3.330 . 3.330 2.427 2.372 2.474 . 0 0 "[ . 1 . 2]" 1
466 1 19 LEU HB3 1 20 THR H 4.140 . 4.140 3.259 3.156 3.371 . 0 0 "[ . 1 . 2]" 1
467 1 19 LEU HB3 1 20 THR HA 4.950 . 4.950 4.122 4.015 4.261 . 0 0 "[ . 1 . 2]" 1
468 1 19 LEU HB3 1 21 GLU H 5.400 . 5.400 5.476 5.445 5.496 0.096 10 0 "[ . 1 . 2]" 1
469 1 19 LEU HB3 1 22 SER H 5.500 . 5.500 5.409 5.271 5.507 0.007 5 0 "[ . 1 . 2]" 1
470 1 19 LEU HB3 1 29 LEU MD1 3.420 . 3.420 2.628 2.466 2.774 . 0 0 "[ . 1 . 2]" 1
471 1 19 LEU HB3 1 34 ILE HA 5.500 . 5.500 4.262 4.052 4.418 . 0 0 "[ . 1 . 2]" 1
472 1 19 LEU HB3 1 34 ILE MG 4.330 . 4.330 3.685 3.463 3.897 . 0 0 "[ . 1 . 2]" 1
473 1 19 LEU HB3 1 51 TYR QE 4.940 . 4.940 2.847 2.703 3.032 . 0 0 "[ . 1 . 2]" 1
474 1 19 LEU HB3 1 55 LEU MD1 4.080 . 4.080 3.458 3.250 3.576 . 0 0 "[ . 1 . 2]" 1
475 1 19 LEU HB3 1 55 LEU QD 3.570 . 3.570 3.096 2.957 3.274 . 0 0 "[ . 1 . 2]" 1
476 1 19 LEU HB3 1 55 LEU MD2 4.080 . 4.080 3.501 3.252 3.799 . 0 0 "[ . 1 . 2]" 1
477 1 19 LEU QD 1 23 GLY H 5.250 . 5.250 4.627 4.471 4.846 . 0 0 "[ . 1 . 2]" 1
478 1 19 LEU QD 1 33 GLU HA 5.000 . 5.000 4.515 4.271 4.733 . 0 0 "[ . 1 . 2]" 1
479 1 19 LEU QD 1 33 GLU QB 4.380 . 4.380 3.681 3.369 3.980 . 0 0 "[ . 1 . 2]" 1
480 1 19 LEU QD 1 33 GLU HG2 4.740 . 4.740 3.979 3.477 4.257 . 0 0 "[ . 1 . 2]" 1
481 1 19 LEU QD 1 33 GLU HG3 4.000 . 4.000 2.730 2.270 3.026 . 0 0 "[ . 1 . 2]" 1
482 1 19 LEU QD 1 34 ILE H 4.110 . 4.110 3.679 3.464 3.870 . 0 0 "[ . 1 . 2]" 1
483 1 19 LEU QD 1 37 ARG H 3.820 . 3.820 3.304 3.108 3.541 . 0 0 "[ . 1 . 2]" 1
484 1 19 LEU QD 1 37 ARG HA 4.650 . 4.650 4.562 4.418 4.676 0.026 7 0 "[ . 1 . 2]" 1
485 1 19 LEU QD 1 37 ARG QB 3.660 . 3.660 2.232 2.106 2.407 . 0 0 "[ . 1 . 2]" 1
486 1 19 LEU QD 1 37 ARG HG2 3.520 . 3.520 2.608 2.321 2.770 . 0 0 "[ . 1 . 2]" 1
487 1 19 LEU QD 1 37 ARG HG3 3.440 . 3.440 2.359 2.131 2.545 . 0 0 "[ . 1 . 2]" 1
488 1 19 LEU QD 1 38 MET H 4.560 . 4.560 3.799 3.582 3.978 . 0 0 "[ . 1 . 2]" 1
489 1 19 LEU QD 1 38 MET HA 5.290 . 5.290 4.837 4.645 5.014 . 0 0 "[ . 1 . 2]" 1
490 1 19 LEU QD 1 38 MET HB2 5.210 . 5.210 4.784 4.472 4.997 . 0 0 "[ . 1 . 2]" 1
491 1 19 LEU QD 1 38 MET ME 2.670 . 2.670 1.868 1.839 1.909 . 0 0 "[ . 1 . 2]" 1
492 1 19 LEU QD 1 38 MET QG 3.240 . 3.240 2.857 2.585 3.027 . 0 0 "[ . 1 . 2]" 1
493 1 19 LEU QD 1 48 MET ME 4.120 . 4.120 3.637 3.450 3.847 . 0 0 "[ . 1 . 2]" 1
494 1 19 LEU QD 1 51 TYR QE 3.140 . 3.140 2.217 2.083 2.422 . 0 0 "[ . 1 . 2]" 1
495 1 19 LEU QD 1 55 LEU QD 4.160 . 4.160 3.369 3.247 3.564 . 0 0 "[ . 1 . 2]" 1
496 1 19 LEU MD1 1 20 THR H 5.190 . 5.190 4.454 4.347 4.557 . 0 0 "[ . 1 . 2]" 1
497 1 19 LEU MD1 1 34 ILE H 4.920 . 4.920 4.412 4.264 4.659 . 0 0 "[ . 1 . 2]" 1
498 1 19 LEU MD1 1 34 ILE HA 3.190 . 3.190 2.084 1.979 2.308 . 0 0 "[ . 1 . 2]" 1
499 1 19 LEU MD1 1 37 ARG H 4.400 . 4.400 3.559 3.337 3.831 . 0 0 "[ . 1 . 2]" 1
500 1 19 LEU MD1 1 37 ARG HA 5.500 . 5.500 4.922 4.719 5.086 . 0 0 "[ . 1 . 2]" 1
501 1 19 LEU MD1 1 51 TYR QE 4.070 . 4.070 2.229 2.091 2.441 . 0 0 "[ . 1 . 2]" 1
502 1 19 LEU MD2 1 20 THR H 5.190 . 5.190 4.677 4.645 4.733 . 0 0 "[ . 1 . 2]" 1
503 1 19 LEU MD2 1 34 ILE H 4.920 . 4.920 3.946 3.619 4.203 . 0 0 "[ . 1 . 2]" 1
504 1 19 LEU MD2 1 34 ILE HA 3.190 . 3.190 2.326 2.069 2.503 . 0 0 "[ . 1 . 2]" 1
505 1 19 LEU MD2 1 37 ARG H 4.400 . 4.400 3.926 3.656 4.166 . 0 0 "[ . 1 . 2]" 1
506 1 19 LEU MD2 1 37 ARG HA 5.500 . 5.500 5.399 5.266 5.519 0.019 1 0 "[ . 1 . 2]" 1
507 1 19 LEU MD2 1 51 TYR QE 4.070 . 4.070 3.955 3.707 4.077 0.007 2 0 "[ . 1 . 2]" 1
508 1 19 LEU HG 1 20 THR H 5.350 . 5.350 4.586 4.468 4.679 . 0 0 "[ . 1 . 2]" 1
509 1 19 LEU HG 1 34 ILE HA 4.900 . 4.900 4.187 4.022 4.333 . 0 0 "[ . 1 . 2]" 1
510 1 19 LEU HG 1 34 ILE MG 4.590 . 4.590 4.615 4.570 4.642 0.052 6 0 "[ . 1 . 2]" 1
511 1 19 LEU HG 1 37 ARG QB 3.530 . 3.530 3.313 3.027 3.530 0.000 12 0 "[ . 1 . 2]" 1
512 1 19 LEU HG 1 38 MET QG 5.500 . 5.500 5.196 4.840 5.382 . 0 0 "[ . 1 . 2]" 1
513 1 19 LEU HG 1 51 TYR QE 5.500 . 5.500 4.618 4.463 4.701 . 0 0 "[ . 1 . 2]" 1
514 1 19 LEU HG 1 55 LEU QD 5.400 . 5.400 5.301 5.147 5.452 0.052 14 0 "[ . 1 . 2]" 1
515 1 20 THR H 1 20 THR HB 3.560 . 3.560 2.304 2.249 2.428 . 0 0 "[ . 1 . 2]" 1
516 1 20 THR H 1 20 THR MG 3.740 . 3.740 3.699 3.676 3.735 . 0 0 "[ . 1 . 2]" 1
517 1 20 THR H 1 21 GLU H 3.910 . 3.910 2.793 2.718 2.835 . 0 0 "[ . 1 . 2]" 1
518 1 20 THR H 1 21 GLU HA 5.500 . 5.500 5.344 5.297 5.385 . 0 0 "[ . 1 . 2]" 1
519 1 20 THR H 1 21 GLU QB 5.020 . 5.020 4.402 4.195 4.524 . 0 0 "[ . 1 . 2]" 1
520 1 20 THR H 1 55 LEU QD 4.830 . 4.830 3.486 3.405 3.599 . 0 0 "[ . 1 . 2]" 1
521 1 20 THR HA 1 20 THR MG 3.250 . 3.250 2.593 2.532 2.617 . 0 0 "[ . 1 . 2]" 1
522 1 20 THR HA 1 22 SER H 5.220 . 5.220 4.491 4.354 4.619 . 0 0 "[ . 1 . 2]" 1
523 1 20 THR HA 1 22 SER QB 5.340 . 5.340 5.271 5.097 5.364 0.024 8 0 "[ . 1 . 2]" 1
524 1 20 THR HA 1 23 GLY H 4.800 . 4.800 3.758 3.646 3.893 . 0 0 "[ . 1 . 2]" 1
525 1 20 THR HA 1 24 LYS H 5.190 . 5.190 4.153 3.937 4.289 . 0 0 "[ . 1 . 2]" 1
526 1 20 THR HA 1 24 LYS HG3 5.470 . 5.470 4.588 4.428 4.737 . 0 0 "[ . 1 . 2]" 1
527 1 20 THR HA 1 55 LEU QD 3.000 . 3.000 2.115 2.011 2.223 . 0 0 "[ . 1 . 2]" 1
528 1 20 THR HA 1 60 VAL MG2 4.410 . 4.410 3.320 3.165 3.562 . 0 0 "[ . 1 . 2]" 1
529 1 20 THR HB 1 21 GLU H 3.980 . 3.980 2.486 2.264 2.615 . 0 0 "[ . 1 . 2]" 1
530 1 20 THR HB 1 51 TYR QE 5.500 . 5.500 4.572 4.353 4.779 . 0 0 "[ . 1 . 2]" 1
531 1 20 THR HB 1 54 PHE QE 4.690 . 4.690 3.907 3.632 4.187 . 0 0 "[ . 1 . 2]" 1
532 1 20 THR HB 1 54 PHE HZ 5.250 . 5.250 4.874 4.624 5.150 . 0 0 "[ . 1 . 2]" 1
533 1 20 THR MG 1 21 GLU H 3.460 . 3.460 2.981 2.939 3.032 . 0 0 "[ . 1 . 2]" 1
534 1 20 THR MG 1 21 GLU HA 4.010 . 4.010 2.977 2.929 3.063 . 0 0 "[ . 1 . 2]" 1
535 1 20 THR MG 1 21 GLU QB 3.430 . 3.430 3.533 3.484 3.569 0.139 19 0 "[ . 1 . 2]" 1
536 1 20 THR MG 1 23 GLY H 5.060 . 5.060 4.930 4.849 5.018 . 0 0 "[ . 1 . 2]" 1
537 1 20 THR MG 1 24 LYS H 4.720 . 4.720 4.199 4.016 4.343 . 0 0 "[ . 1 . 2]" 1
538 1 20 THR MG 1 24 LYS HE2 4.930 . 4.930 4.089 3.940 4.216 . 0 0 "[ . 1 . 2]" 1
539 1 20 THR MG 1 24 LYS QE 4.260 . 4.260 3.906 3.796 4.000 . 0 0 "[ . 1 . 2]" 1
540 1 20 THR MG 1 24 LYS HE3 4.930 . 4.930 4.958 4.906 5.035 0.105 20 0 "[ . 1 . 2]" 1
541 1 20 THR MG 1 24 LYS HG3 2.990 . 2.990 2.611 2.364 2.855 . 0 0 "[ . 1 . 2]" 1
542 1 20 THR MG 1 51 TYR QE 4.620 . 4.620 4.349 4.182 4.632 0.012 10 0 "[ . 1 . 2]" 1
543 1 20 THR MG 1 54 PHE QE 3.190 . 3.190 2.827 2.615 3.130 . 0 0 "[ . 1 . 2]" 1
544 1 20 THR MG 1 54 PHE HZ 3.550 . 3.550 3.024 2.819 3.254 . 0 0 "[ . 1 . 2]" 1
545 1 20 THR MG 1 55 LEU HA 5.190 . 5.190 4.261 3.978 4.483 . 0 0 "[ . 1 . 2]" 1
546 1 20 THR MG 1 55 LEU QD 3.300 . 3.300 3.003 2.826 3.173 . 0 0 "[ . 1 . 2]" 1
547 1 21 GLU H 1 21 GLU QB 2.990 . 2.990 2.111 2.008 2.198 . 0 0 "[ . 1 . 2]" 1
548 1 21 GLU H 1 21 GLU QG 4.250 . 4.250 3.909 3.801 3.969 . 0 0 "[ . 1 . 2]" 1
549 1 21 GLU H 1 24 LYS HG3 5.500 . 5.500 4.783 4.600 4.965 . 0 0 "[ . 1 . 2]" 1
550 1 21 GLU H 1 29 LEU MD1 5.500 . 5.500 5.288 5.173 5.390 . 0 0 "[ . 1 . 2]" 1
551 1 21 GLU HA 1 21 GLU QG 3.290 . 3.290 2.656 2.425 3.035 . 0 0 "[ . 1 . 2]" 1
552 1 21 GLU HA 1 23 GLY H 5.200 . 5.200 4.578 4.402 4.694 . 0 0 "[ . 1 . 2]" 1
553 1 21 GLU HA 1 24 LYS H 4.090 . 4.090 3.523 3.322 3.737 . 0 0 "[ . 1 . 2]" 1
554 1 21 GLU HA 1 24 LYS HB2 3.980 . 3.980 2.584 2.424 2.843 . 0 0 "[ . 1 . 2]" 1
555 1 21 GLU HA 1 24 LYS QE 4.970 . 4.970 4.671 4.441 4.875 . 0 0 "[ . 1 . 2]" 1
556 1 21 GLU HA 1 24 LYS HG3 3.710 . 3.710 2.931 2.576 3.238 . 0 0 "[ . 1 . 2]" 1
557 1 21 GLU HA 1 25 LYS H 5.260 . 5.260 4.464 4.302 4.749 . 0 0 "[ . 1 . 2]" 1
558 1 21 GLU QB 1 22 SER H 3.240 . 3.240 2.450 2.302 2.586 . 0 0 "[ . 1 . 2]" 1
559 1 21 GLU QB 1 22 SER QB 4.450 . 4.450 4.416 4.274 4.486 0.036 3 0 "[ . 1 . 2]" 1
560 1 21 GLU QB 1 23 GLY H 5.260 . 5.260 4.735 4.641 4.802 . 0 0 "[ . 1 . 2]" 1
561 1 21 GLU QG 1 22 SER H 4.190 . 4.190 3.615 3.321 4.250 0.060 9 0 "[ . 1 . 2]" 1
562 1 21 GLU QG 1 25 LYS QD 4.090 . 4.090 2.845 1.825 4.115 0.025 9 0 "[ . 1 . 2]" 1
563 1 21 GLU QG 1 25 LYS HG2 5.310 . 5.310 4.187 3.572 5.169 . 0 0 "[ . 1 . 2]" 1
564 1 21 GLU QG 1 25 LYS QG 4.600 . 4.600 3.154 2.770 4.274 . 0 0 "[ . 1 . 2]" 1
565 1 21 GLU QG 1 25 LYS HG3 5.310 . 5.310 3.266 2.886 4.557 . 0 0 "[ . 1 . 2]" 1
566 1 22 SER H 1 22 SER HB2 3.780 . 3.780 2.555 2.460 2.623 . 0 0 "[ . 1 . 2]" 1
567 1 22 SER H 1 22 SER QB 3.060 . 3.060 2.506 2.419 2.569 . 0 0 "[ . 1 . 2]" 1
568 1 22 SER H 1 22 SER HB3 3.780 . 3.780 3.623 3.587 3.672 . 0 0 "[ . 1 . 2]" 1
569 1 22 SER H 1 23 GLY H 3.540 . 3.540 2.648 2.561 2.700 . 0 0 "[ . 1 . 2]" 1
570 1 22 SER H 1 23 GLY HA3 4.970 . 4.970 4.905 4.816 4.949 . 0 0 "[ . 1 . 2]" 1
571 1 22 SER H 1 24 LYS H 5.210 . 5.210 3.914 3.853 3.979 . 0 0 "[ . 1 . 2]" 1
572 1 22 SER H 1 24 LYS HG3 5.500 . 5.500 5.629 5.551 5.680 0.180 16 0 "[ . 1 . 2]" 1
573 1 22 SER H 1 25 LYS QD 5.500 . 5.500 4.545 3.973 4.986 . 0 0 "[ . 1 . 2]" 1
574 1 22 SER H 1 29 LEU MD1 5.500 . 5.500 4.591 4.442 4.741 . 0 0 "[ . 1 . 2]" 1
575 1 22 SER H 1 29 LEU MD2 4.620 . 4.620 4.458 4.278 4.629 0.009 18 0 "[ . 1 . 2]" 1
576 1 22 SER HA 1 22 SER QB 2.540 . 2.540 2.359 2.337 2.380 . 0 0 "[ . 1 . 2]" 1
577 1 22 SER HA 1 24 LYS H 4.970 . 4.970 4.290 4.134 4.414 . 0 0 "[ . 1 . 2]" 1
578 1 22 SER HA 1 25 LYS H 4.330 . 4.330 3.435 3.127 3.586 . 0 0 "[ . 1 . 2]" 1
579 1 22 SER HA 1 25 LYS QB 3.240 . 3.240 3.013 2.749 3.234 . 0 0 "[ . 1 . 2]" 1
580 1 22 SER HA 1 25 LYS QD 4.000 . 4.000 2.433 2.040 2.860 . 0 0 "[ . 1 . 2]" 1
581 1 22 SER HA 1 25 LYS QE 5.010 . 5.010 4.020 2.712 4.716 . 0 0 "[ . 1 . 2]" 1
582 1 22 SER HA 1 25 LYS HG2 5.080 . 5.080 4.709 4.265 5.097 0.017 17 0 "[ . 1 . 2]" 1
583 1 22 SER HA 1 25 LYS QG 4.320 . 4.320 3.248 2.771 4.072 . 0 0 "[ . 1 . 2]" 1
584 1 22 SER HA 1 25 LYS HG3 5.080 . 5.080 3.315 2.808 4.281 . 0 0 "[ . 1 . 2]" 1
585 1 22 SER HA 1 29 LEU MD2 5.240 . 5.240 4.572 4.373 4.757 . 0 0 "[ . 1 . 2]" 1
586 1 22 SER QB 1 23 GLY H 3.360 . 3.360 2.434 2.345 2.558 . 0 0 "[ . 1 . 2]" 1
587 1 22 SER QB 1 23 GLY HA3 4.660 . 4.660 4.231 4.161 4.353 . 0 0 "[ . 1 . 2]" 1
588 1 22 SER QB 1 24 LYS H 5.320 . 5.320 4.558 4.490 4.614 . 0 0 "[ . 1 . 2]" 1
589 1 22 SER QB 1 25 LYS QB 4.810 . 4.810 4.389 4.058 4.535 . 0 0 "[ . 1 . 2]" 1
590 1 22 SER QB 1 25 LYS QD 4.710 . 4.710 4.160 3.718 4.596 . 0 0 "[ . 1 . 2]" 1
591 1 22 SER QB 1 26 ARG QD 4.010 . 4.010 3.751 2.974 4.064 0.054 9 0 "[ . 1 . 2]" 1
592 1 22 SER HB2 1 23 GLY H 3.920 . 3.920 2.476 2.379 2.608 . 0 0 "[ . 1 . 2]" 1
593 1 22 SER HB2 1 23 GLY HA3 5.490 . 5.490 4.451 4.360 4.584 . 0 0 "[ . 1 . 2]" 1
594 1 22 SER HB2 1 29 LEU MD2 3.840 . 3.840 2.571 2.312 2.886 . 0 0 "[ . 1 . 2]" 1
595 1 22 SER HB3 1 23 GLY H 3.920 . 3.920 3.588 3.481 3.708 . 0 0 "[ . 1 . 2]" 1
596 1 22 SER HB3 1 23 GLY HA3 5.490 . 5.490 5.288 5.181 5.427 . 0 0 "[ . 1 . 2]" 1
597 1 22 SER HB3 1 29 LEU MD2 3.840 . 3.840 3.157 2.950 3.463 . 0 0 "[ . 1 . 2]" 1
598 1 23 GLY H 1 24 LYS H 4.150 . 4.150 2.611 2.569 2.652 . 0 0 "[ . 1 . 2]" 1
599 1 23 GLY H 1 26 ARG QD 5.500 . 5.500 4.838 4.462 5.145 . 0 0 "[ . 1 . 2]" 1
600 1 23 GLY H 1 29 LEU MD1 3.610 . 3.610 2.742 2.602 2.893 . 0 0 "[ . 1 . 2]" 1
601 1 23 GLY H 1 29 LEU MD2 3.480 . 3.480 2.776 2.622 2.948 . 0 0 "[ . 1 . 2]" 1
602 1 23 GLY H 1 29 LEU HG 4.310 . 4.310 3.627 3.509 3.746 . 0 0 "[ . 1 . 2]" 1
603 1 23 GLY H 1 55 LEU QD 5.440 . 5.440 4.166 4.069 4.279 . 0 0 "[ . 1 . 2]" 1
604 1 23 GLY H 1 60 VAL MG1 4.370 . 4.370 4.077 3.937 4.197 . 0 0 "[ . 1 . 2]" 1
605 1 23 GLY H 1 60 VAL MG2 5.210 . 5.210 3.833 3.730 3.970 . 0 0 "[ . 1 . 2]" 1
606 1 23 GLY HA2 1 25 LYS H 5.330 . 5.330 4.214 4.157 4.310 . 0 0 "[ . 1 . 2]" 1
607 1 23 GLY HA2 1 26 ARG H 4.150 . 4.150 3.440 3.320 3.528 . 0 0 "[ . 1 . 2]" 1
608 1 23 GLY HA2 1 26 ARG HB2 4.350 . 4.350 2.849 2.637 3.140 . 0 0 "[ . 1 . 2]" 1
609 1 23 GLY HA2 1 26 ARG HB3 5.500 . 5.500 4.540 4.292 4.846 . 0 0 "[ . 1 . 2]" 1
610 1 23 GLY HA2 1 26 ARG QD 4.360 . 4.360 3.025 2.776 3.239 . 0 0 "[ . 1 . 2]" 1
611 1 23 GLY HA2 1 26 ARG HG3 5.460 . 5.460 3.632 3.367 3.790 . 0 0 "[ . 1 . 2]" 1
612 1 23 GLY HA2 1 27 GLY H 4.450 . 4.450 3.354 3.250 3.472 . 0 0 "[ . 1 . 2]" 1
613 1 23 GLY HA2 1 28 VAL H 4.370 . 4.370 3.091 2.932 3.246 . 0 0 "[ . 1 . 2]" 1
614 1 23 GLY HA2 1 28 VAL MG1 5.500 . 5.500 4.556 4.378 4.715 . 0 0 "[ . 1 . 2]" 1
615 1 23 GLY HA2 1 28 VAL QG 4.570 . 4.570 4.355 4.221 4.464 . 0 0 "[ . 1 . 2]" 1
616 1 23 GLY HA2 1 28 VAL MG2 5.500 . 5.500 5.541 5.502 5.583 0.083 16 0 "[ . 1 . 2]" 1
617 1 23 GLY HA2 1 29 LEU HB2 4.950 . 4.950 4.586 4.479 4.733 . 0 0 "[ . 1 . 2]" 1
618 1 23 GLY HA2 1 29 LEU HB3 5.500 . 5.500 5.103 4.943 5.245 . 0 0 "[ . 1 . 2]" 1
619 1 23 GLY HA2 1 29 LEU MD1 3.570 . 3.570 3.337 3.217 3.473 . 0 0 "[ . 1 . 2]" 1
620 1 23 GLY HA2 1 29 LEU MD2 3.230 . 3.230 2.729 2.551 2.803 . 0 0 "[ . 1 . 2]" 1
621 1 23 GLY HA2 1 29 LEU HG 3.550 . 3.550 2.189 2.062 2.342 . 0 0 "[ . 1 . 2]" 1
622 1 23 GLY HA2 1 60 VAL HB 5.500 . 5.500 5.428 5.319 5.512 0.012 5 0 "[ . 1 . 2]" 1
623 1 23 GLY HA2 1 60 VAL MG1 3.420 . 3.420 2.729 2.619 2.826 . 0 0 "[ . 1 . 2]" 1
624 1 23 GLY HA3 1 25 LYS H 5.500 . 5.500 4.633 4.585 4.708 . 0 0 "[ . 1 . 2]" 1
625 1 23 GLY HA3 1 26 ARG H 5.470 . 5.470 4.651 4.548 4.745 . 0 0 "[ . 1 . 2]" 1
626 1 23 GLY HA3 1 26 ARG HB2 5.490 . 5.490 4.504 4.290 4.786 . 0 0 "[ . 1 . 2]" 1
627 1 23 GLY HA3 1 28 VAL H 5.460 . 5.460 4.272 4.110 4.478 . 0 0 "[ . 1 . 2]" 1
628 1 23 GLY HA3 1 29 LEU HB2 4.830 . 4.830 4.337 4.175 4.434 . 0 0 "[ . 1 . 2]" 1
629 1 23 GLY HA3 1 29 LEU MD1 3.400 . 3.400 2.461 2.334 2.588 . 0 0 "[ . 1 . 2]" 1
630 1 23 GLY HA3 1 29 LEU MD2 3.420 . 3.420 3.108 2.944 3.236 . 0 0 "[ . 1 . 2]" 1
631 1 23 GLY HA3 1 29 LEU HG 3.700 . 3.700 2.238 2.100 2.354 . 0 0 "[ . 1 . 2]" 1
632 1 23 GLY HA3 1 60 VAL HB 5.500 . 5.500 4.207 4.070 4.344 . 0 0 "[ . 1 . 2]" 1
633 1 23 GLY HA3 1 60 VAL MG1 3.420 . 3.420 2.199 2.083 2.325 . 0 0 "[ . 1 . 2]" 1
634 1 23 GLY HA3 1 60 VAL MG2 3.990 . 3.990 2.351 2.255 2.490 . 0 0 "[ . 1 . 2]" 1
635 1 24 LYS H 1 24 LYS HB2 3.490 . 3.490 2.331 2.218 2.419 . 0 0 "[ . 1 . 2]" 1
636 1 24 LYS H 1 24 LYS HB3 3.700 . 3.700 3.514 3.464 3.553 . 0 0 "[ . 1 . 2]" 1
637 1 24 LYS H 1 24 LYS HD2 4.920 . 4.920 4.022 3.956 4.196 . 0 0 "[ . 1 . 2]" 1
638 1 24 LYS H 1 24 LYS HD3 4.780 . 4.780 4.559 4.488 4.645 . 0 0 "[ . 1 . 2]" 1
639 1 24 LYS H 1 24 LYS HE2 5.500 . 5.500 5.507 5.294 5.585 0.085 8 0 "[ . 1 . 2]" 1
640 1 24 LYS H 1 24 LYS QE 4.790 . 4.790 4.655 4.610 4.712 . 0 0 "[ . 1 . 2]" 1
641 1 24 LYS H 1 24 LYS HE3 5.500 . 5.500 5.023 4.948 5.121 . 0 0 "[ . 1 . 2]" 1
642 1 24 LYS H 1 24 LYS HG2 3.850 . 3.850 2.223 2.159 2.310 . 0 0 "[ . 1 . 2]" 1
