NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400936 |
1v85   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1v85
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 2646
_Distance_constraint_stats_list.Viol_count 1283
_Distance_constraint_stats_list.Viol_total 256.421
_Distance_constraint_stats_list.Viol_max 0.206
_Distance_constraint_stats_list.Viol_rms 0.0033
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0100
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 GLY 0.001 0.001 14 0 "[ . 1 . 2]"
1 11 LEU 0.430 0.206 20 0 "[ . 1 . 2]"
1 12 LEU 0.044 0.017 18 0 "[ . 1 . 2]"
1 13 VAL 0.068 0.034 12 0 "[ . 1 . 2]"
1 14 HIS 0.034 0.034 12 0 "[ . 1 . 2]"
1 15 LYS 0.028 0.009 9 0 "[ . 1 . 2]"
1 16 ALA 0.010 0.003 18 0 "[ . 1 . 2]"
1 17 VAL 0.457 0.036 1 0 "[ . 1 . 2]"
1 18 ASP 0.268 0.036 1 0 "[ . 1 . 2]"
1 19 LYS 0.482 0.073 18 0 "[ . 1 . 2]"
1 20 TRP 0.829 0.073 18 0 "[ . 1 . 2]"
1 21 THR 0.316 0.051 19 0 "[ . 1 . 2]"
1 22 THR 0.430 0.136 15 0 "[ . 1 . 2]"
1 23 GLU 0.389 0.136 15 0 "[ . 1 . 2]"
1 24 GLU 0.312 0.111 10 0 "[ . 1 . 2]"
1 25 VAL 0.185 0.024 10 0 "[ . 1 . 2]"
1 26 VAL 0.322 0.019 19 0 "[ . 1 . 2]"
1 27 LEU 0.350 0.014 19 0 "[ . 1 . 2]"
1 28 TRP 1.432 0.065 12 0 "[ . 1 . 2]"
1 29 LEU 0.506 0.031 12 0 "[ . 1 . 2]"
1 30 GLU 0.063 0.011 19 0 "[ . 1 . 2]"
1 31 GLN 0.430 0.021 19 0 "[ . 1 . 2]"
1 32 LEU 0.471 0.021 19 0 "[ . 1 . 2]"
1 33 GLY 0.142 0.015 19 0 "[ . 1 . 2]"
1 34 PRO 0.097 0.010 11 0 "[ . 1 . 2]"
1 35 TRP 0.153 0.011 3 0 "[ . 1 . 2]"
1 36 ALA 0.234 0.015 19 0 "[ . 1 . 2]"
1 37 SER 0.017 0.006 18 0 "[ . 1 . 2]"
1 38 LEU 0.056 0.008 17 0 "[