643 1 24 LYS H 1 24 LYS HG3 3.580 . 3.580 3.370 3.287 3.435 . 0 0 "[ . 1 . 2]" 1
644 1 24 LYS H 1 25 LYS H 3.760 . 3.760 2.687 2.654 2.722 . 0 0 "[ . 1 . 2]" 1
645 1 24 LYS H 1 25 LYS QB 4.650 . 4.650 4.667 4.624 4.688 0.038 2 0 "[ . 1 . 2]" 1
646 1 24 LYS H 1 25 LYS QD 5.500 . 5.500 5.337 4.698 5.534 0.034 19 0 "[ . 1 . 2]" 1
647 1 24 LYS H 1 25 LYS QG 5.340 . 5.340 4.175 3.945 4.464 . 0 0 "[ . 1 . 2]" 1
648 1 24 LYS H 1 26 ARG H 5.230 . 5.230 4.108 4.066 4.158 . 0 0 "[ . 1 . 2]" 1
649 1 24 LYS H 1 29 LEU MD1 4.510 . 4.510 4.417 4.257 4.521 0.011 15 0 "[ . 1 . 2]" 1
650 1 24 LYS H 1 29 LEU MD2 5.500 . 5.500 4.833 4.716 4.966 . 0 0 "[ . 1 . 2]" 1
651 1 24 LYS H 1 29 LEU HG 5.500 . 5.500 4.974 4.863 5.087 . 0 0 "[ . 1 . 2]" 1
652 1 24 LYS H 1 60 VAL MG2 3.610 . 3.610 3.007 2.854 3.118 . 0 0 "[ . 1 . 2]" 1
653 1 24 LYS HA 1 24 LYS HD2 3.330 . 3.330 2.198 2.029 2.427 . 0 0 "[ . 1 . 2]" 1
654 1 24 LYS HA 1 24 LYS HD3 4.100 . 4.100 3.681 3.505 3.927 . 0 0 "[ . 1 . 2]" 1
655 1 24 LYS HA 1 24 LYS HE2 5.500 . 5.500 4.502 4.326 4.685 . 0 0 "[ . 1 . 2]" 1
656 1 24 LYS HA 1 24 LYS HE3 5.500 . 5.500 3.424 3.074 3.812 . 0 0 "[ . 1 . 2]" 1
657 1 24 LYS HA 1 24 LYS HG2 3.290 . 3.290 2.682 2.507 2.773 . 0 0 "[ . 1 . 2]" 1
658 1 24 LYS HA 1 24 LYS HG3 3.990 . 3.990 3.712 3.623 3.783 . 0 0 "[ . 1 . 2]" 1
659 1 24 LYS HA 1 26 ARG H 5.080 . 5.080 4.388 4.277 4.511 . 0 0 "[ . 1 . 2]" 1
660 1 24 LYS HA 1 27 GLY H 4.380 . 4.380 3.853 3.612 4.065 . 0 0 "[ . 1 . 2]" 1
661 1 24 LYS HA 1 60 VAL MG2 3.110 . 3.110 2.669 2.458 2.850 . 0 0 "[ . 1 . 2]" 1
662 1 24 LYS HB2 1 24 LYS QE 3.910 . 3.910 3.304 3.242 3.350 . 0 0 "[ . 1 . 2]" 1
663 1 24 LYS HB2 1 25 LYS H 3.940 . 3.940 2.805 2.696 2.928 . 0 0 "[ . 1 . 2]" 1
664 1 24 LYS HB2 1 26 ARG H 5.100 . 5.100 5.002 4.952 5.104 0.004 9 0 "[ . 1 . 2]" 1
665 1 24 LYS HB2 1 60 VAL MG2 4.490 . 4.490 4.343 4.256 4.447 . 0 0 "[ . 1 . 2]" 1
666 1 24 LYS HB3 1 24 LYS QE 3.840 . 3.840 1.952 1.878 2.033 . 0 0 "[ . 1 . 2]" 1
667 1 24 LYS HB3 1 25 LYS H 4.260 . 4.260 3.698 3.636 3.797 . 0 0 "[ . 1 . 2]" 1
668 1 24 LYS HB3 1 26 ARG H 5.500 . 5.500 5.537 5.497 5.581 0.081 20 0 "[ . 1 . 2]" 1
669 1 24 LYS HB3 1 60 VAL MG2 4.540 . 4.540 4.447 4.282 4.558 0.018 15 0 "[ . 1 . 2]" 1
670 1 24 LYS HD2 1 58 GLN HA 5.090 . 5.090 5.047 4.787 5.138 0.048 16 0 "[ . 1 . 2]" 1
671 1 24 LYS HD2 1 59 GLY H 4.980 . 4.980 4.197 3.962 4.616 . 0 0 "[ . 1 . 2]" 1
672 1 24 LYS HD2 1 60 VAL MG2 4.200 . 4.200 2.814 2.652 3.154 . 0 0 "[ . 1 . 2]" 1
673 1 24 LYS HD3 1 58 GLN HA 4.360 . 4.360 4.079 3.770 4.371 0.011 20 0 "[ . 1 . 2]" 1
674 1 24 LYS HD3 1 58 GLN HB3 3.870 . 3.870 1.956 1.893 2.084 . 0 0 "[ . 1 . 2]" 1
675 1 24 LYS HD3 1 59 GLY H 5.500 . 5.500 4.069 3.789 4.469 . 0 0 "[ . 1 . 2]" 1
676 1 24 LYS HD3 1 60 VAL MG2 4.210 . 4.210 3.126 2.923 3.369 . 0 0 "[ . 1 . 2]" 1
677 1 24 LYS QE 1 24 LYS HG2 3.440 . 3.440 3.266 3.231 3.297 . 0 0 "[ . 1 . 2]" 1
678 1 24 LYS QE 1 24 LYS HG3 2.900 . 2.900 2.430 2.366 2.574 . 0 0 "[ . 1 . 2]" 1
679 1 24 LYS QE 1 58 GLN HA 5.130 . 5.130 4.676 4.087 5.114 . 0 0 "[ . 1 . 2]" 1
680 1 24 LYS QE 1 58 GLN QG 5.180 . 5.180 4.694 4.332 5.200 0.020 6 0 "[ . 1 . 2]" 1
681 1 24 LYS QE 1 59 GLY H 5.340 . 5.340 5.424 5.394 5.456 0.116 1 0 "[ . 1 . 2]" 1
682 1 24 LYS QE 1 60 VAL MG2 4.500 . 4.500 4.309 4.185 4.447 . 0 0 "[ . 1 . 2]" 1
683 1 24 LYS HE2 1 24 LYS HG2 3.980 . 3.980 3.669 3.617 3.730 . 0 0 "[ . 1 . 2]" 1
684 1 24 LYS HE2 1 24 LYS HG3 3.330 . 3.330 2.577 2.462 2.687 . 0 0 "[ . 1 . 2]" 1
685 1 24 LYS HE2 1 58 GLN HB3 4.360 . 4.360 3.308 2.816 4.031 . 0 0 "[ . 1 . 2]" 1
686 1 24 LYS HE2 1 60 VAL MG2 5.220 . 5.220 4.939 4.773 5.066 . 0 0 "[ . 1 . 2]" 1
687 1 24 LYS HE3 1 24 LYS HG2 3.980 . 3.980 3.665 3.597 3.720 . 0 0 "[ . 1 . 2]" 1
688 1 24 LYS HE3 1 24 LYS HG3 3.330 . 3.330 3.018 2.706 3.346 0.016 6 0 "[ . 1 . 2]" 1
689 1 24 LYS HE3 1 58 GLN HB3 4.360 . 4.360 4.372 4.253 4.430 0.070 14 0 "[ . 1 . 2]" 1
690 1 24 LYS HE3 1 60 VAL MG2 5.220 . 5.220 4.765 4.476 5.019 . 0 0 "[ . 1 . 2]" 1
691 1 24 LYS HG2 1 25 LYS H 5.360 . 5.360 4.434 4.382 4.480 . 0 0 "[ . 1 . 2]" 1
692 1 24 LYS HG2 1 58 GLN HB3 4.390 . 4.390 4.109 3.764 4.391 0.001 20 0 "[ . 1 . 2]" 1
693 1 24 LYS HG2 1 59 GLY H 5.500 . 5.500 5.484 5.237 5.543 0.043 6 0 "[ . 1 . 2]" 1
694 1 24 LYS HG2 1 60 VAL MG2 3.120 . 3.120 2.684 2.503 2.745 . 0 0 "[ . 1 . 2]" 1
695 1 24 LYS HG3 1 60 VAL MG2 4.050 . 4.050 4.030 3.862 4.098 0.048 1 0 "[ . 1 . 2]" 1
696 1 25 LYS H 1 25 LYS QB 2.980 . 2.980 2.346 2.256 2.413 . 0 0 "[ . 1 . 2]" 1
697 1 25 LYS H 1 25 LYS QD 4.350 . 4.350 3.628 3.141 3.806 . 0 0 "[ . 1 . 2]" 1
698 1 25 LYS H 1 25 LYS QE 4.920 . 4.920 4.601 4.020 4.901 . 0 0 "[ . 1 . 2]" 1
699 1 25 LYS H 1 25 LYS HG2 4.130 . 4.130 3.507 3.240 3.829 . 0 0 "[ . 1 . 2]" 1
700 1 25 LYS H 1 25 LYS QG 3.630 . 3.630 2.217 2.054 2.432 . 0 0 "[ . 1 . 2]" 1
701 1 25 LYS H 1 25 LYS HG3 4.130 . 4.130 2.242 2.074 2.460 . 0 0 "[ . 1 . 2]" 1
702 1 25 LYS H 1 26 ARG H 3.700 . 3.700 2.395 2.288 2.437 . 0 0 "[ . 1 . 2]" 1
703 1 25 LYS H 1 26 ARG QD 5.500 . 5.500 5.394 5.044 5.537 0.037 14 0 "[ . 1 . 2]" 1
704 1 25 LYS H 1 26 ARG HG2 5.500 . 5.500 5.503 5.376 5.586 0.086 8 0 "[ . 1 . 2]" 1
705 1 25 LYS H 1 26 ARG HG3 4.940 . 4.940 4.025 3.863 4.196 . 0 0 "[ . 1 . 2]" 1
706 1 25 LYS H 1 27 GLY H 4.590 . 4.590 4.054 3.883 4.200 . 0 0 "[ . 1 . 2]" 1
707 1 25 LYS HA 1 25 LYS QB 2.710 . 2.710 2.368 2.333 2.409 . 0 0 "[ . 1 . 2]" 1
708 1 25 LYS HA 1 25 LYS QD 5.050 . 5.050 4.196 3.974 4.289 . 0 0 "[ . 1 . 2]" 1
709 1 25 LYS HA 1 25 LYS QE 4.620 . 4.620 4.262 3.913 4.640 0.020 2 0 "[ . 1 . 2]" 1
710 1 25 LYS HA 1 25 LYS HG2 3.800 . 3.800 2.619 2.503 2.781 . 0 0 "[ . 1 . 2]" 1
711 1 25 LYS HA 1 25 LYS QG 3.320 . 3.320 2.457 2.351 2.547 . 0 0 "[ . 1 . 2]" 1
712 1 25 LYS HA 1 25 LYS HG3 3.800 . 3.800 3.002 2.536 3.228 . 0 0 "[ . 1 . 2]" 1
713 1 25 LYS QB 1 25 LYS QD 2.920 . 2.920 2.284 2.093 2.356 . 0 0 "[ . 1 . 2]" 1
714 1 25 LYS QB 1 25 LYS QE 4.050 . 4.050 2.265 1.939 3.456 . 0 0 "[ . 1 . 2]" 1
715 1 25 LYS QB 1 26 ARG H 3.210 . 3.210 2.477 2.293 2.740 . 0 0 "[ . 1 . 2]" 1
716 1 25 LYS QD 1 26 ARG H 5.500 . 5.500 4.623 4.346 4.889 . 0 0 "[ . 1 . 2]" 1
717 1 25 LYS QE 1 25 LYS QG 3.300 . 3.300 2.548 2.008 2.864 . 0 0 "[ . 1 . 2]" 1
718 1 25 LYS QE 1 26 ARG H 5.500 . 5.500 5.136 4.735 5.629 0.129 12 0 "[ . 1 . 2]" 1
719 1 25 LYS QG 1 26 ARG H 4.510 . 4.510 3.936 3.767 4.192 . 0 0 "[ . 1 . 2]" 1
720 1 25 LYS HG2 1 26 ARG H 5.370 . 5.370 4.904 4.737 5.181 . 0 0 "[ . 1 . 2]" 1
721 1 25 LYS HG3 1 26 ARG H 5.370 . 5.370 4.146 3.950 4.429 . 0 0 "[ . 1 . 2]" 1
722 1 26 ARG H 1 26 ARG HB2 3.690 . 3.690 2.556 2.433 2.629 . 0 0 "[ . 1 . 2]" 1
723 1 26 ARG H 1 26 ARG HB3 3.770 . 3.770 3.644 3.590 3.687 . 0 0 "[ . 1 . 2]" 1
724 1 26 ARG H 1 26 ARG QD 3.910 . 3.910 3.809 3.609 3.921 0.011 12 0 "[ . 1 . 2]" 1
725 1 26 ARG H 1 26 ARG HG2 3.720 . 3.720 3.496 3.375 3.568 . 0 0 "[ . 1 . 2]" 1
726 1 26 ARG H 1 26 ARG HG3 3.690 . 3.690 2.308 2.157 2.495 . 0 0 "[ . 1 . 2]" 1
727 1 26 ARG H 1 27 GLY H 3.390 . 3.390 2.439 2.409 2.480 . 0 0 "[ . 1 . 2]" 1
728 1 26 ARG H 1 27 GLY HA2 5.120 . 5.120 4.599 4.576 4.620 . 0 0 "[ . 1 . 2]" 1
729 1 26 ARG H 1 27 GLY QA 4.250 . 4.250 4.273 4.256 4.285 0.035 1 0 "[ . 1 . 2]" 1
730 1 26 ARG H 1 27 GLY HA3 5.120 . 5.120 5.073 5.055 5.103 . 0 0 "[ . 1 . 2]" 1
731 1 26 ARG H 1 28 VAL H 4.540 . 4.540 3.789 3.721 3.934 . 0 0 "[ . 1 . 2]" 1
732 1 26 ARG HA 1 26 ARG QD 4.270 . 4.270 4.045 3.914 4.264 . 0 0 "[ . 1 . 2]" 1
733 1 26 ARG HA 1 26 ARG HG2 3.450 . 3.450 2.649 2.576 2.734 . 0 0 "[ . 1 . 2]" 1
734 1 26 ARG HA 1 26 ARG HG3 3.500 . 3.500 3.174 3.032 3.259 . 0 0 "[ . 1 . 2]" 1
735 1 26 ARG HA 1 27 GLY QA 5.170 . 5.170 4.342 4.325 4.395 . 0 0 "[ . 1 . 2]" 1
736 1 26 ARG HA 1 28 VAL H 4.930 . 4.930 4.272 4.137 4.472 . 0 0 "[ . 1 . 2]" 1
737 1 26 ARG HA 1 28 VAL QG 5.410 . 5.410 4.112 3.875 4.442 . 0 0 "[ . 1 . 2]" 1
738 1 26 ARG HB2 1 26 ARG QD 2.900 . 2.900 2.240 2.161 2.382 . 0 0 "[ . 1 . 2]" 1
739 1 26 ARG HB2 1 27 GLY H 3.920 . 3.920 2.325 2.161 2.459 . 0 0 "[ . 1 . 2]" 1
740 1 26 ARG HB2 1 27 GLY QA 4.820 . 4.820 3.940 3.853 4.056 . 0 0 "[ . 1 . 2]" 1
741 1 26 ARG HB2 1 28 VAL H 3.740 . 3.740 1.951 1.878 2.098 . 0 0 "[ . 1 . 2]" 1
742 1 26 ARG HB2 1 28 VAL QG 4.080 . 4.080 2.864 2.628 3.050 . 0 0 "[ . 1 . 2]" 1
743 1 26 ARG HB3 1 26 ARG QD 3.780 . 3.780 2.486 2.145 2.902 . 0 0 "[ . 1 . 2]" 1
744 1 26 ARG HB3 1 27 GLY H 4.210 . 4.210 3.499 3.370 3.595 . 0 0 "[ . 1 . 2]" 1
745 1 26 ARG HB3 1 27 GLY QA 5.340 . 5.340 4.379 4.254 4.498 . 0 0 "[ . 1 . 2]" 1
746 1 26 ARG HB3 1 28 VAL H 4.140 . 4.140 2.965 2.658 3.306 . 0 0 "[ . 1 . 2]" 1
747 1 26 ARG HB3 1 28 VAL QG 3.940 . 3.940 2.269 2.046 2.631 . 0 0 "[ . 1 . 2]" 1
748 1 26 ARG QD 1 26 ARG HG3 2.580 . 2.580 2.283 2.152 2.397 . 0 0 "[ . 1 . 2]" 1
749 1 26 ARG QD 1 27 GLY H 4.780 . 4.780 4.281 4.056 4.533 . 0 0 "[ . 1 . 2]" 1
750 1 26 ARG QD 1 28 VAL HB 5.500 . 5.500 5.318 4.960 5.595 0.095 1 0 "[ . 1 . 2]" 1
751 1 26 ARG QD 1 28 VAL QG 3.730 . 3.730 2.947 2.539 3.288 . 0 0 "[ . 1 . 2]" 1
752 1 26 ARG QD 1 29 LEU MD2 4.220 . 4.220 2.625 2.090 2.894 . 0 0 "[ . 1 . 2]" 1
753 1 26 ARG HG2 1 28 VAL H 5.500 . 5.500 4.876 4.747 4.994 . 0 0 "[ . 1 . 2]" 1
754 1 26 ARG HG3 1 27 GLY H 4.430 . 4.430 4.001 3.857 4.186 . 0 0 "[ . 1 . 2]" 1
755 1 26 ARG HG3 1 28 VAL H 5.070 . 5.070 4.321 4.249 4.471 . 0 0 "[ . 1 . 2]" 1
756 1 26 ARG HG3 1 28 VAL QG 5.320 . 5.320 4.512 4.362 4.726 . 0 0 "[ . 1 . 2]" 1
757 1 27 GLY H 1 28 VAL H 3.600 . 3.600 2.029 1.971 2.082 . 0 0 "[ . 1 . 2]" 1
758 1 27 GLY H 1 28 VAL HA 5.500 . 5.500 4.588 4.491 4.655 . 0 0 "[ . 1 . 2]" 1
759 1 27 GLY H 1 28 VAL MG1 5.500 . 5.500 3.960 3.833 4.033 . 0 0 "[ . 1 . 2]" 1
760 1 27 GLY H 1 28 VAL QG 4.450 . 4.450 3.880 3.767 3.943 . 0 0 "[ . 1 . 2]" 1
761 1 27 GLY H 1 28 VAL MG2 5.500 . 5.500 5.562 5.537 5.603 0.103 18 0 "[ . 1 . 2]" 1
762 1 27 GLY H 1 29 LEU MD2 5.500 . 5.500 5.387 5.286 5.466 . 0 0 "[ . 1 . 2]" 1
763 1 27 GLY H 1 29 LEU HG 5.500 . 5.500 5.087 5.006 5.177 . 0 0 "[ . 1 . 2]" 1
764 1 27 GLY H 1 60 VAL HA 5.170 . 5.170 4.323 4.117 4.475 . 0 0 "[ . 1 . 2]" 1
765 1 27 GLY H 1 60 VAL MG1 4.740 . 4.740 3.727 3.602 3.832 . 0 0 "[ . 1 . 2]" 1
766 1 27 GLY H 1 60 VAL MG2 5.270 . 5.270 3.998 3.913 4.095 . 0 0 "[ . 1 . 2]" 1
767 1 27 GLY QA 1 60 VAL MG1 4.320 . 4.320 3.779 3.628 3.904 . 0 0 "[ . 1 . 2]" 1
768 1 27 GLY QA 1 60 VAL MG2 4.530 . 4.530 3.781 3.745 3.811 . 0 0 "[ . 1 . 2]" 1
769 1 27 GLY HA2 1 28 VAL HB 5.500 . 5.500 4.693 4.661 4.746 . 0 0 "[ . 1 . 2]" 1
770 1 27 GLY HA2 1 28 VAL MG1 5.500 . 5.500 4.749 4.524 4.851 . 0 0 "[ . 1 . 2]" 1
771 1 27 GLY HA2 1 28 VAL MG2 5.500 . 5.500 5.566 5.536 5.606 0.106 13 0 "[ . 1 . 2]" 1
772 1 27 GLY HA2 1 60 VAL MG1 5.160 . 5.160 3.926 3.754 4.064 . 0 0 "[ . 1 . 2]" 1
773 1 27 GLY HA2 1 60 VAL MG2 5.310 . 5.310 3.867 3.826 3.900 . 0 0 "[ . 1 . 2]" 1
774 1 27 GLY HA3 1 28 VAL HB 5.500 . 5.500 3.949 3.849 4.079 . 0 0 "[ . 1 . 2]" 1
775 1 27 GLY HA3 1 28 VAL MG1 5.500 . 5.500 4.056 3.858 4.169 . 0 0 "[ . 1 . 2]" 1
776 1 27 GLY HA3 1 28 VAL MG2 5.500 . 5.500 5.224 5.120 5.347 . 0 0 "[ . 1 . 2]" 1
777 1 27 GLY HA3 1 60 VAL MG1 5.160 . 5.160 4.924 4.804 5.050 . 0 0 "[ . 1 . 2]" 1
778 1 27 GLY HA3 1 60 VAL MG2 5.310 . 5.310 5.347 5.327 5.381 0.071 8 0 "[ . 1 . 2]" 1
779 1 28 VAL H 1 28 VAL HB 3.980 . 3.980 3.224 3.111 3.386 . 0 0 "[ . 1 . 2]" 1
780 1 28 VAL H 1 28 VAL MG1 4.140 . 4.140 2.565 2.412 2.661 . 0 0 "[ . 1 . 2]" 1
781 1 28 VAL H 1 28 VAL QG 3.360 . 3.360 2.534 2.391 2.622 . 0 0 "[ . 1 . 2]" 1
782 1 28 VAL H 1 28 VAL MG2 4.140 . 4.140 3.953 3.915 3.993 . 0 0 "[ . 1 . 2]" 1
783 1 28 VAL H 1 29 LEU H 4.930 . 4.930 4.220 4.163 4.268 . 0 0 "[ . 1 . 2]" 1
784 1 28 VAL H 1 29 LEU MD1 5.500 . 5.500 5.352 5.241 5.514 0.014 10 0 "[ . 1 . 2]" 1
785 1 28 VAL H 1 29 LEU MD2 4.980 . 4.980 4.589 4.461 4.702 . 0 0 "[ . 1 . 2]" 1
786 1 28 VAL H 1 60 VAL HA 5.500 . 5.500 4.070 3.882 4.336 . 0 0 "[ . 1 . 2]" 1
787 1 28 VAL H 1 60 VAL MG1 4.160 . 4.160 2.977 2.833 3.205 . 0 0 "[ . 1 . 2]" 1
788 1 28 VAL HA 1 28 VAL MG1 3.420 . 3.420 3.205 3.180 3.227 . 0 0 "[ . 1 . 2]" 1
789 1 28 VAL HA 1 28 VAL MG2 3.420 . 3.420 2.230 2.207 2.280 . 0 0 "[ . 1 . 2]" 1
790 1 28 VAL HA 1 29 LEU H 3.020 . 3.020 2.204 2.150 2.287 . 0 0 "[ . 1 . 2]" 1
791 1 28 VAL HA 1 29 LEU HA 4.970 . 4.970 4.426 4.375 4.469 . 0 0 "[ . 1 . 2]" 1
792 1 28 VAL HA 1 29 LEU HB2 5.080 . 5.080 4.240 4.111 4.292 . 0 0 "[ . 1 . 2]" 1
793 1 28 VAL HA 1 29 LEU HB3 5.500 . 5.500 5.564 5.532 5.579 0.079 4 0 "[ . 1 . 2]" 1
794 1 28 VAL HA 1 29 LEU HG 5.500 . 5.500 4.221 4.129 4.286 . 0 0 "[ . 1 . 2]" 1
795 1 28 VAL HA 1 60 VAL HA 4.570 . 4.570 3.473 3.381 3.586 . 0 0 "[ . 1 . 2]" 1
796 1 28 VAL HA 1 60 VAL MG1 3.450 . 3.450 2.454 2.376 2.547 . 0 0 "[ . 1 . 2]" 1
797 1 28 VAL HA 1 61 GLU H 3.590 . 3.590 2.318 2.151 2.474 . 0 0 "[ . 1 . 2]" 1
798 1 28 VAL HA 1 61 GLU HA 4.880 . 4.880 4.376 4.091 4.453 . 0 0 "[ . 1 . 2]" 1
799 1 28 VAL HA 1 61 GLU HB2 4.000 . 4.000 3.003 2.830 3.191 . 0 0 "[ . 1 . 2]" 1
800 1 28 VAL HA 1 61 GLU HB3 4.430 . 4.430 4.356 4.081 4.478 0.048 17 0 "[ . 1 . 2]" 1
801 1 28 VAL HA 1 61 GLU HG3 5.460 . 5.460 4.575 4.346 4.982 . 0 0 "[ . 1 . 2]" 1
802 1 28 VAL HA 1 62 LEU HA 5.190 . 5.190 4.106 3.863 4.320 . 0 0 "[ . 1 . 2]" 1
803 1 28 VAL HB 1 29 LEU H 4.220 . 4.220 3.960 3.912 4.018 . 0 0 "[ . 1 . 2]" 1
804 1 28 VAL HB 1 29 LEU HA 5.500 . 5.500 5.582 5.546 5.612 0.112 6 0 "[ . 1 . 2]" 1
805 1 28 VAL HB 1 60 VAL HA 5.490 . 5.490 5.125 5.004 5.191 . 0 0 "[ . 1 . 2]" 1
806 1 28 VAL HB 1 60 VAL MG1 4.570 . 4.570 4.433 4.349 4.507 . 0 0 "[ . 1 . 2]" 1
807 1 28 VAL HB 1 61 GLU H 4.830 . 4.830 3.790 3.523 3.952 . 0 0 "[ . 1 . 2]" 1
808 1 28 VAL HB 1 63 ILE H 5.500 . 5.500 5.560 5.529 5.587 0.087 15 0 "[ . 1 . 2]" 1
809 1 28 VAL HB 1 63 ILE QG 4.870 . 4.870 4.751 4.622 4.871 0.001 13 0 "[ . 1 . 2]" 1
810 1 28 VAL QG 1 29 LEU H 3.190 . 3.190 2.034 1.940 2.177 . 0 0 "[ . 1 . 2]" 1
811 1 28 VAL QG 1 29 LEU HA 4.360 . 4.360 3.105 3.044 3.180 . 0 0 "[ . 1 . 2]" 1
812 1 28 VAL QG 1 30 THR HA 4.840 . 4.840 4.089 4.012 4.180 . 0 0 "[ . 1 . 2]" 1
813 1 28 VAL QG 1 61 GLU H 4.050 . 4.050 3.406 3.241 3.520 . 0 0 "[ . 1 . 2]" 1
814 1 28 VAL QG 1 61 GLU HA 4.450 . 4.450 4.266 3.969 4.420 . 0 0 "[ . 1 . 2]" 1
815 1 28 VAL QG 1 61 GLU HB2 3.280 . 3.280 2.382 2.039 2.606 . 0 0 "[ . 1 . 2]" 1
816 1 28 VAL QG 1 61 GLU HB3 3.260 . 3.260 3.175 2.770 3.312 0.052 20 0 "[ . 1 . 2]" 1
817 1 28 VAL QG 1 62 LEU H 5.200 . 5.200 4.251 3.450 4.518 . 0 0 "[ . 1 . 2]" 1
818 1 28 VAL QG 1 62 LEU HA 4.480 . 4.480 3.311 3.024 3.600 . 0 0 "[ . 1 . 2]" 1
819 1 28 VAL QG 1 63 ILE H 4.590 . 4.590 2.694 2.602 2.766 . 0 0 "[ . 1 . 2]" 1
820 1 28 VAL QG 1 68 GLU HA 5.440 . 5.440 4.365 3.871 5.476 0.036 20 0 "[ . 1 . 2]" 1
821 1 28 VAL QG 1 69 THR H 5.020 . 5.020 4.173 3.304 5.083 0.063 4 0 "[ . 1 . 2]" 1
822 1 28 VAL MG1 1 29 LEU H 3.800 . 3.800 3.439 3.343 3.587 . 0 0 "[ . 1 . 2]" 1
823 1 28 VAL MG1 1 30 THR H 5.500 . 5.500 4.553 4.316 4.761 . 0 0 "[ . 1 . 2]" 1
824 1 28 VAL MG1 1 30 THR HA 5.500 . 5.500 5.533 5.509 5.563 0.063 2 0 "[ . 1 . 2]" 1
825 1 28 VAL MG1 1 60 VAL HA 5.500 . 5.500 5.553 5.470 5.604 0.104 13 0 "[ . 1 . 2]" 1
826 1 28 VAL MG2 1 29 LEU H 3.800 . 3.800 2.049 1.952 2.199 . 0 0 "[ . 1 . 2]" 1
827 1 28 VAL MG2 1 30 THR H 5.500 . 5.500 4.277 4.081 4.506 . 0 0 "[ . 1 . 2]" 1
828 1 28 VAL MG2 1 30 THR HA 5.500 . 5.500 4.213 4.118 4.327 . 0 0 "[ . 1 . 2]" 1
829 1 28 VAL MG2 1 60 VAL HA 5.500 . 5.500 5.016 4.918 5.108 . 0 0 "[ . 1 . 2]" 1
830 1 29 LEU H 1 29 LEU HB2 3.720 . 3.720 2.674 2.556 2.750 . 0 0 "[ . 1 . 2]" 1
831 1 29 LEU H 1 29 LEU HB3 4.100 . 4.100 3.735 3.675 3.770 . 0 0 "[ . 1 . 2]" 1
832 1 29 LEU H 1 29 LEU MD1 4.800 . 4.800 4.316 4.188 4.382 . 0 0 "[ . 1 . 2]" 1
833 1 29 LEU H 1 29 LEU MD2 4.310 . 4.310 4.193 4.147 4.229 . 0 0 "[ . 1 . 2]" 1
834 1 29 LEU H 1 29 LEU HG 4.340 . 4.340 3.618 3.516 3.703 . 0 0 "[ . 1 . 2]" 1
835 1 29 LEU H 1 30 THR H 5.210 . 5.210 4.173 4.066 4.292 . 0 0 "[ . 1 . 2]" 1
836 1 29 LEU H 1 34 ILE MD 5.180 . 5.180 4.423 4.231 4.599 . 0 0 "[ . 1 . 2]" 1
837 1 29 LEU H 1 60 VAL HB 5.500 . 5.500 5.361 5.152 5.504 0.004 20 0 "[ . 1 . 2]" 1
838 1 29 LEU H 1 60 VAL MG1 3.550 . 3.550 2.789 2.632 2.907 . 0 0 "[ . 1 . 2]" 1
839 1 29 LEU H 1 61 GLU H 4.550 . 4.550 4.097 3.882 4.289 . 0 0 "[ . 1 . 2]" 1
840 1 29 LEU H 1 62 LEU HA 3.910 . 3.910 2.637 2.438 2.826 . 0 0 "[ . 1 . 2]" 1
841 1 29 LEU H 1 62 LEU QD 3.920 . 3.920 3.093 2.955 3.261 . 0 0 "[ . 1 . 2]" 1
842 1 29 LEU H 1 63 ILE H 4.720 . 4.720 3.017 2.841 3.205 . 0 0 "[ . 1 . 2]" 1
843 1 29 LEU H 1 63 ILE MD 4.990 . 4.990 4.402 4.129 4.554 . 0 0 "[ . 1 . 2]" 1
844 1 29 LEU H 1 63 ILE MG 4.460 . 4.460 4.108 3.891 4.433 . 0 0 "[ . 1 . 2]" 1
845 1 29 LEU HA 1 29 LEU MD1 3.860 . 3.860 3.872 3.837 3.888 0.028 4 0 "[ . 1 . 2]" 1
846 1 29 LEU HA 1 29 LEU MD2 2.820 . 2.820 2.104 2.015 2.151 . 0 0 "[ . 1 . 2]" 1
847 1 29 LEU HA 1 29 LEU HG 3.520 . 3.520 2.993 2.921 3.069 . 0 0 "[ . 1 . 2]" 1
848 1 29 LEU HA 1 30 THR H 3.040 . 3.040 2.277 2.208 2.351 . 0 0 "[ . 1 . 2]" 1
849 1 29 LEU HA 1 30 THR MG 4.460 . 4.460 4.067 3.793 4.344 . 0 0 "[ . 1 . 2]" 1
850 1 29 LEU HA 1 33 GLU HG2 4.710 . 4.710 4.169 3.747 4.556 . 0 0 "[ . 1 . 2]" 1
851 1 29 LEU HA 1 33 GLU HG3 5.100 . 5.100 4.640 4.011 5.139 0.039 6 0 "[ . 1 . 2]" 1
852 1 29 LEU HA 1 34 ILE QG 5.340 . 5.340 4.551 4.303 4.810 . 0 0 "[ . 1 . 2]" 1
853 1 29 LEU HA 1 60 VAL MG1 4.480 . 4.480 4.000 3.902 4.092 . 0 0 "[ . 1 . 2]" 1
854 1 29 LEU HA 1 62 LEU QD 5.320 . 5.320 4.448 4.357 4.544 . 0 0 "[ . 1 . 2]" 1
855 1 29 LEU HB2 1 29 LEU MD1 2.770 . 2.770 2.256 2.211 2.305 . 0 0 "[ . 1 . 2]" 1
856 1 29 LEU HB2 1 30 THR H 4.670 . 4.670 4.170 4.040 4.249 . 0 0 "[ . 1 . 2]" 1
857 1 29 LEU HB2 1 34 ILE QG 4.390 . 4.390 3.538 3.324 3.964 . 0 0 "[ . 1 . 2]" 1
858 1 29 LEU HB2 1 60 VAL MG1 3.270 . 3.270 2.503 2.389 2.591 . 0 0 "[ . 1 . 2]" 1
859 1 29 LEU HB2 1 62 LEU HA 4.180 . 4.180 3.356 3.169 3.679 . 0 0 "[ . 1 . 2]" 1
860 1 29 LEU HB2 1 62 LEU QD 3.750 . 3.750 2.129 1.997 2.402 . 0 0 "[ . 1 . 2]" 1
861 1 29 LEU HB3 1 29 LEU MD1 3.020 . 3.020 2.363 2.340 2.393 . 0 0 "[ . 1 . 2]" 1
862 1 29 LEU HB3 1 29 LEU MD2 2.660 . 2.660 2.349 2.289 2.430 . 0 0 "[ . 1 . 2]" 1
863 1 29 LEU HB3 1 30 THR H 4.250 . 4.250 3.131 2.941 3.288 . 0 0 "[ . 1 . 2]" 1
864 1 29 LEU HB3 1 33 GLU HG2 5.090 . 5.090 3.445 3.238 4.225 . 0 0 "[ . 1 . 2]" 1
865 1 29 LEU HB3 1 34 ILE MD 2.690 . 2.690 2.209 2.041 2.335 . 0 0 "[ . 1 . 2]" 1
866 1 29 LEU HB3 1 34 ILE QG 4.330 . 4.330 2.440 2.236 2.713 . 0 0 "[ . 1 . 2]" 1
867 1 29 LEU HB3 1 60 VAL MG1 3.800 . 3.800 3.776 3.680 3.843 0.043 2 0 "[ . 1 . 2]" 1
868 1 29 LEU HB3 1 62 LEU QD 3.160 . 3.160 3.160 3.054 3.246 0.086 6 0 "[ . 1 . 2]" 1
869 1 29 LEU MD1 1 33 GLU HG2 5.240 . 5.240 4.659 4.504 4.806 . 0 0 "[ . 1 . 2]" 1
870 1 29 LEU MD1 1 34 ILE H 5.500 . 5.500 4.966 4.661 5.081 . 0 0 "[ . 1 . 2]" 1
871 1 29 LEU MD1 1 34 ILE QG 3.830 . 3.830 2.222 2.077 2.377 . 0 0 "[ . 1 . 2]" 1
872 1 29 LEU MD1 1 51 TYR QD 5.500 . 5.500 5.149 5.080 5.219 . 0 0 "[ . 1 . 2]" 1
873 1 29 LEU MD1 1 51 TYR QE 4.880 . 4.880 3.772 3.705 3.884 . 0 0 "[ . 1 . 2]" 1
874 1 29 LEU MD1 1 55 LEU QD 2.730 . 2.730 1.889 1.843 1.938 . 0 0 "[ . 1 . 2]" 1
875 1 29 LEU MD1 1 60 VAL HB 3.780 . 3.780 3.727 3.597 3.798 0.018 6 0 "[ . 1 . 2]" 1
876 1 29 LEU MD1 1 60 VAL MG1 2.710 . 2.710 2.025 1.965 2.089 . 0 0 "[ . 1 . 2]" 1
877 1 29 LEU MD2 1 30 THR H 4.170 . 4.170 3.429 3.141 3.575 . 0 0 "[ . 1 . 2]" 1
878 1 29 LEU MD2 1 33 GLU H 5.500 . 5.500 5.478 5.317 5.540 0.040 12 0 "[ . 1 . 2]" 1
879 1 29 LEU MD2 1 33 GLU HG2 4.190 . 4.190 3.493 2.669 3.675 . 0 0 "[ . 1 . 2]" 1
880 1 29 LEU MD2 1 33 GLU HG3 3.430 . 3.430 2.807 2.490 2.977 . 0 0 "[ . 1 . 2]" 1
881 1 29 LEU MD2 1 34 ILE H 4.930 . 4.930 4.801 4.379 4.924 . 0 0 "[ . 1 . 2]" 1
882 1 29 LEU MD2 1 34 ILE QG 3.880 . 3.880 3.136 3.016 3.212 . 0 0 "[ . 1 . 2]" 1
883 1 29 LEU MD2 1 51 TYR QE 5.500 . 5.500 5.533 5.503 5.557 0.057 16 0 "[ . 1 . 2]" 1
884 1 29 LEU MD2 1 60 VAL MG1 3.470 . 3.470 3.487 3.387 3.538 0.068 14 0 "[ . 1 . 2]" 1
885 1 29 LEU HG 1 34 ILE QG 5.340 . 5.340 4.630 4.447 4.828 . 0 0 "[ . 1 . 2]" 1
886 1 29 LEU HG 1 60 VAL MG1 3.270 . 3.270 2.129 2.031 2.191 . 0 0 "[ . 1 . 2]" 1
887 1 29 LEU HG 1 62 LEU QD 4.880 . 4.880 3.884 3.754 4.339 . 0 0 "[ . 1 . 2]" 1
888 1 30 THR H 1 30 THR MG 3.060 . 3.060 2.517 2.301 2.739 . 0 0 "[ . 1 . 2]" 1
889 1 30 THR H 1 31 TYR H 5.090 . 5.090 4.584 4.486 4.639 . 0 0 "[ . 1 . 2]" 1
890 1 30 THR H 1 33 GLU QB 4.290 . 4.290 3.989 2.917 4.336 0.046 6 0 "[ . 1 . 2]" 1
891 1 30 THR H 1 33 GLU HG2 3.930 . 3.930 2.730 2.437 3.490 . 0 0 "[ . 1 . 2]" 1
892 1 30 THR H 1 33 GLU HG3 4.510 . 4.510 3.939 3.626 4.535 0.025 8 0 "[ . 1 . 2]" 1
893 1 30 THR H 1 34 ILE MD 4.900 . 4.900 4.477 4.276 4.626 . 0 0 "[ . 1 . 2]" 1
894 1 30 THR H 1 62 LEU QD 5.280 . 5.280 5.020 4.773 5.195 . 0 0 "[ . 1 . 2]" 1
895 1 30 THR H 1 63 ILE MD 5.500 . 5.500 3.918 3.634 4.165 . 0 0 "[ . 1 . 2]" 1
896 1 30 THR H 1 63 ILE MG 5.500 . 5.500 5.653 5.617 5.686 0.186 13 0 "[ . 1 . 2]" 1
897 1 30 THR HA 1 30 THR MG 3.170 . 3.170 2.351 2.317 2.406 . 0 0 "[ . 1 . 2]" 1
898 1 30 THR HA 1 31 TYR H 3.200 . 3.200 2.240 2.112 2.302 . 0 0 "[ . 1 . 2]" 1
899 1 30 THR HA 1 31 TYR QD 5.470 . 5.470 4.582 4.100 4.877 . 0 0 "[ . 1 . 2]" 1
900 1 30 THR HA 1 32 GLU H 4.990 . 4.990 4.113 3.966 4.299 . 0 0 "[ . 1 . 2]" 1
901 1 30 THR HA 1 62 LEU HA 5.500 . 5.500 4.162 3.922 4.455 . 0 0 "[ . 1 . 2]" 1
902 1 30 THR HA 1 62 LEU HB3 5.500 . 5.500 4.608 4.308 5.074 . 0 0 "[ . 1 . 2]" 1
903 1 30 THR HA 1 62 LEU QD 5.440 . 5.440 4.769 4.353 5.013 . 0 0 "[ . 1 . 2]" 1
904 1 30 THR HA 1 63 ILE H 3.870 . 3.870 2.833 2.647 2.955 . 0 0 "[ . 1 . 2]" 1
905 1 30 THR HA 1 63 ILE HB 5.060 . 5.060 4.184 3.846 4.422 . 0 0 "[ . 1 . 2]" 1
906 1 30 THR HA 1 63 ILE MD 5.130 . 5.130 3.648 3.442 3.862 . 0 0 "[ . 1 . 2]" 1
907 1 30 THR HA 1 63 ILE HG12 4.920 . 4.920 2.875 2.775 3.011 . 0 0 "[ . 1 . 2]" 1
908 1 30 THR HA 1 63 ILE QG 4.140 . 4.140 2.080 1.913 2.274 . 0 0 "[ . 1 . 2]" 1
909 1 30 THR HA 1 63 ILE HG13 4.920 . 4.920 2.138 1.939 2.361 . 0 0 "[ . 1 . 2]" 1
910 1 30 THR HA 1 63 ILE MG 5.180 . 5.180 4.448 4.386 4.541 . 0 0 "[ . 1 . 2]" 1
911 1 30 THR HA 1 65 GLU H 5.500 . 5.500 4.400 3.370 5.233 . 0 0 "[ . 1 . 2]" 1
912 1 30 THR HB 1 31 TYR H 3.630 . 3.630 2.864 2.712 3.063 . 0 0 "[ . 1 . 2]" 1
913 1 30 THR HB 1 31 TYR QD 5.500 . 5.500 5.082 4.649 5.499 . 0 0 "[ . 1 . 2]" 1
914 1 30 THR HB 1 32 GLU H 3.700 . 3.700 2.656 2.387 2.870 . 0 0 "[ . 1 . 2]" 1
915 1 30 THR HB 1 33 GLU H 4.650 . 4.650 3.238 3.048 3.434 . 0 0 "[ . 1 . 2]" 1
916 1 30 THR HB 1 33 GLU QB 4.920 . 4.920 4.297 3.556 4.541 . 0 0 "[ . 1 . 2]" 1
917 1 30 THR HB 1 63 ILE H 5.370 . 5.370 5.321 5.137 5.410 0.040 1 0 "[ . 1 . 2]" 1
918 1 30 THR HB 1 65 GLU H 4.880 . 4.880 4.023 3.026 4.660 . 0 0 "[ . 1 . 2]" 1
919 1 30 THR HB 1 65 GLU QB 5.230 . 5.230 2.365 1.969 2.691 . 0 0 "[ . 1 . 2]" 1
920 1 30 THR HB 1 65 GLU QG 4.000 . 4.000 3.374 2.956 4.029 0.029 20 0 "[ . 1 . 2]" 1
921 1 30 THR MG 1 31 TYR H 3.670 . 3.670 3.694 3.620 3.762 0.092 8 0 "[ . 1 . 2]" 1
922 1 30 THR MG 1 32 GLU H 4.370 . 4.370 4.244 4.007 4.395 0.025 1 0 "[ . 1 . 2]" 1
923 1 30 THR MG 1 33 GLU H 4.650 . 4.650 4.284 4.005 4.497 . 0 0 "[ . 1 . 2]" 1
924 1 30 THR MG 1 33 GLU HG2 4.530 . 4.530 4.131 3.952 4.632 0.102 8 0 "[ . 1 . 2]" 1
925 1 30 THR MG 1 63 ILE H 4.190 . 4.190 4.066 3.847 4.216 0.026 12 0 "[ . 1 . 2]" 1
926 1 30 THR MG 1 64 SER HA 5.050 . 5.050 4.444 4.211 4.658 . 0 0 "[ . 1 . 2]" 1
927 1 30 THR MG 1 64 SER HB2 5.500 . 5.500 5.485 5.059 5.679 0.179 11 0 "[ . 1 . 2]" 1
928 1 30 THR MG 1 64 SER HB3 5.500 . 5.500 5.055 4.666 5.627 0.127 5 0 "[ . 1 . 2]" 1
929 1 30 THR MG 1 65 GLU H 4.500 . 4.500 2.879 1.794 3.935 . 0 0 "[ . 1 . 2]" 1
930 1 30 THR MG 1 65 GLU HA 3.090 . 3.090 1.886 1.775 2.177 . 0 0 "[ . 1 . 2]" 1
931 1 30 THR MG 1 65 GLU QB 2.990 . 2.990 2.856 2.091 3.083 0.093 3 0 "[ . 1 . 2]" 1
932 1 30 THR MG 1 65 GLU HG2 3.860 . 3.860 3.232 2.270 3.884 0.024 7 0 "[ . 1 . 2]" 1
933 1 30 THR MG 1 65 GLU QG 3.330 . 3.330 2.580 2.068 3.047 . 0 0 "[ . 1 . 2]" 1
934 1 30 THR MG 1 65 GLU HG3 3.860 . 3.860 3.175 2.080 3.947 0.087 2 0 "[ . 1 . 2]" 1
935 1 30 THR MG 1 66 ASN H 5.290 . 5.290 4.529 4.306 4.648 . 0 0 "[ . 1 . 2]" 1
936 1 31 TYR H 1 31 TYR HB2 3.840 . 3.840 2.558 2.420 2.637 . 0 0 "[ . 1 . 2]" 1
937 1 31 TYR H 1 31 TYR QB 3.360 . 3.360 2.510 2.385 2.582 . 0 0 "[ . 1 . 2]" 1
938 1 31 TYR H 1 31 TYR HB3 3.840 . 3.840 3.657 3.604 3.699 . 0 0 "[ . 1 . 2]" 1
939 1 31 TYR H 1 31 TYR QD 3.320 . 3.320 2.918 2.395 3.219 . 0 0 "[ . 1 . 2]" 1
940 1 31 TYR H 1 31 TYR QE 5.060 . 5.060 4.531 4.243 4.658 . 0 0 "[ . 1 . 2]" 1
941 1 31 TYR H 1 32 GLU H 3.850 . 3.850 2.762 2.560 2.961 . 0 0 "[ . 1 . 2]" 1
942 1 31 TYR H 1 34 ILE MD 4.700 . 4.700 4.171 3.985 4.443 . 0 0 "[ . 1 . 2]" 1
943 1 31 TYR H 1 62 LEU HB3 5.500 . 5.500 4.086 3.476 4.647 . 0 0 "[ . 1 . 2]" 1
944 1 31 TYR H 1 62 LEU QD 5.440 . 5.440 4.901 4.292 5.153 . 0 0 "[ . 1 . 2]" 1
945 1 31 TYR H 1 63 ILE H 4.370 . 4.370 4.048 3.710 4.348 . 0 0 "[ . 1 . 2]" 1
946 1 31 TYR H 1 63 ILE QG 4.480 . 4.480 3.775 3.549 3.983 . 0 0 "[ . 1 . 2]" 1
947 1 31 TYR H 1 64 SER HA 4.020 . 4.020 3.220 2.781 3.645 . 0 0 "[ . 1 . 2]" 1
948 1 31 TYR HA 1 31 TYR QD 2.980 . 2.980 2.552 2.264 2.886 . 0 0 "[ . 1 . 2]" 1
949 1 31 TYR HA 1 31 TYR QE 4.670 . 4.670 4.547 4.400 4.684 0.014 15 0 "[ . 1 . 2]" 1
950 1 31 TYR HA 1 34 ILE H 4.510 . 4.510 3.783 3.466 4.137 . 0 0 "[ . 1 . 2]" 1
951 1 31 TYR HA 1 34 ILE HB 3.650 . 3.650 2.912 2.639 3.269 . 0 0 "[ . 1 . 2]" 1
952 1 31 TYR HA 1 34 ILE MD 3.330 . 3.330 2.342 2.149 2.538 . 0 0 "[ . 1 . 2]" 1
953 1 31 TYR HA 1 34 ILE QG 5.100 . 5.100 3.500 3.081 3.789 . 0 0 "[ . 1 . 2]" 1
954 1 31 TYR HA 1 34 ILE MG 4.570 . 4.570 4.106 3.963 4.347 . 0 0 "[ . 1 . 2]" 1
955 1 31 TYR HA 1 52 TYR QE 4.340 . 4.340 3.131 2.263 3.512 . 0 0 "[ . 1 . 2]" 1
956 1 31 TYR HA 1 62 LEU QD 5.210 . 5.210 4.160 3.220 4.522 . 0 0 "[ . 1 . 2]" 1
957 1 31 TYR QB 1 34 ILE MD 4.590 . 4.590 4.197 3.952 4.415 . 0 0 "[ . 1 . 2]" 1
958 1 31 TYR QB 1 64 SER HA 4.560 . 4.560 3.304 2.889 3.685 . 0 0 "[ . 1 . 2]" 1
959 1 31 TYR HB2 1 32 GLU H 4.330 . 4.330 2.736 2.571 2.893 . 0 0 "[ . 1 . 2]" 1
960 1 31 TYR HB3 1 32 GLU H 4.330 . 4.330 3.647 3.500 3.771 . 0 0 "[ . 1 . 2]" 1
961 1 31 TYR QD 1 32 GLU H 5.280 . 5.280 4.335 4.107 4.593 . 0 0 "[ . 1 . 2]" 1
962 1 31 TYR QD 1 34 ILE MD 4.110 . 4.110 3.436 2.621 3.809 . 0 0 "[ . 1 . 2]" 1
963 1 31 TYR QD 1 34 ILE MG 5.050 . 5.050 4.708 4.306 5.014 . 0 0 "[ . 1 . 2]" 1
964 1 31 TYR QD 1 62 LEU HB3 4.660 . 4.660 3.274 2.941 3.645 . 0 0 "[ . 1 . 2]" 1
965 1 31 TYR QD 1 62 LEU MD1 5.080 . 5.080 4.434 3.107 5.049 . 0 0 "[ . 1 . 2]" 1
966 1 31 TYR QD 1 62 LEU QD 4.410 . 4.410 3.968 2.827 4.422 0.012 5 0 "[ . 1 . 2]" 1
967 1 31 TYR QD 1 62 LEU MD2 5.080 . 5.080 4.488 3.240 4.887 . 0 0 "[ . 1 . 2]" 1
968 1 31 TYR QD 1 62 LEU HG 5.500 . 5.500 3.955 3.300 5.519 0.019 6 0 "[ . 1 . 2]" 1
969 1 31 TYR QD 1 64 SER H 4.740 . 4.740 4.211 3.812 4.552 . 0 0 "[ . 1 . 2]" 1
970 1 31 TYR QD 1 64 SER HA 3.390 . 3.390 1.918 1.791 2.274 . 0 0 "[ . 1 . 2]" 1
971 1 31 TYR QD 1 64 SER HB2 4.170 . 4.170 3.932 3.370 4.311 0.141 9 0 "[ . 1 . 2]" 1
972 1 31 TYR QD 1 64 SER HB3 5.030 . 5.030 4.573 4.012 4.909 . 0 0 "[ . 1 . 2]" 1
973 1 31 TYR QD 1 65 GLU H 5.500 . 5.500 4.907 3.681 5.313 . 0 0 "[ . 1 . 2]" 1
974 1 31 TYR QE 1 52 TYR QD 4.120 . 4.120 3.444 2.880 3.875 . 0 0 "[ . 1 . 2]" 1
975 1 31 TYR QE 1 52 TYR QE 4.190 . 4.190 3.859 3.343 4.220 0.030 6 0 "[ . 1 . 2]" 1
976 1 31 TYR QE 1 62 LEU HB2 4.940 . 4.940 2.861 2.358 3.253 . 0 0 "[ . 1 . 2]" 1
977 1 31 TYR QE 1 62 LEU HB3 4.490 . 4.490 3.089 2.553 3.557 . 0 0 "[ . 1 . 2]" 1
978 1 31 TYR QE 1 62 LEU MD1 4.960 . 4.960 4.374 2.091 4.907 . 0 0 "[ . 1 . 2]" 1
979 1 31 TYR QE 1 62 LEU QD 3.690 . 3.690 3.186 2.079 3.688 . 0 0 "[ . 1 . 2]" 1
980 1 31 TYR QE 1 62 LEU MD2 4.960 . 4.960 3.408 3.074 3.819 . 0 0 "[ . 1 . 2]" 1
981 1 31 TYR QE 1 64 SER HA 5.500 . 5.500 3.321 2.899 4.010 . 0 0 "[ . 1 . 2]" 1
982 1 31 TYR QE 1 64 SER HB2 5.500 . 5.500 3.914 2.754 4.594 . 0 0 "[ . 1 . 2]" 1
983 1 31 TYR QE 1 64 SER HB3 5.500 . 5.500 5.094 4.328 5.539 0.039 16 0 "[ . 1 . 2]" 1
984 1 32 GLU H 1 32 GLU HB2 4.040 . 4.040 2.536 2.392 2.697 . 0 0 "[ . 1 . 2]" 1
985 1 32 GLU H 1 32 GLU HB3 4.040 . 4.040 2.922 2.523 3.646 . 0 0 "[ . 1 . 2]" 1
986 1 32 GLU H 1 32 GLU HG2 4.720 . 4.720 4.206 3.182 4.574 . 0 0 "[ . 1 . 2]" 1
987 1 32 GLU H 1 32 GLU QG 4.100 . 4.100 3.507 2.252 4.040 . 0 0 "[ . 1 . 2]" 1
988 1 32 GLU H 1 32 GLU HG3 4.720 . 4.720 3.844 2.282 4.532 . 0 0 "[ . 1 . 2]" 1
989 1 32 GLU H 1 33 GLU H 4.260 . 4.260 2.669 2.538 2.837 . 0 0 "[ . 1 . 2]" 1
990 1 32 GLU H 1 64 SER HA 5.020 . 5.020 4.658 4.117 5.044 0.024 15 0 "[ . 1 . 2]" 1
991 1 32 GLU H 1 65 GLU QG 5.180 . 5.180 4.552 3.725 5.231 0.051 4 0 "[ . 1 . 2]" 1
992 1 32 GLU HA 1 32 GLU HG2 3.380 . 3.380 2.882 2.270 3.317 . 0 0 "[ . 1 . 2]" 1
993 1 32 GLU HA 1 32 GLU QG 2.790 . 2.790 2.329 2.231 2.442 . 0 0 "[ . 1 . 2]" 1
994 1 32 GLU HA 1 32 GLU HG3 3.380 . 3.380 2.600 2.319 3.285 . 0 0 "[ . 1 . 2]" 1
995 1 32 GLU HA 1 34 ILE H 4.960 . 4.960 4.034 3.699 4.288 . 0 0 "[ . 1 . 2]" 1
996 1 32 GLU HA 1 35 ALA H 4.060 . 4.060 2.976 2.441 3.508 . 0 0 "[ . 1 . 2]" 1
997 1 32 GLU HA 1 35 ALA MB 3.290 . 3.290 2.372 2.014 2.895 . 0 0 "[ . 1 . 2]" 1
998 1 32 GLU QB 1 35 ALA MB 5.340 . 5.340 3.936 3.105 4.619 . 0 0 "[ . 1 . 2]" 1
999 1 32 GLU QG 1 33 GLU H 5.090 . 5.090 4.117 3.762 4.449 . 0 0 "[ . 1 . 2]" 1
1000 1 32 GLU QG 1 35 ALA MB 4.630 . 4.630 3.213 2.491 3.969 . 0 0 "[ . 1 . 2]" 1
1001 1 32 GLU HG2 1 35 ALA MB 5.500 . 5.500 3.838 2.938 4.792 . 0 0 "[ . 1 . 2]" 1
1002 1 32 GLU HG3 1 35 ALA MB 5.500 . 5.500 3.661 2.529 5.017 . 0 0 "[ . 1 . 2]" 1
1003 1 33 GLU H 1 33 GLU HB2 3.800 . 3.800 3.625 2.731 3.701 . 0 0 "[ . 1 . 2]" 1
1004 1 33 GLU H 1 33 GLU QB 3.290 . 3.290 2.537 2.030 2.619 . 0 0 "[ . 1 . 2]" 1
1005 1 33 GLU H 1 33 GLU HB3 3.800 . 3.800 2.591 2.093 2.679 . 0 0 "[ . 1 . 2]" 1
1006 1 33 GLU H 1 33 GLU HG2 4.230 . 4.230 2.399 2.165 4.281 0.051 8 0 "[ . 1 . 2]" 1
1007 1 33 GLU H 1 33 GLU HG3 4.200 . 4.200 3.577 3.413 4.155 . 0 0 "[ . 1 . 2]" 1
1008 1 33 GLU H 1 34 ILE H 3.940 . 3.940 2.278 2.122 2.355 . 0 0 "[ . 1 . 2]" 1
1009 1 33 GLU H 1 34 ILE HA 5.500 . 5.500 4.939 4.784 4.990 . 0 0 "[ . 1 . 2]" 1
1010 1 33 GLU H 1 34 ILE MD 4.980 . 4.980 4.778 4.707 4.889 . 0 0 "[ . 1 . 2]" 1
1011 1 33 GLU H 1 34 ILE MG 5.500 . 5.500 5.541 5.439 5.585 0.085 20 0 "[ . 1 . 2]" 1
1012 1 33 GLU HA 1 33 GLU QB 2.600 . 2.600 2.195 2.181 2.280 . 0 0 "[ . 1 . 2]" 1
1013 1 33 GLU HA 1 33 GLU HG3 3.740 . 3.740 3.737 3.424 3.787 0.047 6 0 "[ . 1 . 2]" 1
1014 1 33 GLU HA 1 34 ILE HA 5.010 . 5.010 4.735 4.683 4.822 . 0 0 "[ . 1 . 2]" 1
1015 1 33 GLU HA 1 35 ALA H 4.980 . 4.980 4.143 4.028 4.470 . 0 0 "[ . 1 . 2]" 1
1016 1 33 GLU HA 1 36 GLU H 3.760 . 3.760 3.119 2.948 3.408 . 0 0 "[ . 1 . 2]" 1
1017 1 33 GLU HA 1 36 GLU QB 3.430 . 3.430 2.277 1.982 2.509 . 0 0 "[ . 1 . 2]" 1
1018 1 33 GLU HA 1 37 ARG H 4.960 . 4.960 4.387 4.074 4.787 . 0 0 "[ . 1 . 2]" 1
1019 1 33 GLU QB 1 34 ILE H 3.870 . 3.870 3.476 2.341 3.593 . 0 0 "[ . 1 . 2]" 1
1020 1 33 GLU HB2 1 34 ILE H 4.490 . 4.490 4.008 3.752 4.127 . 0 0 "[ . 1 . 2]" 1
1021 1 33 GLU HB3 1 34 ILE H 4.490 . 4.490 3.843 2.365 3.982 . 0 0 "[ . 1 . 2]" 1
1022 1 33 GLU HG2 1 34 ILE H 4.120 . 4.120 2.640 2.377 4.146 0.026 8 0 "[ . 1 . 2]" 1
1023 1 33 GLU HG2 1 34 ILE QG 5.150 . 5.150 2.810 2.567 4.206 . 0 0 "[ . 1 . 2]" 1
1024 1 33 GLU HG3 1 34 ILE H 4.250 . 4.250 2.930 2.724 3.228 . 0 0 "[ . 1 . 2]" 1
1025 1 33 GLU HG3 1 34 ILE HA 3.620 . 3.620 3.466 3.360 3.598 . 0 0 "[ . 1 . 2]" 1
1026 1 34 ILE H 1 34 ILE HB 3.390 . 3.390 2.455 2.376 2.621 . 0 0 "[ . 1 . 2]" 1
1027 1 34 ILE H 1 34 ILE MD 3.600 . 3.600 3.531 3.481 3.582 . 0 0 "[ . 1 . 2]" 1
1028 1 34 ILE H 1 34 ILE HG12 3.900 . 3.900 3.441 3.282 3.531 . 0 0 "[ . 1 . 2]" 1
1029 1 34 ILE H 1 34 ILE QG 3.290 . 3.290 2.131 1.966 2.241 . 0 0 "[ . 1 . 2]" 1
1030 1 34 ILE H 1 34 ILE HG13 3.900 . 3.900 2.152 1.981 2.266 . 0 0 "[ . 1 . 2]" 1
1031 1 34 ILE H 1 34 ILE MG 3.810 . 3.810 3.722 3.676 3.765 . 0 0 "[ . 1 . 2]" 1
1032 1 34 ILE H 1 35 ALA H 3.750 . 3.750 2.588 2.492 2.812 . 0 0 "[ . 1 . 2]" 1
1033 1 34 ILE H 1 35 ALA HA 5.500 . 5.500 5.142 5.042 5.313 . 0 0 "[ . 1 . 2]" 1
1034 1 34 ILE H 1 35 ALA MB 4.410 . 4.410 4.217 4.125 4.411 0.001 8 0 "[ . 1 . 2]" 1
1035 1 34 ILE H 1 36 GLU H 4.910 . 4.910 3.797 3.625 3.954 . 0 0 "[ . 1 . 2]" 1
1036 1 34 ILE HA 1 34 ILE MD 3.890 . 3.890 3.818 3.795 3.845 . 0 0 "[ . 1 . 2]" 1
1037 1 34 ILE HA 1 34 ILE HG12 3.730 . 3.730 2.514 2.475 2.555 . 0 0 "[ . 1 . 2]" 1
1038 1 34 ILE HA 1 34 ILE HG13 3.730 . 3.730 2.935 2.859 3.007 . 0 0 "[ . 1 . 2]" 1
1039 1 34 ILE HA 1 34 ILE MG 3.120 . 3.120 2.402 2.309 2.503 . 0 0 "[ . 1 . 2]" 1
1040 1 34 ILE HA 1 35 ALA HA 4.850 . 4.850 4.757 4.725 4.790 . 0 0 "[ . 1 . 2]" 1
1041 1 34 ILE HA 1 35 ALA MB 5.500 . 5.500 5.018 5.001 5.036 . 0 0 "[ . 1 . 2]" 1
1042 1 34 ILE HA 1 36 GLU H 5.080 . 5.080 4.148 3.914 4.425 . 0 0 "[ . 1 . 2]" 1
1043 1 34 ILE HA 1 37 ARG H 4.360 . 4.360 3.932 3.760 4.056 . 0 0 "[ . 1 . 2]" 1
1044 1 34 ILE HA 1 37 ARG QB 4.680 . 4.680 4.004 3.708 4.237 . 0 0 "[ . 1 . 2]" 1
1045 1 34 ILE HA 1 37 ARG HG2 5.100 . 5.100 3.937 3.495 4.180 . 0 0 "[ . 1 . 2]" 1
1046 1 34 ILE HA 1 37 ARG HG3 5.050 . 5.050 4.482 4.030 4.803 . 0 0 "[ . 1 . 2]" 1
1047 1 34 ILE HA 1 38 MET ME 5.100 . 5.100 4.355 4.100 4.587 . 0 0 "[ . 1 . 2]" 1
1048 1 34 ILE HA 1 38 MET QG 4.320 . 4.320 4.067 3.914 4.299 . 0 0 "[ . 1 . 2]" 1
1049 1 34 ILE HA 1 55 LEU QD 5.440 . 5.440 4.880 4.609 5.027 . 0 0 "[ . 1 . 2]" 1
1050 1 34 ILE HB 1 34 ILE MD 3.310 . 3.310 2.413 2.389 2.443 . 0 0 "[ . 1 . 2]" 1
1051 1 34 ILE HB 1 35 ALA H 3.450 . 3.450 2.698 2.616 2.781 . 0 0 "[ . 1 . 2]" 1
1052 1 34 ILE HB 1 35 ALA MB 4.330 . 4.330 3.893 3.777 4.020 . 0 0 "[ . 1 . 2]" 1
1053 1 34 ILE HB 1 38 MET QG 5.370 . 5.370 4.992 4.863 5.151 . 0 0 "[ . 1 . 2]" 1
1054 1 34 ILE HB 1 52 TYR QE 4.830 . 4.830 2.687 2.510 2.859 . 0 0 "[ . 1 . 2]" 1
1055 1 34 ILE HB 1 55 LEU QD 5.410 . 5.410 4.651 4.541 4.802 . 0 0 "[ . 1 . 2]" 1
1056 1 34 ILE MD 1 34 ILE MG 2.730 . 2.730 1.945 1.907 2.000 . 0 0 "[ . 1 . 2]" 1
1057 1 34 ILE MD 1 35 ALA H 4.670 . 4.670 4.629 4.543 4.689 0.019 6 0 "[ . 1 . 2]" 1
1058 1 34 ILE MD 1 51 TYR QE 4.270 . 4.270 3.515 3.131 3.818 . 0 0 "[ . 1 . 2]" 1
1059 1 34 ILE MD 1 52 TYR HA 4.890 . 4.890 3.991 3.804 4.150 . 0 0 "[ . 1 . 2]" 1
1060 1 34 ILE MD 1 52 TYR QD 3.360 . 3.360 2.624 2.475 2.886 . 0 0 "[ . 1 . 2]" 1
1061 1 34 ILE MD 1 52 TYR QE 3.030 . 3.030 2.030 1.887 2.208 . 0 0 "[ . 1 . 2]" 1
1062 1 34 ILE MD 1 55 LEU QD 2.790 . 2.790 2.181 2.061 2.376 . 0 0 "[ . 1 . 2]" 1
1063 1 34 ILE MD 1 62 LEU QD 2.750 . 2.750 1.918 1.839 2.202 . 0 0 "[ . 1 . 2]" 1
1064 1 34 ILE QG 1 34 ILE MG 2.700 . 2.700 2.304 2.259 2.332 . 0 0 "[ . 1 . 2]" 1
1065 1 34 ILE QG 1 35 ALA H 5.170 . 5.170 4.049 3.948 4.138 . 0 0 "[ . 1 . 2]" 1
1066 1 34 ILE QG 1 51 TYR QE 4.800 . 4.800 3.424 2.995 3.732 . 0 0 "[ . 1 . 2]" 1
1067 1 34 ILE QG 1 55 LEU QD 4.730 . 4.730 3.135 2.986 3.283 . 0 0 "[ . 1 . 2]" 1
1068 1 34 ILE QG 1 62 LEU QD 4.320 . 4.320 3.588 3.485 3.856 . 0 0 "[ . 1 . 2]" 1
1069 1 34 ILE MG 1 35 ALA H 3.700 . 3.700 3.461 3.360 3.595 . 0 0 "[ . 1 . 2]" 1
1070 1 34 ILE MG 1 35 ALA HA 3.800 . 3.800 3.413 3.315 3.572 . 0 0 "[ . 1 . 2]" 1
1071 1 34 ILE MG 1 37 ARG H 5.190 . 5.190 5.012 4.887 5.140 . 0 0 "[ . 1 . 2]" 1
1072 1 34 ILE MG 1 37 ARG HG2 5.500 . 5.500 5.411 5.101 5.568 0.068 15 0 "[ . 1 . 2]" 1
1073 1 34 ILE MG 1 38 MET H 4.980 . 4.980 4.692 4.476 4.946 . 0 0 "[ . 1 . 2]" 1
1074 1 34 ILE MG 1 38 MET HB2 4.890 . 4.890 4.390 4.010 4.732 . 0 0 "[ . 1 . 2]" 1
1075 1 34 ILE MG 1 38 MET ME 3.300 . 3.300 3.021 2.856 3.197 . 0 0 "[ . 1 . 2]" 1
1076 1 34 ILE MG 1 38 MET QG 3.170 . 3.170 2.930 2.750 3.144 . 0 0 "[ . 1 . 2]" 1
1077 1 34 ILE MG 1 48 MET HA 5.500 . 5.500 4.419 4.200 4.670 . 0 0 "[ . 1 . 2]" 1
1078 1 34 ILE MG 1 48 MET ME 2.760 . 2.760 2.261 2.123 2.450 . 0 0 "[ . 1 . 2]" 1
1079 1 34 ILE MG 1 48 MET QG 5.500 . 5.500 4.296 4.003 4.924 . 0 0 "[ . 1 . 2]" 1
1080 1 34 ILE MG 1 51 TYR HB3 4.820 . 4.820 3.931 3.771 4.082 . 0 0 "[ . 1 . 2]" 1
1081 1 34 ILE MG 1 51 TYR QD 3.310 . 3.310 2.332 2.166 2.463 . 0 0 "[ . 1 . 2]" 1
1082 1 34 ILE MG 1 51 TYR QE 3.020 . 3.020 2.136 1.997 2.297 . 0 0 "[ . 1 . 2]" 1
1083 1 34 ILE MG 1 52 TYR HA 5.310 . 5.310 4.673 4.531 4.798 . 0 0 "[ . 1 . 2]" 1
1084 1 34 ILE MG 1 52 TYR QE 3.050 . 3.050 2.054 1.857 2.821 . 0 0 "[ . 1 . 2]" 1
1085 1 34 ILE MG 1 55 LEU QD 3.860 . 3.860 2.905 2.720 3.072 . 0 0 "[ . 1 . 2]" 1
1086 1 35 ALA H 1 35 ALA MB 2.700 . 2.700 2.181 2.162 2.195 . 0 0 "[ . 1 . 2]" 1
1087 1 35 ALA HA 1 37 ARG H 4.770 . 4.770 4.654 4.360 4.778 0.008 2 0 "[ . 1 . 2]" 1
1088 1 35 ALA HA 1 38 MET H 4.000 . 4.000 3.511 3.365 3.627 . 0 0 "[ . 1 . 2]" 1
1089 1 35 ALA HA 1 38 MET HB2 3.400 . 3.400 2.641 2.287 2.910 . 0 0 "[ . 1 . 2]" 1
1090 1 35 ALA HA 1 38 MET HB3 4.740 . 4.740 4.291 3.939 4.574 . 0 0 "[ . 1 . 2]" 1
1091 1 35 ALA HA 1 38 MET QG 4.080 . 4.080 3.227 2.974 3.425 . 0 0 "[ . 1 . 2]" 1
1092 1 35 ALA HA 1 39 SER H 5.500 . 5.500 4.814 4.554 5.216 . 0 0 "[ . 1 . 2]" 1
1093 1 35 ALA HA 1 48 MET ME 4.120 . 4.120 4.024 3.807 4.143 0.023 3 0 "[ . 1 . 2]" 1
1094 1 35 ALA HA 1 52 TYR QE 5.500 . 5.500 5.567 5.513 5.609 0.109 13 0 "[ . 1 . 2]" 1
1095 1 35 ALA MB 1 36 GLU H 3.240 . 3.240 2.746 2.537 2.862 . 0 0 "[ . 1 . 2]" 1
1096 1 35 ALA MB 1 36 GLU QB 4.650 . 4.650 3.881 3.695 4.041 . 0 0 "[ . 1 . 2]" 1
1097 1 35 ALA MB 1 37 ARG H 5.080 . 5.080 4.859 4.713 4.971 . 0 0 "[ . 1 . 2]" 1
1098 1 35 ALA MB 1 38 MET H 4.890 . 4.890 4.508 4.376 4.577 . 0 0 "[ . 1 . 2]" 1
1099 1 35 ALA MB 1 38 MET HB2 4.860 . 4.860 3.985 3.730 4.227 . 0 0 "[ . 1 . 2]" 1
1100 1 36 GLU H 1 36 GLU QB 3.040 . 3.040 2.166 2.068 2.256 . 0 0 "[ . 1 . 2]" 1
1101 1 36 GLU H 1 36 GLU QG 4.150 . 4.150 3.922 3.846 3.993 . 0 0 "[ . 1 . 2]" 1
1102 1 36 GLU H 1 37 ARG H 3.460 . 3.460 2.827 2.705 2.923 . 0 0 "[ . 1 . 2]" 1
1103 1 36 GLU H 1 37 ARG HG2 4.950 . 4.950 4.285 3.993 4.708 . 0 0 "[ . 1 . 2]" 1
1104 1 36 GLU HA 1 36 GLU QB 2.560 . 2.560 2.347 2.288 2.421 . 0 0 "[ . 1 . 2]" 1
1105 1 36 GLU HA 1 36 GLU QG 2.760 . 2.760 2.522 2.386 2.824 0.064 11 0 "[ . 1 . 2]" 1
1106 1 36 GLU HA 1 37 ARG QD 5.340 . 5.340 5.294 5.072 5.409 0.069 6 0 "[ . 1 . 2]" 1
1107 1 36 GLU QB 1 37 ARG H 3.380 . 3.380 2.409 2.132 2.689 . 0 0 "[ . 1 . 2]" 1
1108 1 37 ARG H 1 37 ARG HB2 3.660 . 3.660 2.510 2.438 2.622 . 0 0 "[ . 1 . 2]" 1
1109 1 37 ARG H 1 37 ARG QB 3.010 . 3.010 2.457 2.397 2.550 . 0 0 "[ . 1 . 2]" 1
1110 1 37 ARG H 1 37 ARG HB3 3.660 . 3.660 3.504 3.469 3.569 . 0 0 "[ . 1 . 2]" 1
1111 1 37 ARG H 1 37 ARG HD2 4.730 . 4.730 4.363 4.120 4.569 . 0 0 "[ . 1 . 2]" 1
1112 1 37 ARG H 1 37 ARG QD 4.530 . 4.530 3.217 2.961 3.399 . 0 0 "[ . 1 . 2]" 1
1113 1 37 ARG H 1 37 ARG HD3 4.730 . 4.730 3.313 3.035 3.505 . 0 0 "[ . 1 . 2]" 1
1114 1 37 ARG H 1 37 ARG HE 5.300 . 5.300 4.270 3.572 5.344 0.044 3 0 "[ . 1 . 2]" 1
1115 1 37 ARG H 1 37 ARG HG2 3.680 . 3.680 1.988 1.836 2.229 . 0 0 "[ . 1 . 2]" 1
1116 1 37 ARG H 1 37 ARG HG3 3.900 . 3.900 3.464 3.354 3.653 . 0 0 "[ . 1 . 2]" 1
1117 1 37 ARG H 1 38 MET H 3.530 . 3.530 2.500 2.378 2.588 . 0 0 "[ . 1 . 2]" 1
1118 1 37 ARG H 1 38 MET QG 4.560 . 4.560 3.992 3.809 4.107 . 0 0 "[ . 1 . 2]" 1
1119 1 37 ARG H 1 39 SER H 5.500 . 5.500 4.018 3.894 4.243 . 0 0 "[ . 1 . 2]" 1
1120 1 37 ARG HA 1 37 ARG HD2 3.430 . 3.430 3.138 2.568 3.377 . 0 0 "[ . 1 . 2]" 1
1121 1 37 ARG HA 1 37 ARG QD 2.890 . 2.890 2.119 1.857 2.438 . 0 0 "[ . 1 . 2]" 1
1122 1 37 ARG HA 1 37 ARG HD3 3.430 . 3.430 2.168 1.868 2.559 . 0 0 "[ . 1 . 2]" 1
1123 1 37 ARG HA 1 37 ARG HG2 3.650 . 3.650 3.197 3.088 3.354 . 0 0 "[ . 1 . 2]" 1
1124 1 37 ARG HA 1 37 ARG HG3 3.900 . 3.900 3.821 3.754 3.902 0.002 12 0 "[ . 1 . 2]" 1
1125 1 37 ARG HA 1 38 MET QG 5.130 . 5.130 5.149 5.132 5.158 0.028 1 0 "[ . 1 . 2]" 1
1126 1 37 ARG HA 1 39 SER H 4.310 . 4.310 3.683 3.532 3.893 . 0 0 "[ . 1 . 2]" 1
1127 1 37 ARG QB 1 37 ARG QD 3.330 . 3.330 2.361 2.315 2.402 . 0 0 "[ . 1 . 2]" 1
1128 1 37 ARG QB 1 38 MET H 3.690 . 3.690 2.828 2.621 3.004 . 0 0 "[ . 1 . 2]" 1
1129 1 37 ARG QB 1 38 MET QG 3.460 . 3.460 3.168 2.978 3.357 . 0 0 "[ . 1 . 2]" 1
1130 1 37 ARG HB2 1 38 MET H 4.260 . 4.260 2.896 2.667 3.089 . 0 0 "[ . 1 . 2]" 1
1131 1 37 ARG HB3 1 38 MET H 4.260 . 4.260 3.975 3.776 4.107 . 0 0 "[ . 1 . 2]" 1
1132 1 37 ARG HG2 1 38 MET H 5.270 . 5.270 4.143 3.918 4.389 . 0 0 "[ . 1 . 2]" 1
1133 1 37 ARG HG2 1 38 MET QG 5.500 . 5.500 4.993 4.717 5.202 . 0 0 "[ . 1 . 2]" 1
1134 1 37 ARG HG3 1 38 MET H 5.250 . 5.250 5.029 4.817 5.186 . 0 0 "[ . 1 . 2]" 1
1135 1 38 MET H 1 38 MET HB2 3.440 . 3.440 2.560 2.486 2.616 . 0 0 "[ . 1 . 2]" 1
1136 1 38 MET H 1 38 MET HB3 3.810 . 3.810 3.642 3.614 3.660 . 0 0 "[ . 1 . 2]" 1
1137 1 38 MET H 1 38 MET ME 5.300 . 5.300 4.362 4.253 4.565 . 0 0 "[ . 1 . 2]" 1
1138 1 38 MET H 1 38 MET QG 3.350 . 3.350 2.387 2.319 2.452 . 0 0 "[ . 1 . 2]" 1
1139 1 38 MET H 1 39 SER H 3.560 . 3.560 2.488 2.387 2.587 . 0 0 "[ . 1 . 2]" 1
1140 1 38 MET H 1 39 SER QB 4.950 . 4.950 4.447 3.973 4.765 . 0 0 "[ . 1 . 2]" 1
1141 1 38 MET HA 1 38 MET QG 3.530 . 3.530 2.976 2.930 3.032 . 0 0 "[ . 1 . 2]" 1
1142 1 38 MET HA 1 41 PHE H 4.580 . 4.580 3.289 3.040 3.513 . 0 0 "[ . 1 . 2]" 1
1143 1 38 MET HA 1 41 PHE QD 3.260 . 3.260 1.974 1.883 2.089 . 0 0 "[ . 1 . 2]" 1
1144 1 38 MET HA 1 41 PHE QE 3.910 . 3.910 3.014 2.641 3.337 . 0 0 "[ . 1 . 2]" 1
1145 1 38 MET HB2 1 39 SER H 4.430 . 4.430 3.537 3.378 3.673 . 0 0 "[ . 1 . 2]" 1
1146 1 38 MET HB2 1 41 PHE QB 5.340 . 5.340 4.862 4.619 5.072 . 0 0 "[ . 1 . 2]" 1
1147 1 38 MET HB2 1 41 PHE QD 4.640 . 4.640 4.393 4.092 4.514 . 0 0 "[ . 1 . 2]" 1
1148 1 38 MET HB2 1 43 ILE HB 4.850 . 4.850 3.336 2.889 4.872 0.022 5 0 "[ . 1 . 2]" 1
1149 1 38 MET HB2 1 43 ILE MD 5.100 . 5.100 5.037 3.038 5.173 0.073 16 0 "[ . 1 . 2]" 1
1150 1 38 MET HB2 1 43 ILE QG 4.370 . 4.370 3.571 3.494 3.975 . 0 0 "[ . 1 . 2]" 1
1151 1 38 MET HB3 1 38 MET ME 4.010 . 4.010 3.977 3.939 4.001 . 0 0 "[ . 1 . 2]" 1
1152 1 38 MET HB3 1 39 SER H 4.720 . 4.720 4.261 4.171 4.335 . 0 0 "[ . 1 . 2]" 1
1153 1 38 MET HB3 1 41 PHE HB2 5.500 . 5.500 3.478 3.226 3.688 . 0 0 "[ . 1 . 2]" 1
1154 1 38 MET HB3 1 41 PHE QB 4.690 . 4.690 3.422 3.179 3.626 . 0 0 "[ . 1 . 2]" 1
1155 1 38 MET HB3 1 41 PHE HB3 5.500 . 5.500 5.086 4.795 5.346 . 0 0 "[ . 1 . 2]" 1
1156 1 38 MET HB3 1 41 PHE QD 3.860 . 3.860 3.059 2.646 3.208 . 0 0 "[ . 1 . 2]" 1
1157 1 38 MET HB3 1 41 PHE QE 5.500 . 5.500 4.885 4.446 5.071 . 0 0 "[ . 1 . 2]" 1
1158 1 38 MET HB3 1 43 ILE HB 4.230 . 4.230 2.500 2.007 3.906 . 0 0 "[ . 1 . 2]" 1
1159 1 38 MET HB3 1 43 ILE MD 4.590 . 4.590 3.690 1.981 3.831 . 0 0 "[ . 1 . 2]" 1
1160 1 38 MET HB3 1 43 ILE HG12 4.770 . 4.770 2.667 2.346 3.802 . 0 0 "[ . 1 . 2]" 1
1161 1 38 MET HB3 1 43 ILE QG 4.190 . 4.190 2.105 2.024 2.520 . 0 0 "[ . 1 . 2]" 1
1162 1 38 MET HB3 1 43 ILE HG13 4.770 . 4.770 2.223 2.101 2.557 . 0 0 "[ . 1 . 2]" 1
1163 1 38 MET ME 1 38 MET QG 2.970 . 2.970 2.202 2.187 2.225 . 0 0 "[ . 1 . 2]" 1
1164 1 38 MET ME 1 48 MET ME 3.130 . 3.130 2.338 2.052 2.653 . 0 0 "[ . 1 . 2]" 1
1165 1 38 MET ME 1 51 TYR HB2 4.600 . 4.600 4.125 3.770 4.327 . 0 0 "[ . 1 . 2]" 1
1166 1 38 MET ME 1 51 TYR HB3 5.040 . 5.040 4.343 3.964 4.561 . 0 0 "[ . 1 . 2]" 1
1167 1 38 MET ME 1 51 TYR QD 4.200 . 4.200 3.158 2.850 3.414 . 0 0 "[ . 1 . 2]" 1
1168 1 38 MET ME 1 51 TYR QE 3.740 . 3.740 3.037 2.843 3.216 . 0 0 "[ . 1 . 2]" 1
1169 1 38 MET QG 1 39 SER H 4.840 . 4.840 4.401 4.300 4.502 . 0 0 "[ . 1 . 2]" 1
1170 1 38 MET QG 1 41 PHE QD 4.210 . 4.210 4.055 3.932 4.162 . 0 0 "[ . 1 . 2]" 1
1171 1 38 MET QG 1 41 PHE QE 4.810 . 4.810 4.663 4.485 4.817 0.007 18 0 "[ . 1 . 2]" 1
1172 1 38 MET QG 1 43 ILE MD 5.180 . 5.180 4.365 2.315 4.616 . 0 0 "[ . 1 . 2]" 1
1173 1 38 MET QG 1 48 MET ME 3.030 . 3.030 1.998 1.890 2.133 . 0 0 "[ . 1 . 2]" 1
1174 1 39 SER H 1 39 SER HB2 3.730 . 3.730 2.726 2.358 3.615 . 0 0 "[ . 1 . 2]" 1
1175 1 39 SER H 1 39 SER QB 3.250 . 3.250 2.435 2.174 2.785 . 0 0 "[ . 1 . 2]" 1
1176 1 39 SER H 1 39 SER HB3 3.730 . 3.730 3.109 2.508 3.625 . 0 0 "[ . 1 . 2]" 1
1177 1 39 SER H 1 40 SER H 3.960 . 3.960 2.509 2.352 2.725 . 0 0 "[ . 1 . 2]" 1
1178 1 40 SER H 1 40 SER HB2 3.620 . 3.620 2.623 2.443 3.579 . 0 0 "[ . 1 . 2]" 1
1179 1 40 SER H 1 40 SER HB3 3.620 . 3.620 3.077 2.400 3.541 . 0 0 "[ . 1 . 2]" 1
1180 1 40 SER H 1 41 PHE H 3.570 . 3.570 2.417 2.258 2.676 . 0 0 "[ . 1 . 2]" 1
1181 1 40 SER H 1 41 PHE QD 4.900 . 4.900 4.149 3.804 4.357 . 0 0 "[ . 1 . 2]" 1
1182 1 40 SER H 1 41 PHE QE 5.500 . 5.500 4.794 4.448 5.045 . 0 0 "[ . 1 . 2]" 1
1183 1 40 SER HA 1 40 SER HB2 3.000 . 3.000 2.794 2.468 3.029 0.029 16 0 "[ . 1 . 2]" 1
1184 1 40 SER HA 1 40 SER HB3 3.000 . 3.000 2.628 2.372 3.033 0.033 4 0 "[ . 1 . 2]" 1
1185 1 40 SER QB 1 41 PHE H 4.280 . 4.280 2.821 2.548 3.543 . 0 0 "[ . 1 . 2]" 1
1186 1 40 SER QB 1 41 PHE QD 4.910 . 4.910 3.578 3.223 4.127 . 0 0 "[ . 1 . 2]" 1
1187 1 40 SER QB 1 41 PHE QE 4.970 . 4.970 3.478 3.043 4.077 . 0 0 "[ . 1 . 2]" 1
1188 1 40 SER HB2 1 41 PHE H 4.950 . 4.950 3.302 2.703 3.971 . 0 0 "[ . 1 . 2]" 1
1189 1 40 SER HB3 1 41 PHE H 4.950 . 4.950 3.567 2.586 4.115 . 0 0 "[ . 1 . 2]" 1
1190 1 41 PHE H 1 41 PHE HB2 3.760 . 3.760 2.511 2.407 2.623 . 0 0 "[ . 1 . 2]" 1
1191 1 41 PHE H 1 41 PHE HB3 3.760 . 3.760 3.647 3.586 3.705 . 0 0 "[ . 1 . 2]" 1
1192 1 41 PHE H 1 41 PHE QD 3.500 . 3.500 2.904 2.714 3.058 . 0 0 "[ . 1 . 2]" 1
1193 1 41 PHE H 1 41 PHE QE 4.530 . 4.530 4.325 4.239 4.405 . 0 0 "[ . 1 . 2]" 1
1194 1 41 PHE H 1 41 PHE HZ 5.500 . 5.500 5.555 5.497 5.606 0.106 8 0 "[ . 1 . 2]" 1
1195 1 41 PHE H 1 42 GLU H 4.670 . 4.670 3.547 2.029 4.383 . 0 0 "[ . 1 . 2]" 1
1196 1 41 PHE H 1 43 ILE MD 5.500 . 5.500 4.906 4.632 5.179 . 0 0 "[ . 1 . 2]" 1
1197 1 41 PHE H 1 43 ILE QG 4.950 . 4.950 3.890 3.558 4.174 . 0 0 "[ . 1 . 2]" 1
1198 1 41 PHE HA 1 41 PHE QD 3.360 . 3.360 2.499 2.286 2.723 . 0 0 "[ . 1 . 2]" 1
1199 1 41 PHE HA 1 42 GLU H 3.420 . 3.420 2.934 2.492 3.473 0.053 5 0 "[ . 1 . 2]" 1
1200 1 41 PHE HA 1 42 GLU HA 5.500 . 5.500 4.750 4.316 5.296 . 0 0 "[ . 1 . 2]" 1
1201 1 41 PHE HA 1 42 GLU QB 4.700 . 4.700 4.493 4.021 4.693 . 0 0 "[ . 1 . 2]" 1
1202 1 41 PHE HA 1 42 GLU QG 4.360 . 4.360 3.820 3.210 4.485 0.125 6 0 "[ . 1 . 2]" 1
1203 1 41 PHE QB 1 42 GLU H 3.530 . 3.530 2.337 1.896 3.170 . 0 0 "[ . 1 . 2]" 1
1204 1 41 PHE QB 1 42 GLU HA 5.010 . 5.010 4.090 3.842 4.663 . 0 0 "[ . 1 . 2]" 1
1205 1 41 PHE QB 1 42 GLU QB 5.340 . 5.340 4.347 4.193 4.561 . 0 0 "[ . 1 . 2]" 1
1206 1 41 PHE QB 1 42 GLU QG 5.180 . 5.180 4.287 3.171 4.842 . 0 0 "[ . 1 . 2]" 1
1207 1 41 PHE QB 1 43 ILE HA 5.340 . 5.340 4.312 3.876 4.572 . 0 0 "[ . 1 . 2]" 1
1208 1 41 PHE QB 1 43 ILE MD 3.490 . 3.490 2.455 2.227 3.144 . 0 0 "[ . 1 . 2]" 1
1209 1 41 PHE QB 1 43 ILE QG 3.310 . 3.310 1.948 1.806 2.222 . 0 0 "[ . 1 . 2]" 1
1210 1 41 PHE QB 1 43 ILE MG 4.720 . 4.720 4.390 4.062 4.550 . 0 0 "[ . 1 . 2]" 1
1211 1 41 PHE HB2 1 42 GLU H 4.240 . 4.240 2.852 2.394 3.270 . 0 0 "[ . 1 . 2]" 1
1212 1 41 PHE HB2 1 43 ILE H 4.870 . 4.870 3.512 2.778 3.868 . 0 0 "[ . 1 . 2]" 1
1213 1 41 PHE HB2 1 43 ILE HB 5.500 . 5.500 4.299 3.968 4.935 . 0 0 "[ . 1 . 2]" 1
1214 1 41 PHE HB2 1 43 ILE MD 4.010 . 4.010 2.811 2.562 3.287 . 0 0 "[ . 1 . 2]" 1
1215 1 41 PHE HB2 1 43 ILE HG12 4.500 . 4.500 2.030 1.842 2.984 . 0 0 "[ . 1 . 2]" 1
1216 1 41 PHE HB2 1 43 ILE HG13 4.500 . 4.500 3.083 2.423 3.286 . 0 0 "[ . 1 . 2]" 1
1217 1 41 PHE HB2 1 43 ILE MG 5.440 . 5.440 4.709 4.599 4.898 . 0 0 "[ . 1 . 2]" 1
1218 1 41 PHE HB3 1 42 GLU H 4.240 . 4.240 2.792 1.947 4.257 0.017 14 0 "[ . 1 . 2]" 1
1219 1 41 PHE HB3 1 43 ILE H 4.870 . 4.870 4.516 3.363 4.891 0.021 2 0 "[ . 1 . 2]" 1
1220 1 41 PHE HB3 1 43 ILE HB 5.500 . 5.500 5.501 5.053 5.580 0.080 2 0 "[ . 1 . 2]" 1
1221 1 41 PHE HB3 1 43 ILE MD 4.010 . 4.010 2.728 2.448 4.006 . 0 0 "[ . 1 . 2]" 1
1222 1 41 PHE HB3 1 43 ILE HG12 4.500 . 4.500 3.077 2.715 3.177 . 0 0 "[ . 1 . 2]" 1
1223 1 41 PHE HB3 1 43 ILE HG13 4.500 . 4.500 4.104 3.361 4.267 . 0 0 "[ . 1 . 2]" 1
1224 1 41 PHE HB3 1 43 ILE MG 5.440 . 5.440 5.263 4.497 5.474 0.034 12 0 "[ . 1 . 2]" 1
1225 1 41 PHE QD 1 42 GLU H 4.500 . 4.500 4.081 3.872 4.323 . 0 0 "[ . 1 . 2]" 1
1226 1 41 PHE QD 1 43 ILE MD 4.290 . 4.290 3.453 2.992 3.855 . 0 0 "[ . 1 . 2]" 1
1227 1 41 PHE QD 1 43 ILE QG 5.210 . 5.210 2.849 2.709 3.296 . 0 0 "[ . 1 . 2]" 1
1228 1 42 GLU H 1 42 GLU QB 3.530 . 3.530 2.918 2.513 3.421 . 0 0 "[ . 1 . 2]" 1
1229 1 42 GLU H 1 42 GLU HG2 3.940 . 3.940 3.550 2.039 3.976 0.036 13 0 "[ . 1 . 2]" 1
1230 1 42 GLU H 1 42 GLU HG3 3.940 . 3.940 2.951 2.552 3.620 . 0 0 "[ . 1 . 2]" 1
1231 1 42 GLU H 1 43 ILE H 3.970 . 3.970 3.242 2.632 3.793 . 0 0 "[ . 1 . 2]" 1
1232 1 42 GLU H 1 43 ILE HB 5.500 . 5.500 5.239 4.654 5.546 0.046 19 0 "[ . 1 . 2]" 1
1233 1 42 GLU H 1 43 ILE MD 4.970 . 4.970 3.676 3.027 4.721 . 0 0 "[ . 1 . 2]" 1
1234 1 42 GLU H 1 43 ILE QG 5.170 . 5.170 3.367 3.065 3.754 . 0 0 "[ . 1 . 2]" 1
1235 1 42 GLU HA 1 42 GLU QB 2.700 . 2.700 2.342 2.178 2.406 . 0 0 "[ . 1 . 2]" 1
1236 1 42 GLU HA 1 42 GLU QG 3.490 . 3.490 2.595 2.375 3.485 . 0 0 "[ . 1 . 2]" 1
1237 1 42 GLU HA 1 43 ILE H 2.920 . 2.920 2.322 2.095 2.781 . 0 0 "[ . 1 . 2]" 1
1238 1 42 GLU HA 1 43 ILE HB 5.200 . 5.200 4.830 4.597 5.243 0.043 6 0 "[ . 1 . 2]" 1
1239 1 42 GLU HA 1 43 ILE QG 4.810 . 4.810 4.030 3.529 4.552 . 0 0 "[ . 1 . 2]" 1
1240 1 42 GLU QB 1 42 GLU QG 2.420 . 2.420 2.080 2.025 2.091 . 0 0 "[ . 1 . 2]" 1
1241 1 42 GLU QB 1 43 ILE H 4.050 . 4.050 3.810 3.642 3.996 . 0 0 "[ . 1 . 2]" 1
1242 1 42 GLU QG 1 43 ILE H 4.570 . 4.570 4.339 3.835 4.513 . 0 0 "[ . 1 . 2]" 1
1243 1 42 GLU HG2 1 43 ILE H 5.340 . 5.340 4.777 3.925 5.164 . 0 0 "[ . 1 . 2]" 1
1244 1 42 GLU HG3 1 43 ILE H 5.340 . 5.340 5.031 4.396 5.387 0.047 6 0 "[ . 1 . 2]" 1
1245 1 43 ILE H 1 43 ILE HB 3.130 . 3.130 2.558 2.410 2.674 . 0 0 "[ . 1 . 2]" 1
1246 1 43 ILE H 1 43 ILE MD 4.100 . 4.100 3.393 2.912 3.649 . 0 0 "[ . 1 . 2]" 1
1247 1 43 ILE H 1 43 ILE HG12 3.800 . 3.800 2.410 2.007 3.437 . 0 0 "[ . 1 . 2]" 1
1248 1 43 ILE H 1 43 ILE QG 3.190 . 3.190 2.317 1.997 2.484 . 0 0 "[ . 1 . 2]" 1
1249 1 43 ILE H 1 43 ILE HG13 3.800 . 3.800 3.689 2.048 3.871 0.071 16 0 "[ . 1 . 2]" 1
1250 1 43 ILE H 1 43 ILE MG 3.810 . 3.810 3.790 3.710 3.826 0.016 12 0 "[ . 1 . 2]" 1
1251 1 43 ILE H 1 44 GLU H 4.670 . 4.670 4.286 4.087 4.531 . 0 0 "[ . 1 . 2]" 1
1252 1 43 ILE HA 1 43 ILE MD 3.920 . 3.920 2.168 1.981 3.797 . 0 0 "[ . 1 . 2]" 1
1253 1 43 ILE HA 1 43 ILE HG12 3.870 . 3.870 3.062 2.748 3.183 . 0 0 "[ . 1 . 2]" 1
1254 1 43 ILE HA 1 43 ILE QG 3.380 . 3.380 2.928 2.570 3.020 . 0 0 "[ . 1 . 2]" 1
1255 1 43 ILE HA 1 43 ILE HG13 3.870 . 3.870 3.732 3.091 3.793 . 0 0 "[ . 1 . 2]" 1
1256 1 43 ILE HA 1 43 ILE MG 2.970 . 2.970 2.381 2.254 2.469 . 0 0 "[ . 1 . 2]" 1
1257 1 43 ILE HA 1 44 GLU H 2.560 . 2.560 2.008 1.928 2.242 . 0 0 "[ . 1 . 2]" 1
1258 1 43 ILE HA 1 47 GLN HE21 5.500 . 5.500 4.199 2.275 5.352 . 0 0 "[ . 1 . 2]" 1
1259 1 43 ILE HA 1 47 GLN HE22 5.500 . 5.500 3.841 2.779 5.576 0.076 19 0 "[ . 1 . 2]" 1
1260 1 43 ILE HA 1 47 GLN HG3 4.450 . 4.450 4.325 3.405 4.503 0.053 18 0 "[ . 1 . 2]" 1
1261 1 43 ILE HB 1 43 ILE MD 3.490 . 3.490 3.149 2.140 3.220 . 0 0 "[ . 1 . 2]" 1
1262 1 43 ILE HB 1 44 GLU H 3.990 . 3.990 4.072 3.681 4.126 0.136 12 0 "[ . 1 . 2]" 1
1263 1 43 ILE HB 1 48 MET H 5.200 . 5.200 5.175 4.435 5.248 0.048 14 0 "[ . 1 . 2]" 1
1264 1 43 ILE HB 1 48 MET ME 3.900 . 3.900 3.634 3.291 3.862 . 0 0 "[ . 1 . 2]" 1
1265 1 43 ILE HB 1 48 MET QG 4.490 . 4.490 3.132 2.556 3.350 . 0 0 "[ . 1 . 2]" 1
1266 1 43 ILE MD 1 43 ILE MG 2.610 . 2.610 1.880 1.637 1.950 . 0 0 "[ . 1 . 2]" 1
1267 1 43 ILE MD 1 44 GLU H 5.000 . 5.000 3.683 3.356 4.653 . 0 0 "[ . 1 . 2]" 1
1268 1 43 ILE MD 1 47 GLN QB 3.820 . 3.820 3.163 2.990 3.400 . 0 0 "[ . 1 . 2]" 1
1269 1 43 ILE MD 1 47 GLN HG2 5.500 . 5.500 4.927 4.546 5.635 0.135 5 0 "[ . 1 . 2]" 1
1270 1 43 ILE MD 1 47 GLN HG3 5.500 . 5.500 4.652 3.919 5.018 . 0 0 "[ . 1 . 2]" 1
1271 1 43 ILE MD 1 48 MET H 5.500 . 5.500 5.392 4.530 5.528 0.028 16 0 "[ . 1 . 2]" 1
1272 1 43 ILE MD 1 48 MET HA 5.460 . 5.460 5.445 3.927 5.579 0.119 18 0 "[ . 1 . 2]" 1
1273 1 43 ILE MD 1 48 MET ME 4.390 . 4.390 4.057 2.225 4.253 . 0 0 "[ . 1 . 2]" 1
1274 1 43 ILE MD 1 48 MET QG 4.770 . 4.770 4.641 3.067 4.823 0.053 12 0 "[ . 1 . 2]" 1
1275 1 43 ILE QG 1 43 ILE MG 2.710 . 2.710 2.297 2.113 2.351 . 0 0 "[ . 1 . 2]" 1
1276 1 43 ILE QG 1 44 GLU H 4.740 . 4.740 4.549 4.120 4.680 . 0 0 "[ . 1 . 2]" 1
1277 1 43 ILE QG 1 48 MET ME 4.620 . 4.620 3.592 3.328 4.066 . 0 0 "[ . 1 . 2]" 1
1278 1 43 ILE QG 1 48 MET QG 5.340 . 5.340 4.354 4.095 4.560 . 0 0 "[ . 1 . 2]" 1
1279 1 43 ILE HG12 1 43 ILE MG 3.210 . 3.210 3.128 2.150 3.193 . 0 0 "[ . 1 . 2]" 1
1280 1 43 ILE HG12 1 44 GLU H 5.500 . 5.500 4.920 4.409 5.049 . 0 0 "[ . 1 . 2]" 1
1281 1 43 ILE HG13 1 43 ILE MG 3.210 . 3.210 2.405 2.318 3.111 . 0 0 "[ . 1 . 2]" 1
1282 1 43 ILE HG13 1 44 GLU H 5.500 . 5.500 5.359 4.946 5.535 0.035 1 0 "[ . 1 . 2]" 1
1283 1 43 ILE MG 1 44 GLU H 3.190 . 3.190 2.717 2.094 2.944 . 0 0 "[ . 1 . 2]" 1
1284 1 43 ILE MG 1 44 GLU HA 4.720 . 4.720 4.140 3.933 4.223 . 0 0 "[ . 1 . 2]" 1
1285 1 43 ILE MG 1 44 GLU QG 5.310 . 5.310 4.326 3.608 4.627 . 0 0 "[ . 1 . 2]" 1
1286 1 43 ILE MG 1 47 GLN H 4.340 . 4.340 3.685 3.180 3.987 . 0 0 "[ . 1 . 2]" 1
1287 1 43 ILE MG 1 47 GLN HA 4.440 . 4.440 4.176 4.012 4.322 . 0 0 "[ . 1 . 2]" 1
1288 1 43 ILE MG 1 47 GLN HB2 3.250 . 3.250 1.911 1.764 2.107 . 0 0 "[ . 1 . 2]" 1
1289 1 43 ILE MG 1 47 GLN QB 2.750 . 2.750 1.847 1.746 1.916 . 0 0 "[ . 1 . 2]" 1
1290 1 43 ILE MG 1 47 GLN HB3 3.250 . 3.250 2.562 2.094 3.018 . 0 0 "[ . 1 . 2]" 1
1291 1 43 ILE MG 1 47 GLN HE21 5.240 . 5.240 3.088 1.764 4.802 . 0 0 "[ . 1 . 2]" 1
1292 1 43 ILE MG 1 47 GLN QE 4.590 . 4.590 2.832 1.755 4.164 . 0 0 "[ . 1 . 2]" 1
1293 1 43 ILE MG 1 47 GLN HE22 5.240 . 5.240 3.543 2.881 4.567 . 0 0 "[ . 1 . 2]" 1
1294 1 43 ILE MG 1 47 GLN HG2 4.500 . 4.500 4.069 3.567 4.324 . 0 0 "[ . 1 . 2]" 1
1295 1 43 ILE MG 1 47 GLN HG3 4.320 . 4.320 3.463 2.288 3.858 . 0 0 "[ . 1 . 2]" 1
1296 1 43 ILE MG 1 48 MET H 3.630 . 3.630 2.817 2.736 3.241 . 0 0 "[ . 1 . 2]" 1
1297 1 43 ILE MG 1 48 MET HA 4.080 . 4.080 3.146 3.001 3.977 . 0 0 "[ . 1 . 2]" 1
1298 1 43 ILE MG 1 48 MET ME 3.380 . 3.380 2.129 1.946 3.205 . 0 0 "[ . 1 . 2]" 1
1299 1 43 ILE MG 1 48 MET QG 3.060 . 3.060 2.031 1.875 2.928 . 0 0 "[ . 1 . 2]" 1
1300 1 44 GLU H 1 44 GLU HB2 3.150 . 3.150 2.462 2.315 2.635 . 0 0 "[ . 1 . 2]" 1
1301 1 44 GLU H 1 44 GLU HB3 3.930 . 3.930 3.564 3.510 3.625 . 0 0 "[ . 1 . 2]" 1
1302 1 44 GLU H 1 44 GLU HG2 3.470 . 3.470 2.672 2.030 3.496 0.026 11 0 "[ . 1 . 2]" 1
1303 1 44 GLU H 1 44 GLU QG 3.010 . 3.010 2.146 2.011 2.266 . 0 0 "[ . 1 . 2]" 1
1304 1 44 GLU H 1 44 GLU HG3 3.470 . 3.470 2.974 2.028 3.561 0.091 1 0 "[ . 1 . 2]" 1
1305 1 44 GLU H 1 47 GLN H 4.900 . 4.900 3.945 3.741 4.221 . 0 0 "[ . 1 . 2]" 1
1306 1 44 GLU H 1 47 GLN QB 4.550 . 4.550 3.060 2.293 3.887 . 0 0 "[ . 1 . 2]" 1
1307 1 44 GLU H 1 47 GLN HG2 4.990 . 4.990 4.431 3.555 5.010 0.020 2 0 "[ . 1 . 2]" 1
1308 1 44 GLU H 1 47 GLN HG3 4.120 . 4.120 2.979 2.129 3.289 . 0 0 "[ . 1 . 2]" 1
1309 1 44 GLU H 1 48 MET QG 5.500 . 5.500 4.567 4.312 4.853 . 0 0 "[ . 1 . 2]" 1
1310 1 44 GLU HA 1 44 GLU HB3 2.840 . 2.840 2.437 2.393 2.485 . 0 0 "[ . 1 . 2]" 1
1311 1 44 GLU HA 1 44 GLU QG 3.450 . 3.450 2.726 2.422 3.053 . 0 0 "[ . 1 . 2]" 1
1312 1 44 GLU HA 1 45 SER H 2.840 . 2.840 2.335 2.188 2.485 . 0 0 "[ . 1 . 2]" 1
1313 1 44 GLU HA 1 45 SER QB 4.330 . 4.330 4.292 4.145 4.435 0.105 3 0 "[ . 1 . 2]" 1
1314 1 44 GLU HA 1 47 GLN H 5.340 . 5.340 4.673 4.479 4.974 . 0 0 "[ . 1 . 2]" 1
1315 1 44 GLU HB2 1 45 SER H 4.150 . 4.150 3.628 3.448 3.926 . 0 0 "[ . 1 . 2]" 1
1316 1 44 GLU HB2 1 46 ASP H 4.230 . 4.230 3.113 2.835 3.373 . 0 0 "[ . 1 . 2]" 1
1317 1 44 GLU HB2 1 46 ASP HB2 3.770 . 3.770 3.141 2.730 3.823 0.053 15 0 "[ . 1 . 2]" 1
1318 1 44 GLU HB2 1 47 GLN H 4.090 . 4.090 2.653 2.064 3.175 . 0 0 "[ . 1 . 2]" 1
1319 1 44 GLU HB3 1 45 SER H 3.930 . 3.930 2.536 2.308 2.823 . 0 0 "[ . 1 . 2]" 1
1320 1 44 GLU HB3 1 46 ASP H 3.790 . 3.790 2.699 2.397 2.983 . 0 0 "[ . 1 . 2]" 1
1321 1 44 GLU HB3 1 47 GLN H 5.280 . 5.280 3.701 3.284 4.282 . 0 0 "[ . 1 . 2]" 1
1322 1 44 GLU QG 1 45 SER H 4.530 . 4.530 4.178 3.801 4.474 . 0 0 "[ . 1 . 2]" 1
1323 1 44 GLU QG 1 46 ASP H 4.780 . 4.780 4.565 4.330 4.794 0.014 19 0 "[ . 1 . 2]" 1
1324 1 44 GLU HG2 1 45 SER H 5.300 . 5.300 4.570 3.987 4.959 . 0 0 "[ . 1 . 2]" 1
1325 1 44 GLU HG2 1 46 ASP H 5.500 . 5.500 5.247 4.806 5.490 . 0 0 "[ . 1 . 2]" 1
1326 1 44 GLU HG2 1 47 GLN H 5.500 . 5.500 5.205 4.663 5.557 0.057 8 0 "[ . 1 . 2]" 1
1327 1 44 GLU HG3 1 45 SER H 5.300 . 5.300 4.880 4.695 5.091 . 0 0 "[ . 1 . 2]" 1
1328 1 44 GLU HG3 1 46 ASP H 5.500 . 5.500 5.054 4.652 5.510 0.010 8 0 "[ . 1 . 2]" 1
1329 1 44 GLU HG3 1 47 GLN H 5.500 . 5.500 4.948 4.391 5.505 0.005 2 0 "[ . 1 . 2]" 1
1330 1 45 SER H 1 45 SER QB 3.280 . 3.280 2.303 2.209 2.534 . 0 0 "[ . 1 . 2]" 1
1331 1 45 SER H 1 46 ASP H 4.330 . 4.330 2.639 2.538 2.837 . 0 0 "[ . 1 . 2]" 1
1332 1 45 SER HA 1 48 MET H 4.210 . 4.210 3.246 3.071 3.403 . 0 0 "[ . 1 . 2]" 1
1333 1 45 SER HA 1 48 MET QG 4.180 . 4.180 2.799 2.408 3.308 . 0 0 "[ . 1 . 2]" 1
1334 1 45 SER QB 1 46 ASP H 3.760 . 3.760 2.866 2.623 3.560 . 0 0 "[ . 1 . 2]" 1
1335 1 45 SER QB 1 48 MET H 5.330 . 5.330 4.829 4.606 4.991 . 0 0 "[ . 1 . 2]" 1
1336 1 46 ASP H 1 46 ASP HB2 3.580 . 3.580 2.525 2.316 2.685 . 0 0 "[ . 1 . 2]" 1
1337 1 46 ASP H 1 46 ASP HB3 3.650 . 3.650 3.498 2.577 3.665 0.015 8 0 "[ . 1 . 2]" 1
1338 1 46 ASP H 1 47 GLN H 3.600 . 3.600 2.645 2.336 2.857 . 0 0 "[ . 1 . 2]" 1
1339 1 46 ASP H 1 47 GLN HG2 5.500 . 5.500 5.390 3.925 5.554 0.054 11 0 "[ . 1 . 2]" 1
1340 1 46 ASP H 1 47 GLN HG3 4.740 . 4.740 4.249 4.020 4.826 0.086 19 0 "[ . 1 . 2]" 1
1341 1 46 ASP H 1 48 MET H 5.020 . 5.020 3.891 3.769 4.028 . 0 0 "[ . 1 . 2]" 1
1342 1 46 ASP HA 1 46 ASP HB3 2.810 . 2.810 2.515 2.395 2.943 0.133 15 0 "[ . 1 . 2]" 1
1343 1 46 ASP HA 1 48 MET H 4.820 . 4.820 4.449 4.198 4.685 . 0 0 "[ . 1 . 2]" 1
1344 1 46 ASP HB2 1 47 GLN H 4.110 . 4.110 2.502 2.075 3.478 . 0 0 "[ . 1 . 2]" 1
1345 1 46 ASP HB2 1 47 GLN HA 5.400 . 5.400 4.298 3.931 5.438 0.038 17 0 "[ . 1 . 2]" 1
1346 1 46 ASP HB3 1 47 GLN H 4.130 . 4.130 3.380 2.095 3.790 . 0 0 "[ . 1 . 2]" 1
1347 1 46 ASP HB3 1 47 GLN HA 4.440 . 4.440 4.313 3.838 4.460 0.020 9 0 "[ . 1 . 2]" 1
1348 1 47 GLN H 1 47 GLN HB2 3.650 . 3.650 2.554 2.363 2.714 . 0 0 "[ . 1 . 2]" 1
1349 1 47 GLN H 1 47 GLN HB3 3.650 . 3.650 3.586 3.504 3.641 . 0 0 "[ . 1 . 2]" 1
1350 1 47 GLN H 1 47 GLN HG2 3.470 . 3.470 3.066 2.103 3.393 . 0 0 "[ . 1 . 2]" 1
1351 1 47 GLN H 1 47 GLN HG3 3.610 . 3.610 2.194 1.933 3.172 . 0 0 "[ . 1 . 2]" 1
1352 1 47 GLN H 1 48 MET H 3.520 . 3.520 2.461 2.290 2.636 . 0 0 "[ . 1 . 2]" 1
1353 1 47 GLN H 1 48 MET HA 5.270 . 5.270 5.046 4.884 5.191 . 0 0 "[ . 1 . 2]" 1
1354 1 47 GLN H 1 48 MET HB2 4.730 . 4.730 4.536 4.353 4.711 . 0 0 "[ . 1 . 2]" 1
1355 1 47 GLN H 1 48 MET QG 4.940 . 4.940 4.507 4.244 4.857 . 0 0 "[ . 1 . 2]" 1
1356 1 47 GLN H 1 49 ASP H 4.710 . 4.710 4.079 3.825 4.380 . 0 0 "[ . 1 . 2]" 1
1357 1 47 GLN HA 1 47 GLN HE21 5.500 . 5.500 4.202 3.291 5.226 . 0 0 "[ . 1 . 2]" 1
1358 1 47 GLN HA 1 47 GLN HE22 5.500 . 5.500 5.474 3.946 5.731 0.231 13 0 "[ . 1 . 2]" 1
1359 1 47 GLN HA 1 47 GLN HG2 3.280 . 3.280 2.598 2.263 2.759 . 0 0 "[ . 1 . 2]" 1
1360 1 47 GLN QB 1 48 MET H 3.480 . 3.480 2.541 2.307 2.780 . 0 0 "[ . 1 . 2]" 1
1361 1 47 GLN HB2 1 48 MET H 4.130 . 4.130 2.584 2.343 2.839 . 0 0 "[ . 1 . 2]" 1
1362 1 47 GLN HB3 1 48 MET H 4.130 . 4.130 3.764 3.461 3.982 . 0 0 "[ . 1 . 2]" 1
1363 1 47 GLN HG2 1 48 MET H 4.850 . 4.850 4.743 4.176 4.868 0.018 7 0 "[ . 1 . 2]" 1
1364 1 47 GLN HG3 1 48 MET H 4.520 . 4.520 4.023 3.713 4.498 . 0 0 "[ . 1 . 2]" 1
1365 1 48 MET H 1 48 MET HB2 3.330 . 3.330 2.405 2.344 2.449 . 0 0 "[ . 1 . 2]" 1
1366 1 48 MET H 1 48 MET HB3 3.780 . 3.780 3.607 3.579 3.630 . 0 0 "[ . 1 . 2]" 1
1367 1 48 MET H 1 48 MET ME 4.220 . 4.220 3.811 3.745 3.892 . 0 0 "[ . 1 . 2]" 1
1368 1 48 MET H 1 48 MET QG 3.480 . 3.480 2.599 2.515 2.705 . 0 0 "[ . 1 . 2]" 1
1369 1 48 MET H 1 49 ASP H 3.420 . 3.420 2.726 2.579 2.857 . 0 0 "[ . 1 . 2]" 1
1370 1 48 MET H 1 49 ASP HB2 5.500 . 5.500 5.068 4.770 5.391 . 0 0 "[ . 1 . 2]" 1
1371 1 48 MET H 1 49 ASP HB3 5.500 . 5.500 4.935 4.687 5.236 . 0 0 "[ . 1 . 2]" 1
1372 1 48 MET HA 1 48 MET ME 2.710 . 2.710 1.802 1.760 1.833 . 0 0 "[ . 1 . 2]" 1
1373 1 48 MET HA 1 48 MET QG 3.310 . 3.310 2.640 2.586 2.720 . 0 0 "[ . 1 . 2]" 1
1374 1 48 MET HA 1 51 TYR H 3.960 . 3.960 3.346 3.261 3.483 . 0 0 "[ . 1 . 2]" 1
1375 1 48 MET HA 1 51 TYR HB2 4.220 . 4.220 3.545 3.421 3.754 . 0 0 "[ . 1 . 2]" 1
1376 1 48 MET HA 1 51 TYR HB3 3.500 . 3.500 2.789 2.636 2.959 . 0 0 "[ . 1 . 2]" 1
1377 1 48 MET HA 1 51 TYR QD 4.910 . 4.910 3.947 3.734 4.119 . 0 0 "[ . 1 . 2]" 1
1378 1 48 MET HA 1 52 TYR H 4.300 . 4.300 4.225 4.149 4.318 0.018 2 0 "[ . 1 . 2]" 1
1379 1 48 MET HA 1 52 TYR QD 5.410 . 5.410 4.944 4.552 5.087 . 0 0 "[ . 1 . 2]" 1
1380 1 48 MET HA 1 52 TYR QE 5.490 . 5.490 4.612 4.412 4.762 . 0 0 "[ . 1 . 2]" 1
1381 1 48 MET HB2 1 49 ASP H 3.780 . 3.780 2.705 2.524 2.810 . 0 0 "[ . 1 . 2]" 1
1382 1 48 MET HB2 1 49 ASP HA 4.790 . 4.790 4.530 4.375 4.636 . 0 0 "[ . 1 . 2]" 1
1383 1 48 MET HB2 1 52 TYR QD 4.930 . 4.930 4.632 4.134 4.839 . 0 0 "[ . 1 . 2]" 1
1384 1 48 MET HB2 1 52 TYR QE 3.590 . 3.590 3.446 3.228 3.605 0.015 5 0 "[ . 1 . 2]" 1
1385 1 48 MET HB3 1 49 ASP H 3.950 . 3.950 3.449 3.317 3.561 . 0 0 "[ . 1 . 2]" 1
1386 1 48 MET HB3 1 52 TYR QE 5.070 . 5.070 2.658 2.048 2.953 . 0 0 "[ . 1 . 2]" 1
1387 1 48 MET ME 1 48 MET QG 2.720 . 2.720 2.519 2.489 2.566 . 0 0 "[ . 1 . 2]" 1
1388 1 48 MET ME 1 51 TYR HB2 4.670 . 4.670 3.141 2.994 3.427 . 0 0 "[ . 1 . 2]" 1
1389 1 48 MET ME 1 51 TYR HB3 3.500 . 3.500 2.318 2.190 2.624 . 0 0 "[ . 1 . 2]" 1
1390 1 48 MET ME 1 51 TYR QD 2.990 . 2.990 2.132 1.990 2.381 . 0 0 "[ . 1 . 2]" 1
1391 1 48 MET ME 1 51 TYR QE 4.720 . 4.720 3.625 3.439 3.860 . 0 0 "[ . 1 . 2]" 1
1392 1 48 MET ME 1 52 TYR H 5.020 . 5.020 4.240 4.093 4.361 . 0 0 "[ . 1 . 2]" 1
1393 1 48 MET QG 1 49 ASP H 4.390 . 4.390 4.248 4.132 4.339 . 0 0 "[ . 1 . 2]" 1
1394 1 48 MET QG 1 51 TYR HB3 5.490 . 5.490 5.007 4.912 5.119 . 0 0 "[ . 1 . 2]" 1
1395 1 48 MET QG 1 51 TYR QD 5.500 . 5.500 5.250 5.062 5.469 . 0 0 "[ . 1 . 2]" 1
1396 1 48 MET QG 1 52 TYR QD 5.500 . 5.500 5.474 5.144 5.534 0.034 2 0 "[ . 1 . 2]" 1
1397 1 48 MET QG 1 52 TYR QE 4.160 . 4.160 4.136 3.770 4.238 0.078 12 0 "[ . 1 . 2]" 1
1398 1 49 ASP H 1 49 ASP HB2 3.720 . 3.720 2.493 2.316 2.640 . 0 0 "[ . 1 . 2]" 1
1399 1 49 ASP H 1 49 ASP HB3 3.080 . 3.080 2.576 2.423 2.680 . 0 0 "[ . 1 . 2]" 1
1400 1 49 ASP H 1 50 GLU H 3.630 . 3.630 2.704 2.553 2.884 . 0 0 "[ . 1 . 2]" 1
1401 1 49 ASP H 1 52 TYR QD 4.690 . 4.690 4.033 3.578 4.153 . 0 0 "[ . 1 . 2]" 1
1402 1 49 ASP H 1 52 TYR QE 4.790 . 4.790 4.264 4.093 4.462 . 0 0 "[ . 1 . 2]" 1
1403 1 49 ASP HA 1 50 GLU HA 5.000 . 5.000 4.741 4.591 4.837 . 0 0 "[ . 1 . 2]" 1
1404 1 49 ASP HA 1 52 TYR H 4.030 . 4.030 3.133 2.907 3.362 . 0 0 "[ . 1 . 2]" 1
1405 1 49 ASP HA 1 52 TYR HB2 4.560 . 4.560 2.457 2.197 2.752 . 0 0 "[ . 1 . 2]" 1
1406 1 49 ASP HA 1 52 TYR QB 3.970 . 3.970 2.437 2.185 2.721 . 0 0 "[ . 1 . 2]" 1
1407 1 49 ASP HA 1 52 TYR HB3 4.560 . 4.560 4.043 3.846 4.290 . 0 0 "[ . 1 . 2]" 1
1408 1 49 ASP HA 1 52 TYR QD 2.870 . 2.870 1.943 1.888 2.040 . 0 0 "[ . 1 . 2]" 1
1409 1 49 ASP HA 1 52 TYR QE 4.130 . 4.130 3.702 3.492 4.115 . 0 0 "[ . 1 . 2]" 1
1410 1 49 ASP HA 1 53 GLU H 4.460 . 4.460 4.010 3.664 4.257 . 0 0 "[ . 1 . 2]" 1
1411 1 49 ASP HA 1 62 LEU QD 5.390 . 5.390 5.422 5.160 5.503 0.113 1 0 "[ . 1 . 2]" 1
1412 1 49 ASP HB2 1 50 GLU HA 5.500 . 5.500 5.550 5.514 5.589 0.089 13 0 "[ . 1 . 2]" 1
1413 1 49 ASP HB3 1 50 GLU H 3.480 . 3.480 2.539 2.346 2.746 . 0 0 "[ . 1 . 2]" 1
1414 1 49 ASP HB3 1 50 GLU HA 4.310 . 4.310 4.182 4.052 4.316 0.006 12 0 "[ . 1 . 2]" 1
1415 1 50 GLU H 1 50 GLU QB 3.160 . 3.160 2.352 2.148 2.636 . 0 0 "[ . 1 . 2]" 1
1416 1 50 GLU H 1 50 GLU QG 4.110 . 4.110 3.065 1.990 4.020 . 0 0 "[ . 1 . 2]" 1
1417 1 50 GLU HA 1 52 TYR H 5.080 . 5.080 4.316 4.080 4.463 . 0 0 "[ . 1 . 2]" 1
1418 1 50 GLU QB 1 51 TYR H 3.780 . 3.780 2.613 2.331 3.534 . 0 0 "[ . 1 . 2]" 1
1419 1 51 TYR H 1 51 TYR HB2 3.450 . 3.450 2.592 2.550 2.641 . 0 0 "[ . 1 . 2]" 1
1420 1 51 TYR H 1 51 TYR HB3 3.480 . 3.480 2.517 2.466 2.567 . 0 0 "[ . 1 . 2]" 1
1421 1 51 TYR H 1 51 TYR QD 4.310 . 4.310 4.227 4.191 4.259 . 0 0 "[ . 1 . 2]" 1
1422 1 51 TYR H 1 52 TYR H 3.650 . 3.650 2.565 2.501 2.622 . 0 0 "[ . 1 . 2]" 1
1423 1 51 TYR H 1 53 GLU H 4.560 . 4.560 4.236 4.114 4.383 . 0 0 "[ . 1 . 2]" 1
1424 1 51 TYR HA 1 51 TYR QD 3.020 . 3.020 2.202 2.113 2.278 . 0 0 "[ . 1 . 2]" 1
1425 1 51 TYR HA 1 51 TYR QE 4.590 . 4.590 4.414 4.318 4.485 . 0 0 "[ . 1 . 2]" 1
1426 1 51 TYR HA 1 53 GLU H 4.710 . 4.710 4.428 4.321 4.538 . 0 0 "[ . 1 . 2]" 1
1427 1 51 TYR HA 1 54 PHE H 3.900 . 3.900 3.227 3.121 3.338 . 0 0 "[ . 1 . 2]" 1
1428 1 51 TYR HA 1 54 PHE HB2 5.090 . 5.090 3.160 3.063 3.228 . 0 0 "[ . 1 . 2]" 1
1429 1 51 TYR HA 1 54 PHE HB3 3.620 . 3.620 2.220 2.105 2.307 . 0 0 "[ . 1 . 2]" 1
1430 1 51 TYR HA 1 54 PHE QD 4.440 . 4.440 3.628 3.492 3.764 . 0 0 "[ . 1 . 2]" 1
1431 1 51 TYR HA 1 55 LEU H 4.590 . 4.590 3.918 3.787 4.027 . 0 0 "[ . 1 . 2]" 1
1432 1 51 TYR HB2 1 52 TYR H 3.980 . 3.980 4.022 3.999 4.039 0.059 14 0 "[ . 1 . 2]" 1
1433 1 51 TYR HB2 1 54 PHE HB2 5.500 . 5.500 5.483 5.393 5.516 0.016 12 0 "[ . 1 . 2]" 1
1434 1 51 TYR HB2 1 54 PHE HB3 5.500 . 5.500 4.536 4.458 4.591 . 0 0 "[ . 1 . 2]" 1
1435 1 51 TYR HB3 1 52 TYR H 3.750 . 3.750 2.835 2.803 2.886 . 0 0 "[ . 1 . 2]" 1
1436 1 51 TYR HB3 1 54 PHE HB3 5.500 . 5.500 4.874 4.812 4.919 . 0 0 "[ . 1 . 2]" 1
1437 1 51 TYR QD 1 54 PHE H 4.620 . 4.620 4.651 4.628 4.678 0.058 11 0 "[ . 1 . 2]" 1
1438 1 51 TYR QD 1 54 PHE HA 5.480 . 5.480 5.525 5.507 5.539 0.059 3 0 "[ . 1 . 2]" 1
1439 1 51 TYR QD 1 54 PHE HB2 4.450 . 4.450 3.788 3.748 3.835 . 0 0 "[ . 1 . 2]" 1
1440 1 51 TYR QD 1 54 PHE HB3 3.460 . 3.460 2.684 2.667 2.707 . 0 0 "[ . 1 . 2]" 1
1441 1 51 TYR QD 1 54 PHE QD 3.590 . 3.590 2.519 2.398 2.699 . 0 0 "[ . 1 . 2]" 1
1442 1 51 TYR QD 1 54 PHE HZ 5.500 . 5.500 5.558 5.519 5.593 0.093 12 0 "[ . 1 . 2]" 1
1443 1 51 TYR QD 1 55 LEU H 4.910 . 4.910 4.136 4.075 4.199 . 0 0 "[ . 1 . 2]" 1
1444 1 51 TYR QD 1 55 LEU HB2 5.500 . 5.500 5.198 5.146 5.306 . 0 0 "[ . 1 . 2]" 1
1445 1 51 TYR QD 1 55 LEU MD1 4.430 . 4.430 3.178 3.109 3.298 . 0 0 "[ . 1 . 2]" 1
1446 1 51 TYR QD 1 55 LEU QD 3.550 . 3.550 3.060 3.007 3.157 . 0 0 "[ . 1 . 2]" 1
1447 1 51 TYR QD 1 55 LEU MD2 4.430 . 4.430 3.997 3.925 4.064 . 0 0 "[ . 1 . 2]" 1
1448 1 51 TYR QE 1 54 PHE HB3 4.850 . 4.850 4.169 4.093 4.246 . 0 0 "[ . 1 . 2]" 1
1449 1 51 TYR QE 1 54 PHE QD 3.350 . 3.350 2.424 2.343 2.534 . 0 0 "[ . 1 . 2]" 1
1450 1 51 TYR QE 1 54 PHE QE 3.620 . 3.620 2.366 2.278 2.482 . 0 0 "[ . 1 . 2]" 1
1451 1 51 TYR QE 1 54 PHE HZ 4.490 . 4.490 4.392 4.299 4.458 . 0 0 "[ . 1 . 2]" 1
1452 1 51 TYR QE 1 55 LEU MD1 3.640 . 3.640 2.477 2.404 2.567 . 0 0 "[ . 1 . 2]" 1
1453 1 51 TYR QE 1 55 LEU QD 3.000 . 3.000 2.324 2.281 2.377 . 0 0 "[ . 1 . 2]" 1
1454 1 51 TYR QE 1 55 LEU MD2 3.640 . 3.640 2.819 2.746 2.885 . 0 0 "[ . 1 . 2]" 1
1455 1 51 TYR QE 1 55 LEU HG 5.150 . 5.150 3.282 3.188 3.355 . 0 0 "[ . 1 . 2]" 1
1456 1 52 TYR H 1 52 TYR HB2 3.860 . 3.860 2.526 2.394 2.574 . 0 0 "[ . 1 . 2]" 1
1457 1 52 TYR H 1 52 TYR HB3 3.860 . 3.860 3.640 3.597 3.668 . 0 0 "[ . 1 . 2]" 1
1458 1 52 TYR H 1 52 TYR QD 3.390 . 3.390 3.261 3.143 3.313 . 0 0 "[ . 1 . 2]" 1
1459 1 52 TYR H 1 52 TYR QE 4.940 . 4.940 4.633 4.581 4.751 . 0 0 "[ . 1 . 2]" 1
1460 1 52 TYR H 1 53 GLU H 3.580 . 3.580 2.675 2.580 2.762 . 0 0 "[ . 1 . 2]" 1
1461 1 52 TYR H 1 53 GLU QB 4.860 . 4.860 4.308 4.080 4.488 . 0 0 "[ . 1 . 2]" 1
1462 1 52 TYR HA 1 52 TYR QD 2.740 . 2.740 2.034 1.977 2.262 . 0 0 "[ . 1 . 2]" 1
1463 1 52 TYR HA 1 52 TYR QE 4.250 . 4.250 4.300 4.271 4.327 0.077 7 0 "[ . 1 . 2]" 1
1464 1 52 TYR HA 1 55 LEU H 4.840 . 4.840 3.430 3.348 3.554 . 0 0 "[ . 1 . 2]" 1
1465 1 52 TYR HA 1 55 LEU HB2 4.180 . 4.180 2.693 2.597 2.911 . 0 0 "[ . 1 . 2]" 1
1466 1 52 TYR HA 1 55 LEU HB3 5.390 . 5.390 4.308 4.191 4.513 . 0 0 "[ . 1 . 2]" 1
1467 1 52 TYR HA 1 55 LEU QD 3.430 . 3.430 2.477 2.326 2.691 . 0 0 "[ . 1 . 2]" 1
1468 1 52 TYR HA 1 55 LEU HG 4.650 . 4.650 3.622 3.517 3.835 . 0 0 "[ . 1 . 2]" 1
1469 1 52 TYR HA 1 56 GLY H 5.130 . 5.130 4.049 3.909 4.233 . 0 0 "[ . 1 . 2]" 1
1470 1 52 TYR HA 1 62 LEU QD 3.040 . 3.040 2.554 2.449 2.717 . 0 0 "[ . 1 . 2]" 1
1471 1 52 TYR HA 1 62 LEU HG 4.620 . 4.620 3.365 3.049 4.651 0.031 6 0 "[ . 1 . 2]" 1
1472 1 52 TYR QB 1 53 GLU H 3.230 . 3.230 2.565 2.372 2.675 . 0 0 "[ . 1 . 2]" 1
1473 1 52 TYR QB 1 53 GLU QB 4.510 . 4.510 3.885 3.621 4.089 . 0 0 "[ . 1 . 2]" 1
1474 1 52 TYR QB 1 55 LEU QD 5.140 . 5.140 4.126 3.960 4.277 . 0 0 "[ . 1 . 2]" 1
1475 1 52 TYR QB 1 62 LEU QD 3.190 . 3.190 2.162 2.006 2.297 . 0 0 "[ . 1 . 2]" 1
1476 1 52 TYR HB2 1 53 GLU H 3.720 . 3.720 2.627 2.415 2.744 . 0 0 "[ . 1 . 2]" 1
1477 1 52 TYR HB2 1 53 GLU QB 5.140 . 5.140 4.071 3.761 4.298 . 0 0 "[ . 1 . 2]" 1
1478 1 52 TYR HB3 1 53 GLU H 3.720 . 3.720 3.591 3.471 3.708 . 0 0 "[ . 1 . 2]" 1
1479 1 52 TYR HB3 1 53 GLU QB 5.140 . 5.140 4.916 4.719 5.125 . 0 0 "[ . 1 . 2]" 1
1480 1 52 TYR QD 1 53 GLU H 4.540 . 4.540 4.434 4.252 4.535 . 0 0 "[ . 1 . 2]" 1
1481 1 52 TYR QD 1 55 LEU HB2 5.500 . 5.500 3.930 3.821 4.150 . 0 0 "[ . 1 . 2]" 1
1482 1 52 TYR QD 1 55 LEU QD 3.960 . 3.960 2.442 2.165 2.791 . 0 0 "[ . 1 . 2]" 1
1483 1 52 TYR QD 1 62 LEU MD1 4.110 . 4.110 3.023 1.973 3.288 . 0 0 "[ . 1 . 2]" 1
1484 1 52 TYR QD 1 62 LEU QD 2.860 . 2.860 2.708 1.816 2.888 0.028 9 0 "[ . 1 . 2]" 1
1485 1 52 TYR QD 1 62 LEU MD2 4.110 . 4.110 3.063 2.098 3.246 . 0 0 "[ . 1 . 2]" 1
1486 1 52 TYR QD 1 62 LEU HG 3.730 . 3.730 2.520 2.212 3.894 0.164 3 0 "[ . 1 . 2]" 1
1487 1 52 TYR QE 1 62 LEU MD1 4.620 . 4.620 3.978 3.498 4.273 . 0 0 "[ . 1 . 2]" 1
1488 1 52 TYR QE 1 62 LEU QD 3.980 . 3.980 3.683 2.559 3.976 . 0 0 "[ . 1 . 2]" 1
1489 1 52 TYR QE 1 62 LEU MD2 4.620 . 4.620 4.497 2.631 4.762 0.142 11 0 "[ . 1 . 2]" 1
1490 1 53 GLU H 1 53 GLU QB 2.900 . 2.900 2.161 2.066 2.250 . 0 0 "[ . 1 . 2]" 1
1491 1 53 GLU H 1 53 GLU QG 4.020 . 4.020 3.955 3.870 4.022 0.002 8 0 "[ . 1 . 2]" 1
1492 1 53 GLU H 1 54 PHE HB3 4.790 . 4.790 4.593 4.549 4.658 . 0 0 "[ . 1 . 2]" 1
1493 1 53 GLU HA 1 53 GLU QB 2.780 . 2.780 2.390 2.337 2.457 . 0 0 "[ . 1 . 2]" 1
1494 1 53 GLU HA 1 53 GLU QG 3.360 . 3.360 2.665 2.349 2.947 . 0 0 "[ . 1 . 2]" 1
1495 1 53 GLU HA 1 55 LEU H 5.060 . 5.060 4.625 4.463 4.711 . 0 0 "[ . 1 . 2]" 1
1496 1 53 GLU HA 1 56 GLY H 3.910 . 3.910 3.484 3.136 3.627 . 0 0 "[ . 1 . 2]" 1
1497 1 53 GLU HA 1 62 LEU QD 5.440 . 5.440 4.326 4.150 4.487 . 0 0 "[ . 1 . 2]" 1
1498 1 53 GLU QB 1 54 PHE H 3.350 . 3.350 2.434 2.256 2.657 . 0 0 "[ . 1 . 2]" 1
1499 1 53 GLU QB 1 54 PHE HB2 4.860 . 4.860 4.267 4.090 4.470 . 0 0 "[ . 1 . 2]" 1
1500 1 53 GLU QB 1 54 PHE HB3 5.020 . 5.020 4.505 4.338 4.711 . 0 0 "[ . 1 . 2]" 1
1501 1 53 GLU QB 1 56 GLY H 5.090 . 5.090 4.970 4.769 5.047 . 0 0 "[ . 1 . 2]" 1
1502 1 53 GLU QG 1 54 PHE H 4.820 . 4.820 3.711 3.429 3.956 . 0 0 "[ . 1 . 2]" 1
1503 1 53 GLU QG 1 54 PHE HA 5.400 . 5.400 3.929 3.543 4.284 . 0 0 "[ . 1 . 2]" 1
1504 1 54 PHE H 1 54 PHE HB2 3.270 . 3.270 2.696 2.628 2.738 . 0 0 "[ . 1 . 2]" 1
1505 1 54 PHE H 1 54 PHE HB3 3.260 . 3.260 2.330 2.308 2.351 . 0 0 "[ . 1 . 2]" 1
1506 1 54 PHE H 1 54 PHE QD 4.030 . 4.030 4.077 4.059 4.089 0.059 12 0 "[ . 1 . 2]" 1
1507 1 54 PHE H 1 55 LEU H 3.760 . 3.760 2.781 2.705 2.854 . 0 0 "[ . 1 . 2]" 1
1508 1 54 PHE H 1 55 LEU QD 5.440 . 5.440 4.934 4.839 5.020 . 0 0 "[ . 1 . 2]" 1
1509 1 54 PHE H 1 56 GLY H 4.970 . 4.970 4.112 3.920 4.211 . 0 0 "[ . 1 . 2]" 1
1510 1 54 PHE H 1 62 LEU QD 5.270 . 5.270 5.239 5.129 5.311 0.041 3 0 "[ . 1 . 2]" 1
1511 1 54 PHE HA 1 54 PHE QD 3.340 . 3.340 2.894 2.826 2.993 . 0 0 "[ . 1 . 2]" 1
1512 1 54 PHE HA 1 54 PHE QE 5.020 . 5.020 4.786 4.733 4.846 . 0 0 "[ . 1 . 2]" 1
1513 1 54 PHE HA 1 55 LEU QD 5.440 . 5.440 5.349 5.275 5.416 . 0 0 "[ . 1 . 2]" 1
1514 1 54 PHE HA 1 56 GLY H 4.740 . 4.740 4.488 4.287 4.608 . 0 0 "[ . 1 . 2]" 1
1515 1 54 PHE HA 1 57 GLU H 3.970 . 3.970 3.511 3.398 3.647 . 0 0 "[ . 1 . 2]" 1
1516 1 54 PHE HA 1 57 GLU QB 3.350 . 3.350 2.819 2.598 2.987 . 0 0 "[ . 1 . 2]" 1
1517 1 54 PHE HA 1 57 GLU QG 5.500 . 5.500 3.124 2.842 3.532 . 0 0 "[ . 1 . 2]" 1
1518 1 54 PHE HA 1 58 GLN QG 5.340 . 5.340 4.091 3.883 4.219 . 0 0 "[ . 1 . 2]" 1
1519 1 54 PHE HB2 1 55 LEU H 4.310 . 4.310 3.849 3.825 3.879 . 0 0 "[ . 1 . 2]" 1
1520 1 54 PHE HB2 1 55 LEU HG 5.410 . 5.410 5.279 5.180 5.374 . 0 0 "[ . 1 . 2]" 1
1521 1 54 PHE HB3 1 55 LEU H 4.080 . 4.080 2.450 2.414 2.494 . 0 0 "[ . 1 . 2]" 1
1522 1 54 PHE HB3 1 55 LEU HG 5.150 . 5.150 3.584 3.495 3.685 . 0 0 "[ . 1 . 2]" 1
1523 1 54 PHE QD 1 55 LEU H 3.780 . 3.780 2.751 2.620 2.833 . 0 0 "[ . 1 . 2]" 1
1524 1 54 PHE QD 1 55 LEU HA 3.340 . 3.340 3.205 3.003 3.328 . 0 0 "[ . 1 . 2]" 1
1525 1 54 PHE QD 1 55 LEU HB2 5.260 . 5.260 4.368 4.192 4.478 . 0 0 "[ . 1 . 2]" 1
1526 1 54 PHE QD 1 55 LEU MD1 4.590 . 4.590 4.057 3.942 4.124 . 0 0 "[ . 1 . 2]" 1
1527 1 54 PHE QD 1 55 LEU QD 3.400 . 3.400 2.740 2.594 2.903 . 0 0 "[ . 1 . 2]" 1
1528 1 54 PHE QD 1 55 LEU MD2 4.590 . 4.590 2.787 2.624 2.968 . 0 0 "[ . 1 . 2]" 1
1529 1 54 PHE QD 1 55 LEU HG 4.120 . 4.120 2.474 2.331 2.547 . 0 0 "[ . 1 . 2]" 1
1530 1 54 PHE QD 1 58 GLN HE21 5.240 . 5.240 3.585 2.951 4.518 . 0 0 "[ . 1 . 2]" 1
1531 1 54 PHE QD 1 58 GLN HE22 5.240 . 5.240 4.444 3.731 5.008 . 0 0 "[ . 1 . 2]" 1
1532 1 54 PHE QD 1 58 GLN QG 4.510 . 4.510 3.571 3.464 3.655 . 0 0 "[ . 1 . 2]" 1
1533 1 54 PHE QE 1 55 LEU H 5.150 . 5.150 4.827 4.760 4.859 . 0 0 "[ . 1 . 2]" 1
1534 1 54 PHE QE 1 55 LEU HA 4.040 . 4.040 3.981 3.840 4.046 0.006 9 0 "[ . 1 . 2]" 1
1535 1 54 PHE QE 1 55 LEU QD 3.660 . 3.660 2.812 2.645 2.971 . 0 0 "[ . 1 . 2]" 1
1536 1 54 PHE QE 1 58 GLN HE21 4.860 . 4.860 3.385 2.618 4.294 . 0 0 "[ . 1 . 2]" 1
1537 1 54 PHE QE 1 58 GLN QE 4.250 . 4.250 3.048 2.505 3.768 . 0 0 "[ . 1 . 2]" 1
1538 1 54 PHE QE 1 58 GLN HE22 4.860 . 4.860 3.566 3.162 4.205 . 0 0 "[ . 1 . 2]" 1
1539 1 54 PHE QE 1 58 GLN QG 4.210 . 4.210 3.081 2.947 3.212 . 0 0 "[ . 1 . 2]" 1
1540 1 54 PHE HZ 1 55 LEU HA 5.500 . 5.500 5.562 5.531 5.598 0.098 11 0 "[ . 1 . 2]" 1
1541 1 54 PHE HZ 1 55 LEU QD 4.910 . 4.910 4.648 4.483 4.794 . 0 0 "[ . 1 . 2]" 1
1542 1 54 PHE HZ 1 58 GLN HB3 5.500 . 5.500 5.500 5.331 5.548 0.048 9 0 "[ . 1 . 2]" 1
1543 1 54 PHE HZ 1 58 GLN HE21 5.500 . 5.500 4.367 3.481 5.242 . 0 0 "[ . 1 . 2]" 1
1544 1 54 PHE HZ 1 58 GLN QE 4.690 . 4.690 3.977 3.290 4.686 . 0 0 "[ . 1 . 2]" 1
1545 1 54 PHE HZ 1 58 GLN HE22 5.500 . 5.500 4.652 4.030 5.279 . 0 0 "[ . 1 . 2]" 1
1546 1 54 PHE HZ 1 58 GLN HG2 4.620 . 4.620 4.317 4.201 4.580 . 0 0 "[ . 1 . 2]" 1
1547 1 54 PHE HZ 1 58 GLN QG 3.970 . 3.970 3.225 3.082 3.363 . 0 0 "[ . 1 . 2]" 1
1548 1 54 PHE HZ 1 58 GLN HG3 4.620 . 4.620 3.331 3.157 3.512 . 0 0 "[ . 1 . 2]" 1
1549 1 55 LEU H 1 55 LEU HB2 3.670 . 3.670 2.405 2.365 2.440 . 0 0 "[ . 1 . 2]" 1
1550 1 55 LEU H 1 55 LEU HB3 4.170 . 4.170 3.572 3.550 3.589 . 0 0 "[ . 1 . 2]" 1
1551 1 55 LEU H 1 55 LEU MD1 3.870 . 3.870 3.557 3.483 3.640 . 0 0 "[ . 1 . 2]" 1
1552 1 55 LEU H 1 55 LEU QD 3.300 . 3.300 3.143 3.106 3.174 . 0 0 "[ . 1 . 2]" 1
1553 1 55 LEU H 1 55 LEU MD2 3.870 . 3.870 3.503 3.429 3.571 . 0 0 "[ . 1 . 2]" 1
1554 1 55 LEU H 1 55 LEU HG 3.490 . 3.490 2.384 2.325 2.440 . 0 0 "[ . 1 . 2]" 1
1555 1 55 LEU H 1 56 GLY H 3.710 . 3.710 2.745 2.713 2.765 . 0 0 "[ . 1 . 2]" 1
1556 1 55 LEU H 1 56 GLY HA2 5.500 . 5.500 5.343 5.300 5.361 . 0 0 "[ . 1 . 2]" 1
1557 1 55 LEU H 1 56 GLY HA3 5.020 . 5.020 4.988 4.947 5.015 . 0 0 "[ . 1 . 2]" 1
1558 1 55 LEU H 1 60 VAL HB 5.500 . 5.500 5.289 5.157 5.402 . 0 0 "[ . 1 . 2]" 1
1559 1 55 LEU H 1 62 LEU MD1 5.260 . 5.260 4.766 4.589 4.944 . 0 0 "[ . 1 . 2]" 1
1560 1 55 LEU H 1 62 LEU QD 4.520 . 4.520 4.043 3.902 4.398 . 0 0 "[ . 1 . 2]" 1
1561 1 55 LEU H 1 62 LEU MD2 5.260 . 5.260 4.389 4.150 5.121 . 0 0 "[ . 1 . 2]" 1
1562 1 55 LEU HA 1 55 LEU MD1 4.100 . 4.100 3.822 3.804 3.846 . 0 0 "[ . 1 . 2]" 1
1563 1 55 LEU HA 1 55 LEU QD 2.640 . 2.640 1.992 1.967 2.036 . 0 0 "[ . 1 . 2]" 1
1564 1 55 LEU HA 1 55 LEU MD2 4.100 . 4.100 1.998 1.974 2.044 . 0 0 "[ . 1 . 2]" 1
1565 1 55 LEU HA 1 55 LEU HG 3.960 . 3.960 2.924 2.874 2.995 . 0 0 "[ . 1 . 2]" 1
1566 1 55 LEU HA 1 58 GLN H 4.320 . 4.320 3.343 3.263 3.419 . 0 0 "[ . 1 . 2]" 1
1567 1 55 LEU HA 1 58 GLN HA 5.500 . 5.500 5.446 5.310 5.527 0.027 6 0 "[ . 1 . 2]" 1
1568 1 55 LEU HA 1 58 GLN HB2 3.590 . 3.590 2.944 2.744 3.080 . 0 0 "[ . 1 . 2]" 1
1569 1 55 LEU HA 1 58 GLN HB3 4.740 . 4.740 4.510 4.330 4.621 . 0 0 "[ . 1 . 2]" 1
1570 1 55 LEU HA 1 58 GLN HG2 4.650 . 4.650 3.009 2.687 3.361 . 0 0 "[ . 1 . 2]" 1
1571 1 55 LEU HA 1 58 GLN QG 4.090 . 4.090 2.809 2.558 3.046 . 0 0 "[ . 1 . 2]" 1
1572 1 55 LEU HA 1 58 GLN HG3 4.650 . 4.650 3.403 2.965 3.718 . 0 0 "[ . 1 . 2]" 1
1573 1 55 LEU HA 1 60 VAL MG2 3.860 . 3.860 3.303 3.199 3.409 . 0 0 "[ . 1 . 2]" 1
1574 1 55 LEU HB2 1 55 LEU MD1 3.300 . 3.300 2.276 2.242 2.323 . 0 0 "[ . 1 . 2]" 1
1575 1 55 LEU HB2 1 55 LEU QD 2.870 . 2.870 2.229 2.199 2.271 . 0 0 "[ . 1 . 2]" 1
1576 1 55 LEU HB2 1 55 LEU MD2 3.300 . 3.300 3.191 3.178 3.206 . 0 0 "[ . 1 . 2]" 1
1577 1 55 LEU HB2 1 56 GLY H 3.800 . 3.800 2.575 2.474 2.726 . 0 0 "[ . 1 . 2]" 1
1578 1 55 LEU HB2 1 56 GLY HA2 5.500 . 5.500 4.410 4.337 4.476 . 0 0 "[ . 1 . 2]" 1
1579 1 55 LEU HB2 1 56 GLY HA3 5.500 . 5.500 4.595 4.534 4.682 . 0 0 "[ . 1 . 2]" 1
1580 1 55 LEU HB2 1 60 VAL H 5.500 . 5.500 5.051 4.908 5.217 . 0 0 "[ . 1 . 2]" 1
1581 1 55 LEU HB2 1 60 VAL HB 3.920 . 3.920 3.445 3.350 3.533 . 0 0 "[ . 1 . 2]" 1
1582 1 55 LEU HB2 1 60 VAL MG1 5.480 . 5.480 4.222 4.065 4.306 . 0 0 "[ . 1 . 2]" 1
1583 1 55 LEU HB2 1 62 LEU MD1 4.050 . 4.050 2.698 2.419 3.335 . 0 0 "[ . 1 . 2]" 1
1584 1 55 LEU HB2 1 62 LEU QD 3.520 . 3.520 2.358 2.207 2.882 . 0 0 "[ . 1 . 2]" 1
1585 1 55 LEU HB2 1 62 LEU MD2 4.050 . 4.050 2.625 2.379 3.173 . 0 0 "[ . 1 . 2]" 1
1586 1 55 LEU HB3 1 55 LEU MD1 3.430 . 3.430 2.369 2.320 2.400 . 0 0 "[ . 1 . 2]" 1
1587 1 55 LEU HB3 1 55 LEU QD 2.580 . 2.580 2.087 2.074 2.099 . 0 0 "[ . 1 . 2]" 1
1588 1 55 LEU HB3 1 55 LEU MD2 3.430 . 3.430 2.318 2.282 2.360 . 0 0 "[ . 1 . 2]" 1
1589 1 55 LEU HB3 1 56 GLY H 4.140 . 4.140 3.463 3.363 3.639 . 0 0 "[ . 1 . 2]" 1
1590 1 55 LEU HB3 1 56 GLY HA2 5.500 . 5.500 4.307 4.222 4.408 . 0 0 "[ . 1 . 2]" 1
1591 1 55 LEU HB3 1 56 GLY HA3 5.500 . 5.500 5.114 5.032 5.252 . 0 0 "[ . 1 . 2]" 1
1592 1 55 LEU HB3 1 60 VAL H 4.550 . 4.550 3.985 3.794 4.144 . 0 0 "[ . 1 . 2]" 1
1593 1 55 LEU HB3 1 60 VAL HB 3.490 . 3.490 1.899 1.847 1.976 . 0 0 "[ . 1 . 2]" 1
1594 1 55 LEU QD 1 56 GLY H 4.450 . 4.450 4.048 3.978 4.137 . 0 0 "[ . 1 . 2]" 1
1595 1 55 LEU QD 1 58 GLN HB3 4.750 . 4.750 4.667 4.431 4.782 0.032 3 0 "[ . 1 . 2]" 1
1596 1 55 LEU QD 1 58 GLN QG 5.220 . 5.220 3.322 2.922 3.616 . 0 0 "[ . 1 . 2]" 1
1597 1 55 LEU QD 1 60 VAL H 5.360 . 5.360 4.618 4.434 4.766 . 0 0 "[ . 1 . 2]" 1
1598 1 55 LEU QD 1 60 VAL HB 3.510 . 3.510 2.886 2.783 3.006 . 0 0 "[ . 1 . 2]" 1
1599 1 55 LEU MD1 1 56 GLY H 5.100 . 5.100 4.443 4.327 4.570 . 0 0 "[ . 1 . 2]" 1
1600 1 55 LEU MD1 1 60 VAL HB 4.580 . 4.580 3.437 3.274 3.568 . 0 0 "[ . 1 . 2]" 1
1601 1 55 LEU MD2 1 56 GLY H 5.100 . 5.100 4.664 4.635 4.726 . 0 0 "[ . 1 . 2]" 1
1602 1 55 LEU MD2 1 60 VAL HB 4.580 . 4.580 3.107 2.933 3.282 . 0 0 "[ . 1 . 2]" 1
1603 1 55 LEU HG 1 56 GLY H 4.770 . 4.770 4.452 4.388 4.493 . 0 0 "[ . 1 . 2]" 1
1604 1 55 LEU HG 1 60 VAL HB 5.500 . 5.500 4.847 4.755 4.929 . 0 0 "[ . 1 . 2]" 1
1605 1 56 GLY H 1 57 GLU H 3.480 . 3.480 2.766 2.705 2.822 . 0 0 "[ . 1 . 2]" 1
1606 1 56 GLY H 1 57 GLU QB 5.200 . 5.200 4.620 4.521 4.684 . 0 0 "[ . 1 . 2]" 1
1607 1 56 GLY H 1 62 LEU QD 4.320 . 4.320 3.204 2.928 3.781 . 0 0 "[ . 1 . 2]" 1
1608 1 56 GLY HA2 1 57 GLU QB 5.340 . 5.340 5.367 5.348 5.386 0.046 2 0 "[ . 1 . 2]" 1
1609 1 56 GLY HA2 1 58 GLN H 4.880 . 4.880 4.266 4.153 4.397 . 0 0 "[ . 1 . 2]" 1
1610 1 56 GLY HA2 1 60 VAL HB 4.600 . 4.600 3.995 3.832 4.137 . 0 0 "[ . 1 . 2]" 1
1611 1 56 GLY HA2 1 60 VAL MG2 5.450 . 5.450 4.634 4.434 4.790 . 0 0 "[ . 1 . 2]" 1
1612 1 56 GLY HA2 1 62 LEU QD 5.320 . 5.320 3.701 3.419 4.498 . 0 0 "[ . 1 . 2]" 1
1613 1 56 GLY HA3 1 57 GLU QB 5.100 . 5.100 4.874 4.799 4.947 . 0 0 "[ . 1 . 2]" 1
1614 1 56 GLY HA3 1 60 VAL H 4.730 . 4.730 4.341 4.127 4.521 . 0 0 "[ . 1 . 2]" 1
1615 1 56 GLY HA3 1 60 VAL HB 5.500 . 5.500 5.349 5.195 5.504 0.004 9 0 "[ . 1 . 2]" 1
1616 1 56 GLY HA3 1 62 LEU QD 4.810 . 4.810 3.809 3.540 4.414 . 0 0 "[ . 1 . 2]" 1
1617 1 57 GLU H 1 57 GLU HB2 3.410 . 3.410 2.351 2.291 2.419 . 0 0 "[ . 1 . 2]" 1
1618 1 57 GLU H 1 57 GLU QB 2.930 . 2.930 2.316 2.262 2.378 . 0 0 "[ . 1 . 2]" 1
1619 1 57 GLU H 1 57 GLU HB3 3.410 . 3.410 3.504 3.488 3.515 0.105 5 0 "[ . 1 . 2]" 1
1620 1 57 GLU H 1 57 GLU QG 3.530 . 3.530 2.235 2.110 2.385 . 0 0 "[ . 1 . 2]" 1
1621 1 57 GLU H 1 58 GLN H 3.620 . 3.620 2.709 2.678 2.751 . 0 0 "[ . 1 . 2]" 1
1622 1 57 GLU H 1 58 GLN HB2 5.360 . 5.360 5.092 4.949 5.184 . 0 0 "[ . 1 . 2]" 1
1623 1 57 GLU H 1 58 GLN QG 5.250 . 5.250 4.139 4.030 4.248 . 0 0 "[ . 1 . 2]" 1
1624 1 57 GLU QB 1 58 GLN QE 3.900 . 3.900 2.817 2.093 3.465 . 0 0 "[ . 1 . 2]" 1
1625 1 57 GLU HB2 1 58 GLN HE21 5.130 . 5.130 3.058 2.183 3.804 . 0 0 "[ . 1 . 2]" 1
1626 1 57 GLU HB2 1 58 GLN HE22 5.130 . 5.130 4.288 3.558 5.036 . 0 0 "[ . 1 . 2]" 1
1627 1 57 GLU HB3 1 58 GLN HE21 5.130 . 5.130 3.681 2.825 4.431 . 0 0 "[ . 1 . 2]" 1
1628 1 57 GLU HB3 1 58 GLN HE22 5.130 . 5.130 4.334 3.565 5.144 0.014 9 0 "[ . 1 . 2]" 1
1629 1 57 GLU QG 1 58 GLN H 5.000 . 5.000 4.178 4.070 4.363 . 0 0 "[ . 1 . 2]" 1
1630 1 58 GLN H 1 58 GLN HB2 3.590 . 3.590 2.587 2.513 2.653 . 0 0 "[ . 1 . 2]" 1
1631 1 58 GLN H 1 58 GLN HB3 3.720 . 3.720 3.619 3.589 3.639 . 0 0 "[ . 1 . 2]" 1
1632 1 58 GLN H 1 58 GLN HG2 3.870 . 3.870 2.187 2.107 2.271 . 0 0 "[ . 1 . 2]" 1
1633 1 58 GLN H 1 58 GLN QG 3.330 . 3.330 2.171 2.093 2.252 . 0 0 "[ . 1 . 2]" 1
1634 1 58 GLN H 1 58 GLN HG3 3.870 . 3.870 3.654 3.579 3.736 . 0 0 "[ . 1 . 2]" 1
1635 1 58 GLN H 1 59 GLY H 3.860 . 3.860 2.554 2.465 2.639 . 0 0 "[ . 1 . 2]" 1
1636 1 58 GLN H 1 60 VAL H 4.800 . 4.800 4.166 3.867 4.401 . 0 0 "[ . 1 . 2]" 1
1637 1 58 GLN HA 1 58 GLN HE21 4.570 . 4.570 3.611 2.664 4.180 . 0 0 "[ . 1 . 2]" 1
1638 1 58 GLN HA 1 58 GLN QE 4.000 . 4.000 3.285 2.571 3.722 . 0 0 "[ . 1 . 2]" 1
1639 1 58 GLN HA 1 58 GLN HE22 4.570 . 4.570 3.833 3.344 4.175 . 0 0 "[ . 1 . 2]" 1
1640 1 58 GLN HA 1 58 GLN HG2 3.870 . 3.870 3.220 3.070 3.337 . 0 0 "[ . 1 . 2]" 1
1641 1 58 GLN HA 1 58 GLN QG 3.350 . 3.350 3.055 2.944 3.140 . 0 0 "[ . 1 . 2]" 1
1642 1 58 GLN HA 1 58 GLN HG3 3.870 . 3.870 3.806 3.745 3.865 . 0 0 "[ . 1 . 2]" 1
1643 1 58 GLN HA 1 60 VAL MG2 5.500 . 5.500 5.129 4.971 5.283 . 0 0 "[ . 1 . 2]" 1
1644 1 58 GLN HB2 1 59 GLY H 4.580 . 4.580 2.437 2.272 2.608 . 0 0 "[ . 1 . 2]" 1
1645 1 58 GLN HB2 1 59 GLY QA 5.130 . 5.130 4.131 4.014 4.274 . 0 0 "[ . 1 . 2]" 1
1646 1 58 GLN HB2 1 60 VAL MG2 3.830 . 3.830 2.776 2.561 3.003 . 0 0 "[ . 1 . 2]" 1
1647 1 58 GLN HB3 1 58 GLN HE22 5.500 . 5.500 4.596 4.328 4.818 . 0 0 "[ . 1 . 2]" 1
1648 1 58 GLN HB3 1 59 GLY QA 5.340 . 5.340 4.451 4.333 4.589 . 0 0 "[ . 1 . 2]" 1
1649 1 58 GLN HB3 1 60 VAL H 5.500 . 5.500 5.394 5.052 5.517 0.017 13 0 "[ . 1 . 2]" 1
1650 1 58 GLN HB3 1 60 VAL MG2 4.070 . 4.070 3.846 3.639 4.011 . 0 0 "[ . 1 . 2]" 1
1651 1 58 GLN QG 1 60 VAL MG2 5.050 . 5.050 4.043 3.848 4.287 . 0 0 "[ . 1 . 2]" 1
1652 1 59 GLY H 1 60 VAL H 3.360 . 3.360 2.071 1.860 2.232 . 0 0 "[ . 1 . 2]" 1
1653 1 59 GLY HA2 1 60 VAL MG2 4.850 . 4.850 4.226 4.167 4.357 . 0 0 "[ . 1 . 2]" 1
1654 1 59 GLY HA3 1 60 VAL MG2 4.850 . 4.850 3.892 3.804 3.971 . 0 0 "[ . 1 . 2]" 1
1655 1 60 VAL H 1 60 VAL HB 3.210 . 3.210 2.764 2.656 2.852 . 0 0 "[ . 1 . 2]" 1
1656 1 60 VAL H 1 60 VAL MG2 3.060 . 3.060 2.701 2.505 2.883 . 0 0 "[ . 1 . 2]" 1
1657 1 60 VAL H 1 61 GLU HG3 5.500 . 5.500 4.966 4.748 5.597 0.097 4 0 "[ . 1 . 2]" 1
1658 1 60 VAL HA 1 60 VAL MG1 3.040 . 3.040 2.323 2.295 2.364 . 0 0 "[ . 1 . 2]" 1
1659 1 60 VAL HA 1 60 VAL MG2 2.950 . 2.950 2.538 2.472 2.581 . 0 0 "[ . 1 . 2]" 1
1660 1 60 VAL HA 1 61 GLU H 2.940 . 2.940 2.132 2.094 2.172 . 0 0 "[ . 1 . 2]" 1
1661 1 60 VAL HA 1 61 GLU HA 4.640 . 4.640 4.366 4.315 4.408 . 0 0 "[ . 1 . 2]" 1
1662 1 60 VAL HA 1 61 GLU HB2 4.460 . 4.460 4.452 4.348 4.494 0.034 19 0 "[ . 1 . 2]" 1
1663 1 60 VAL HA 1 61 GLU HG2 5.500 . 5.500 5.176 3.542 5.426 . 0 0 "[ . 1 . 2]" 1
1664 1 60 VAL HA 1 61 GLU HG3 5.500 . 5.500 4.038 3.714 4.822 . 0 0 "[ . 1 . 2]" 1
1665 1 60 VAL HB 1 61 GLU H 4.850 . 4.850 4.064 3.985 4.171 . 0 0 "[ . 1 . 2]" 1
1666 1 60 VAL HB 1 62 LEU MD1 5.500 . 5.500 3.166 2.832 5.251 . 0 0 "[ . 1 . 2]" 1
1667 1 60 VAL HB 1 62 LEU QD 4.270 . 4.270 2.961 2.780 3.943 . 0 0 "[ . 1 . 2]" 1
1668 1 60 VAL HB 1 62 LEU MD2 5.500 . 5.500 3.898 3.634 4.138 . 0 0 "[ . 1 . 2]" 1
1669 1 60 VAL HB 1 62 LEU HG 5.500 . 5.500 5.461 4.560 5.582 0.082 17 0 "[ . 1 . 2]" 1
1670 1 60 VAL MG1 1 61 GLU H 3.220 . 3.220 2.729 2.631 2.827 . 0 0 "[ . 1 . 2]" 1
1671 1 60 VAL MG1 1 61 GLU HA 4.480 . 4.480 3.893 3.825 3.981 . 0 0 "[ . 1 . 2]" 1
1672 1 60 VAL MG1 1 61 GLU HB2 4.570 . 4.570 4.288 4.164 4.404 . 0 0 "[ . 1 . 2]" 1
1673 1 60 VAL MG1 1 61 GLU HB3 5.400 . 5.400 5.061 4.952 5.158 . 0 0 "[ . 1 . 2]" 1
1674 1 60 VAL MG1 1 61 GLU HG2 5.500 . 5.500 5.472 4.415 5.574 0.074 14 0 "[ . 1 . 2]" 1
1675 1 60 VAL MG1 1 61 GLU HG3 5.500 . 5.500 4.891 4.690 5.545 0.045 4 0 "[ . 1 . 2]" 1
1676 1 60 VAL MG1 1 62 LEU HA 4.480 . 4.480 3.629 3.510 3.895 . 0 0 "[ . 1 . 2]" 1
1677 1 60 VAL MG1 1 63 ILE H 5.500 . 5.500 4.942 4.802 5.192 . 0 0 "[ . 1 . 2]" 1
1678 1 61 GLU H 1 61 GLU HB2 3.130 . 3.130 2.348 2.309 2.378 . 0 0 "[ . 1 . 2]" 1
1679 1 61 GLU H 1 61 GLU HB3 3.750 . 3.750 3.581 3.548 3.606 . 0 0 "[ . 1 . 2]" 1
1680 1 61 GLU H 1 61 GLU HG2 4.580 . 4.580 3.638 2.322 3.841 . 0 0 "[ . 1 . 2]" 1
1681 1 61 GLU H 1 61 GLU HG3 3.870 . 3.870 2.625 2.380 3.410 . 0 0 "[ . 1 . 2]" 1
1682 1 61 GLU HA 1 61 GLU HG2 3.540 . 3.540 2.438 2.311 2.507 . 0 0 "[ . 1 . 2]" 1
1683 1 61 GLU HA 1 61 GLU HG3 3.770 . 3.770 3.022 2.865 3.681 . 0 0 "[ . 1 . 2]" 1
1684 1 61 GLU HA 1 62 LEU H 2.650 . 2.650 2.240 2.041 2.459 . 0 0 "[ . 1 . 2]" 1
1685 1 61 GLU HA 1 62 LEU HA 5.210 . 5.210 4.299 4.243 4.335 . 0 0 "[ . 1 . 2]" 1
1686 1 61 GLU HA 1 62 LEU HB2 4.860 . 4.860 4.689 4.341 4.828 . 0 0 "[ . 1 . 2]" 1
1687 1 61 GLU HA 1 62 LEU MD1 5.070 . 5.070 3.683 3.442 4.541 . 0 0 "[ . 1 . 2]" 1
1688 1 61 GLU HA 1 62 LEU QD 4.420 . 4.420 2.927 2.655 3.956 . 0 0 "[ . 1 . 2]" 1
1689 1 61 GLU HA 1 62 LEU MD2 5.070 . 5.070 3.094 2.727 4.437 . 0 0 "[ . 1 . 2]" 1
1690 1 61 GLU HB2 1 62 LEU H 4.800 . 4.800 4.088 3.565 4.254 . 0 0 "[ . 1 . 2]" 1
1691 1 61 GLU HB3 1 62 LEU H 4.120 . 4.120 3.091 2.327 3.313 . 0 0 "[ . 1 . 2]" 1
1692 1 61 GLU HB3 1 62 LEU QD 5.440 . 5.440 4.356 4.149 4.945 . 0 0 "[ . 1 . 2]" 1
1693 1 61 GLU HG2 1 62 LEU H 4.200 . 4.200 4.197 3.695 4.365 0.165 4 0 "[ . 1 . 2]" 1
1694 1 61 GLU HG2 1 62 LEU QD 5.440 . 5.440 4.755 4.496 5.548 0.108 3 0 "[ . 1 . 2]" 1
1695 1 61 GLU HG3 1 62 LEU H 5.500 . 5.500 5.016 4.702 5.417 . 0 0 "[ . 1 . 2]" 1
1696 1 62 LEU H 1 62 LEU HB2 3.390 . 3.390 2.576 2.522 2.660 . 0 0 "[ . 1 . 2]" 1
1697 1 62 LEU H 1 62 LEU MD1 3.940 . 3.940 3.076 2.797 3.885 . 0 0 "[ . 1 . 2]" 1
1698 1 62 LEU H 1 62 LEU QD 3.430 . 3.430 2.172 1.939 3.467 0.037 6 0 "[ . 1 . 2]" 1
1699 1 62 LEU H 1 62 LEU MD2 3.940 . 3.940 2.251 1.972 3.964 0.024 3 0 "[ . 1 . 2]" 1
1700 1 62 LEU H 1 62 LEU HG 3.960 . 3.960 3.990 3.074 4.137 0.177 8 0 "[ . 1 . 2]" 1
1701 1 62 LEU H 1 63 ILE MG 5.500 . 5.500 4.664 4.285 5.028 . 0 0 "[ . 1 . 2]" 1
1702 1 62 LEU HA 1 62 LEU MD1 4.730 . 4.730 2.354 2.126 3.845 . 0 0 "[ . 1 . 2]" 1
1703 1 62 LEU HA 1 62 LEU QD 3.330 . 3.330 2.159 2.064 2.242 . 0 0 "[ . 1 . 2]" 1
1704 1 62 LEU HA 1 62 LEU MD2 4.730 . 4.730 3.372 2.073 3.614 . 0 0 "[ . 1 . 2]" 1
1705 1 62 LEU HA 1 63 ILE H 3.130 . 3.130 2.088 2.054 2.116 . 0 0 "[ . 1 . 2]" 1
1706 1 62 LEU HA 1 63 ILE QG 5.340 . 5.340 3.696 3.579 3.883 . 0 0 "[ . 1 . 2]" 1
1707 1 62 LEU HA 1 63 ILE MG 4.770 . 4.770 4.056 3.852 4.346 . 0 0 "[ . 1 . 2]" 1
1708 1 62 LEU HB2 1 62 LEU QD 2.920 . 2.920 2.201 2.162 2.236 . 0 0 "[ . 1 . 2]" 1
1709 1 62 LEU HB2 1 63 ILE H 4.600 . 4.600 4.255 4.143 4.332 . 0 0 "[ . 1 . 2]" 1
1710 1 62 LEU HB3 1 63 ILE H 4.150 . 4.150 3.549 3.347 3.778 . 0 0 "[ . 1 . 2]" 1
1711 1 62 LEU QD 1 63 ILE H 4.260 . 4.260 3.741 3.515 3.844 . 0 0 "[ . 1 . 2]" 1
1712 1 62 LEU MD1 1 63 ILE H 5.500 . 5.500 4.010 3.799 5.251 . 0 0 "[ . 1 . 2]" 1
1713 1 62 LEU MD2 1 63 ILE H 5.500 . 5.500 4.949 3.576 5.191 . 0 0 "[ . 1 . 2]" 1
1714 1 63 ILE H 1 63 ILE MD 4.020 . 4.020 3.704 3.634 3.824 . 0 0 "[ . 1 . 2]" 1
1715 1 63 ILE H 1 63 ILE HG12 4.120 . 4.120 2.001 1.916 2.147 . 0 0 "[ . 1 . 2]" 1
1716 1 63 ILE H 1 63 ILE HG13 4.120 . 4.120 2.882 2.715 3.005 . 0 0 "[ . 1 . 2]" 1
1717 1 63 ILE H 1 63 ILE MG 3.430 . 3.430 2.737 2.527 2.975 . 0 0 "[ . 1 . 2]" 1
1718 1 63 ILE H 1 64 SER H 4.910 . 4.910 4.477 4.404 4.550 . 0 0 "[ . 1 . 2]" 1
1719 1 63 ILE HA 1 63 ILE MG 3.150 . 3.150 2.257 2.137 2.343 . 0 0 "[ . 1 . 2]" 1
1720 1 63 ILE HA 1 64 SER H 3.210 . 3.210 2.426 2.136 2.668 . 0 0 "[ . 1 . 2]" 1
1721 1 63 ILE HA 1 64 SER HB2 5.150 . 5.150 4.199 3.670 4.544 . 0 0 "[ . 1 . 2]" 1
1722 1 63 ILE HB 1 63 ILE MD 2.970 . 2.970 2.452 2.413 2.504 . 0 0 "[ . 1 . 2]" 1
1723 1 63 ILE HB 1 64 SER H 3.270 . 3.270 2.063 1.737 2.200 . 0 0 "[ . 1 . 2]" 1
1724 1 63 ILE HB 1 64 SER HB3 4.770 . 4.770 4.398 3.965 4.909 0.139 14 0 "[ . 1 . 2]" 1
1725 1 63 ILE HB 1 67 GLU QG 4.430 . 4.430 2.055 1.824 2.313 . 0 0 "[ . 1 . 2]" 1
1726 1 63 ILE MD 1 64 SER H 4.240 . 4.240 4.034 3.784 4.126 . 0 0 "[ . 1 . 2]" 1
1727 1 63 ILE MD 1 65 GLU H 5.500 . 5.500 3.918 2.851 5.541 0.041 12 0 "[ . 1 . 2]" 1
1728 1 63 ILE MD 1 65 GLU HA 4.690 . 4.690 3.667 2.977 4.022 . 0 0 "[ . 1 . 2]" 1
1729 1 63 ILE MD 1 67 GLU H 5.370 . 5.370 4.100 3.530 4.924 . 0 0 "[ . 1 . 2]" 1
1730 1 63 ILE MD 1 67 GLU QG 3.910 . 3.910 2.571 2.039 3.418 . 0 0 "[ . 1 . 2]" 1
1731 1 63 ILE MD 1 68 GLU H 5.010 . 5.010 4.068 3.607 4.632 . 0 0 "[ . 1 . 2]" 1
1732 1 63 ILE MD 1 68 GLU HA 4.280 . 4.280 2.603 1.841 4.357 0.077 20 0 "[ . 1 . 2]" 1
1733 1 63 ILE MD 1 68 GLU QG 4.330 . 4.330 2.774 1.838 4.369 0.039 15 0 "[ . 1 . 2]" 1
1734 1 63 ILE QG 1 64 SER H 3.970 . 3.970 3.447 3.232 3.649 . 0 0 "[ . 1 . 2]" 1
1735 1 63 ILE HG12 1 64 SER H 4.540 . 4.540 4.530 4.398 4.595 0.055 15 0 "[ . 1 . 2]" 1
1736 1 63 ILE HG12 1 67 GLU QG 5.500 . 5.500 4.421 4.155 4.903 . 0 0 "[ . 1 . 2]" 1
1737 1 63 ILE HG13 1 64 SER H 4.540 . 4.540 3.576 3.320 3.840 . 0 0 "[ . 1 . 2]" 1
1738 1 63 ILE HG13 1 67 GLU QG 5.500 . 5.500 3.675 3.296 4.326 . 0 0 "[ . 1 . 2]" 1
1739 1 63 ILE MG 1 64 SER H 4.090 . 4.090 3.312 2.910 3.526 . 0 0 "[ . 1 . 2]" 1
1740 1 63 ILE MG 1 64 SER HA 5.500 . 5.500 5.394 5.170 5.521 0.021 17 0 "[ . 1 . 2]" 1
1741 1 63 ILE MG 1 64 SER HB2 5.500 . 5.500 5.012 4.199 5.549 0.049 18 0 "[ . 1 . 2]" 1
1742 1 63 ILE MG 1 64 SER HB3 5.500 . 5.500 5.446 5.181 5.690 0.190 12 0 "[ . 1 . 2]" 1
1743 1 63 ILE MG 1 67 GLU HB2 4.170 . 4.170 4.223 4.153 4.294 0.124 6 0 "[ . 1 . 2]" 1
1744 1 63 ILE MG 1 67 GLU QG 3.660 . 3.660 2.676 2.433 3.071 . 0 0 "[ . 1 . 2]" 1
1745 1 63 ILE MG 1 68 GLU H 5.500 . 5.500 4.944 4.408 5.342 . 0 0 "[ . 1 . 2]" 1
1746 1 64 SER H 1 64 SER HB2 3.600 . 3.600 2.255 1.744 2.697 . 0 0 "[ . 1 . 2]" 1
1747 1 64 SER H 1 64 SER HB3 3.630 . 3.630 2.734 2.346 3.349 . 0 0 "[ . 1 . 2]" 1
1748 1 64 SER H 1 65 GLU H 4.880 . 4.880 2.985 2.652 4.512 . 0 0 "[ . 1 . 2]" 1
1749 1 64 SER H 1 67 GLU HB3 4.810 . 4.810 4.573 4.258 4.822 0.012 12 0 "[ . 1 . 2]" 1
1750 1 64 SER H 1 67 GLU QG 4.790 . 4.790 2.440 2.058 2.848 . 0 0 "[ . 1 . 2]" 1
1751 1 64 SER HA 1 65 GLU H 3.320 . 3.320 3.279 2.304 3.431 0.111 8 0 "[ . 1 . 2]" 1
1752 1 64 SER HA 1 65 GLU HA 5.230 . 5.230 4.999 4.304 5.166 . 0 0 "[ . 1 . 2]" 1
1753 1 64 SER HA 1 65 GLU QB 4.580 . 4.580 4.078 3.813 4.337 . 0 0 "[ . 1 . 2]" 1
1754 1 64 SER HA 1 66 ASN H 4.700 . 4.700 4.400 3.786 4.759 0.059 16 0 "[ . 1 . 2]" 1
1755 1 64 SER HA 1 67 GLU QG 4.930 . 4.930 4.488 4.102 5.113 0.183 3 0 "[ . 1 . 2]" 1
1756 1 64 SER HB2 1 65 GLU H 4.440 . 4.440 3.561 3.209 4.193 . 0 0 "[ . 1 . 2]" 1
1757 1 64 SER HB2 1 66 ASN H 4.470 . 4.470 4.128 3.690 4.533 0.063 4 0 "[ . 1 . 2]" 1
1758 1 64 SER HB2 1 67 GLU H 5.290 . 5.290 4.612 3.344 5.324 0.034 17 0 "[ . 1 . 2]" 1
1759 1 64 SER HB2 1 67 GLU HB3 5.250 . 5.250 4.756 3.496 5.339 0.089 8 0 "[ . 1 . 2]" 1
1760 1 64 SER HB2 1 67 GLU QG 4.200 . 4.200 3.337 1.995 4.311 0.111 8 0 "[ . 1 . 2]" 1
1761 1 64 SER HB3 1 65 GLU H 4.360 . 4.360 2.710 1.717 4.166 . 0 0 "[ . 1 . 2]" 1
1762 1 64 SER HB3 1 66 ASN H 4.320 . 4.320 2.795 2.162 3.514 . 0 0 "[ . 1 . 2]" 1
1763 1 64 SER HB3 1 66 ASN HB2 5.500 . 5.500 4.036 2.982 5.243 . 0 0 "[ . 1 . 2]" 1
1764 1 64 SER HB3 1 66 ASN QB 4.740 . 4.740 3.221 2.391 4.174 . 0 0 "[ . 1 . 2]" 1
1765 1 64 SER HB3 1 66 ASN HB3 5.500 . 5.500 3.743 2.432 5.282 . 0 0 "[ . 1 . 2]" 1
1766 1 64 SER HB3 1 67 GLU HB3 4.660 . 4.660 4.264 3.656 4.702 0.042 3 0 "[ . 1 . 2]" 1
1767 1 64 SER HB3 1 67 GLU QG 4.140 . 4.140 2.971 1.976 4.103 . 0 0 "[ . 1 . 2]" 1
1768 1 65 GLU H 1 65 GLU QB 3.280 . 3.280 3.061 2.237 3.223 . 0 0 "[ . 1 . 2]" 1
1769 1 65 GLU H 1 65 GLU QG 4.510 . 4.510 4.304 4.080 4.521 0.011 6 0 "[ . 1 . 2]" 1
1770 1 65 GLU H 1 66 ASN H 3.760 . 3.760 2.454 1.601 3.588 . 0 0 "[ . 1 . 2]" 1
1771 1 65 GLU H 1 67 GLU QG 5.280 . 5.280 2.831 2.304 4.443 . 0 0 "[ . 1 . 2]" 1
1772 1 65 GLU HA 1 65 GLU QB 2.680 . 2.680 2.412 2.300 2.478 . 0 0 "[ . 1 . 2]" 1
1773 1 65 GLU HA 1 65 GLU QG 2.860 . 2.860 2.448 2.224 2.674 . 0 0 "[ . 1 . 2]" 1
1774 1 65 GLU HA 1 66 ASN H 3.500 . 3.500 3.443 3.305 3.523 0.023 5 0 "[ . 1 . 2]" 1
1775 1 65 GLU QB 1 66 ASN H 3.580 . 3.580 2.750 2.454 3.154 . 0 0 "[ . 1 . 2]" 1
1776 1 65 GLU QB 1 66 ASN QB 4.520 . 4.520 4.164 3.663 4.653 0.133 8 0 "[ . 1 . 2]" 1
1777 1 65 GLU QG 1 66 ASN HA 5.340 . 5.340 4.573 3.508 5.339 . 0 0 "[ . 1 . 2]" 1
1778 1 66 ASN H 1 66 ASN HB2 3.470 . 3.470 2.518 2.235 3.589 0.119 9 0 "[ . 1 . 2]" 1
1779 1 66 ASN H 1 66 ASN HB3 3.470 . 3.470 2.790 2.409 3.571 0.101 7 0 "[ . 1 . 2]" 1
1780 1 66 ASN H 1 66 ASN QD 4.790 . 4.790 3.917 2.291 4.578 . 0 0 "[ . 1 . 2]" 1
1781 1 66 ASN H 1 67 GLU H 3.740 . 3.740 2.541 2.137 2.887 . 0 0 "[ . 1 . 2]" 1
1782 1 66 ASN H 1 67 GLU QG 4.000 . 4.000 3.741 3.315 4.042 0.042 3 0 "[ . 1 . 2]" 1
1783 1 66 ASN HA 1 67 GLU H 3.250 . 3.250 3.223 2.996 3.348 0.098 14 0 "[ . 1 . 2]" 1
1784 1 66 ASN HA 1 67 GLU HA 4.640 . 4.640 4.496 4.364 4.616 . 0 0 "[ . 1 . 2]" 1
1785 1 66 ASN HA 1 67 GLU HB3 5.210 . 5.210 5.241 5.111 5.307 0.097 14 0 "[ . 1 . 2]" 1
1786 1 66 ASN HA 1 67 GLU QG 5.500 . 5.500 5.087 4.851 5.560 0.060 3 0 "[ . 1 . 2]" 1
1787 1 66 ASN QB 1 66 ASN QD 3.030 . 3.030 2.237 2.101 2.746 . 0 0 "[ . 1 . 2]" 1
1788 1 66 ASN QB 1 67 GLU H 3.750 . 3.750 3.201 2.357 3.677 . 0 0 "[ . 1 . 2]" 1
1789 1 66 ASN QB 1 67 GLU HA 4.730 . 4.730 4.516 4.136 4.765 0.035 2 0 "[ . 1 . 2]" 1
1790 1 66 ASN QB 1 67 GLU HB3 4.780 . 4.780 3.921 3.546 4.647 . 0 0 "[ . 1 . 2]" 1
1791 1 66 ASN QB 1 67 GLU QG 4.680 . 4.680 4.107 3.511 4.710 0.030 9 0 "[ . 1 . 2]" 1
1792 1 66 ASN HB2 1 67 GLU H 4.450 . 4.450 3.938 2.932 4.464 0.014 6 0 "[ . 1 . 2]" 1
1793 1 66 ASN HB3 1 67 GLU H 4.450 . 4.450 3.543 2.396 4.297 . 0 0 "[ . 1 . 2]" 1
1794 1 67 GLU H 1 67 GLU HB3 3.260 . 3.260 3.009 2.554 3.314 0.054 18 0 "[ . 1 . 2]" 1
1795 1 67 GLU H 1 67 GLU QG 3.540 . 3.540 2.232 1.984 2.558 . 0 0 "[ . 1 . 2]" 1
1796 1 67 GLU HA 1 67 GLU HB3 2.840 . 2.840 2.479 2.433 2.597 . 0 0 "[ . 1 . 2]" 1
1797 1 67 GLU HA 1 67 GLU QG 3.430 . 3.430 3.315 3.256 3.437 0.007 8 0 "[ . 1 . 2]" 1
1798 1 67 GLU HA 1 68 GLU H 2.750 . 2.750 2.314 2.090 2.632 . 0 0 "[ . 1 . 2]" 1
1799 1 67 GLU HB2 1 68 GLU H 3.220 . 3.220 2.643 2.042 2.952 . 0 0 "[ . 1 . 2]" 1
1800 1 67 GLU HB3 1 68 GLU H 3.890 . 3.890 3.890 3.546 4.008 0.118 7 0 "[ . 1 . 2]" 1
1801 1 67 GLU QG 1 68 GLU H 3.520 . 3.520 3.377 2.698 3.615 0.095 8 0 "[ . 1 . 2]" 1
1802 1 67 GLU QG 1 68 GLU HA 3.480 . 3.480 3.533 3.372 3.729 0.249 6 0 "[ . 1 . 2]" 1
1803 1 68 GLU H 1 68 GLU QB 3.100 . 3.100 2.989 2.776 3.182 0.082 15 0 "[ . 1 . 2]" 1
1804 1 68 GLU HA 1 68 GLU QG 3.370 . 3.370 2.708 2.344 3.414 0.044 15 0 "[ . 1 . 2]" 1
1805 1 68 GLU HA 1 69 THR H 2.840 . 2.840 2.404 1.973 2.886 0.046 3 0 "[ . 1 . 2]" 1
1806 1 68 GLU HA 1 69 THR MG 4.050 . 4.050 3.713 3.482 4.025 . 0 0 "[ . 1 . 2]" 1
1807 1 68 GLU QB 1 69 THR H 3.550 . 3.550 3.084 1.799 3.672 0.122 14 0 "[ . 1 . 2]" 1
1808 1 68 GLU QB 1 69 THR HA 4.920 . 4.920 4.291 3.750 4.832 . 0 0 "[ . 1 . 2]" 1
1809 1 68 GLU HB2 1 69 THR H 4.140 . 4.140 3.871 2.520 4.214 0.074 19 0 "[ . 1 . 2]" 1
1810 1 68 GLU HB3 1 69 THR H 4.140 . 4.140 3.366 1.808 4.093 . 0 0 "[ . 1 . 2]" 1
1811 1 69 THR H 1 69 THR HB 4.010 . 4.010 3.600 3.147 3.810 . 0 0 "[ . 1 . 2]" 1
1812 1 69 THR H 1 69 THR MG 3.320 . 3.320 2.839 2.265 3.354 0.034 14 0 "[ . 1 . 2]" 1
1813 1 69 THR H 1 70 GLU H 3.820 . 3.820 2.193 1.645 3.428 . 0 0 "[ . 1 . 2]" 1
1814 1 69 THR H 1 70 GLU HA 4.650 . 4.650 4.518 4.053 4.714 0.064 7 0 "[ . 1 . 2]" 1
1815 1 69 THR H 1 70 GLU QG 4.830 . 4.830 3.227 2.265 4.676 . 0 0 "[ . 1 . 2]" 1
1816 1 69 THR HA 1 69 THR MG 3.270 . 3.270 2.607 2.224 3.243 . 0 0 "[ . 1 . 2]" 1
1817 1 69 THR HA 1 70 GLU H 3.180 . 3.180 3.027 2.156 3.317 0.137 12 0 "[ . 1 . 2]" 1
1818 1 69 THR HA 1 70 GLU QG 4.540 . 4.540 4.591 3.985 4.738 0.198 5 0 "[ . 1 . 2]" 1
1819 1 69 THR HA 1 71 ASP H 3.410 . 3.410 3.363 2.897 3.560 0.150 19 0 "[ . 1 . 2]" 1
1820 1 69 THR HA 1 71 ASP HB3 5.500 . 5.500 4.832 3.909 5.571 0.071 13 0 "[ . 1 . 2]" 1
1821 1 69 THR HA 1 72 LEU QB 5.340 . 5.340 3.991 2.198 5.380 0.040 20 0 "[ . 1 . 2]" 1
1822 1 69 THR HA 1 72 LEU QD 4.420 . 4.420 2.812 2.023 4.535 0.115 20 0 "[ . 1 . 2]" 1
1823 1 69 THR HA 1 72 LEU HG 5.140 . 5.140 2.924 2.125 4.581 . 0 0 "[ . 1 . 2]" 1
1824 1 69 THR HB 1 72 LEU QB 5.340 . 5.340 4.644 2.878 5.362 0.022 9 0 "[ . 1 . 2]" 1
1825 1 69 THR HB 1 72 LEU QD 4.780 . 4.780 3.106 2.336 4.073 . 0 0 "[ . 1 . 2]" 1
1826 1 69 THR MG 1 70 GLU H 4.470 . 4.470 4.014 2.704 4.411 . 0 0 "[ . 1 . 2]" 1
1827 1 69 THR MG 1 70 GLU HA 5.500 . 5.500 4.975 3.663 5.556 0.056 16 0 "[ . 1 . 2]" 1
1828 1 70 GLU H 1 70 GLU HB2 3.830 . 3.830 3.452 2.558 3.857 0.027 2 0 "[ . 1 . 2]" 1
1829 1 70 GLU H 1 70 GLU QB 3.140 . 3.140 2.760 2.503 3.114 . 0 0 "[ . 1 . 2]" 1
1830 1 70 GLU H 1 70 GLU HB3 3.830 . 3.830 3.061 2.602 3.698 . 0 0 "[ . 1 . 2]" 1
1831 1 70 GLU H 1 70 GLU QG 3.410 . 3.410 1.995 1.751 2.477 . 0 0 "[ . 1 . 2]" 1
1832 1 70 GLU HA 1 71 ASP HA 4.780 . 4.780 4.571 4.439 4.794 0.014 5 0 "[ . 1 . 2]" 1
1833 1 70 GLU HA 1 71 ASP HB2 5.460 . 5.460 5.473 5.233 5.594 0.134 6 0 "[ . 1 . 2]" 1
1834 1 70 GLU QB 1 71 ASP HA 4.880 . 4.880 4.361 3.856 4.755 . 0 0 "[ . 1 . 2]" 1
1835 1 70 GLU QG 1 71 ASP H 4.280 . 4.280 3.016 2.036 3.939 . 0 0 "[ . 1 . 2]" 1
1836 1 70 GLU QG 1 71 ASP HA 5.340 . 5.340 4.357 3.217 5.492 0.152 7 0 "[ . 1 . 2]" 1
1837 1 71 ASP H 1 71 ASP HB2 3.560 . 3.560 2.745 2.393 3.386 . 0 0 "[ . 1 . 2]" 1
1838 1 71 ASP H 1 71 ASP HB3 3.550 . 3.550 2.550 2.361 2.774 . 0 0 "[ . 1 . 2]" 1
1839 1 71 ASP H 1 72 LEU HA 5.160 . 5.160 4.841 4.500 5.165 0.005 6 0 "[ . 1 . 2]" 1
1840 1 71 ASP HA 1 71 ASP HB2 2.740 . 2.740 2.455 2.350 2.596 . 0 0 "[ . 1 . 2]" 1
1841 1 71 ASP HA 1 72 LEU H 3.110 . 3.110 2.949 2.095 3.263 0.153 20 0 "[ . 1 . 2]" 1
1842 1 71 ASP HA 1 72 LEU HA 4.720 . 4.720 4.589 4.196 4.742 0.022 5 0 "[ . 1 . 2]" 1
1843 1 71 ASP HA 1 72 LEU QB 5.340 . 5.340 5.094 4.431 5.358 0.018 4 0 "[ . 1 . 2]" 1
1844 1 71 ASP HA 1 72 LEU HG 5.470 . 5.470 5.073 4.204 5.474 0.004 2 0 "[ . 1 . 2]" 1
1845 1 71 ASP HA 1 73 GLU H 4.610 . 4.610 3.593 2.518 4.629 0.019 7 0 "[ . 1 . 2]" 1
1846 1 71 ASP HB2 1 72 LEU H 4.540 . 4.540 4.123 3.768 4.563 0.023 13 0 "[ . 1 . 2]" 1
1847 1 71 ASP HB3 1 72 LEU H 4.330 . 4.330 3.467 2.724 4.368 0.038 16 0 "[ . 1 . 2]" 1
1848 1 71 ASP HB3 1 72 LEU HA 5.460 . 5.460 4.509 4.161 4.950 . 0 0 "[ . 1 . 2]" 1
1849 1 71 ASP HB3 1 72 LEU QD 5.440 . 5.440 3.906 3.349 4.829 . 0 0 "[ . 1 . 2]" 1
1850 1 72 LEU H 1 72 LEU HB2 3.770 . 3.770 2.548 2.429 2.720 . 0 0 "[ . 1 . 2]" 1
1851 1 72 LEU H 1 72 LEU QB 2.940 . 2.940 2.504 2.395 2.663 . 0 0 "[ . 1 . 2]" 1
1852 1 72 LEU H 1 72 LEU HB3 3.770 . 3.770 3.685 3.612 3.804 0.034 8 0 "[ . 1 . 2]" 1
1853 1 72 LEU H 1 72 LEU QD 4.870 . 4.870 3.283 3.050 3.694 . 0 0 "[ . 1 . 2]" 1
1854 1 72 LEU H 1 72 LEU HG 3.420 . 3.420 2.684 2.313 3.395 . 0 0 "[ . 1 . 2]" 1
1855 1 72 LEU HA 1 72 LEU MD1 3.890 . 3.890 3.868 3.801 3.903 0.013 16 0 "[ . 1 . 2]" 1
1856 1 72 LEU HA 1 72 LEU QD 3.010 . 3.010 2.078 1.986 2.151 . 0 0 "[ . 1 . 2]" 1
1857 1 72 LEU HA 1 72 LEU MD2 3.890 . 3.890 2.087 1.993 2.162 . 0 0 "[ . 1 . 2]" 1
1858 1 72 LEU HA 1 72 LEU HG 3.910 . 3.910 3.166 3.049 3.258 . 0 0 "[ . 1 . 2]" 1
1859 1 72 LEU QB 1 72 LEU QD 2.760 . 2.760 1.946 1.918 1.964 . 0 0 "[ . 1 . 2]" 1
1860 1 72 LEU QB 1 73 GLU H 3.980 . 3.980 3.122 2.197 3.814 . 0 0 "[ . 1 . 2]" 1
1861 1 72 LEU HB2 1 73 GLU H 4.650 . 4.650 3.278 2.226 4.439 . 0 0 "[ . 1 . 2]" 1
1862 1 72 LEU HB3 1 73 GLU H 4.650 . 4.650 4.043 3.205 4.434 . 0 0 "[ . 1 . 2]" 1
1863 1 72 LEU QD 1 73 GLU H 5.100 . 5.100 4.217 3.796 4.398 . 0 0 "[ . 1 . 2]" 1
1864 1 73 GLU H 1 73 GLU QB 3.020 . 3.020 2.558 2.350 3.149 0.129 16 0 "[ . 1 . 2]" 1
1865 1 73 GLU H 1 73 GLU HG2 4.090 . 4.090 2.966 2.095 4.114 0.024 4 0 "[ . 1 . 2]" 1
1866 1 73 GLU H 1 73 GLU HG3 4.090 . 4.090 3.392 2.555 4.133 0.043 17 0 "[ . 1 . 2]" 1
1867 1 73 GLU HA 1 73 GLU HG2 4.000 . 4.000 2.977 2.506 3.766 . 0 0 "[ . 1 . 2]" 1
1868 1 73 GLU HA 1 73 GLU QG 3.430 . 3.430 2.814 2.391 3.365 . 0 0 "[ . 1 . 2]" 1
1869 1 73 GLU HA 1 73 GLU HG3 4.000 . 4.000 3.524 2.865 3.903 . 0 0 "[ . 1 . 2]" 1
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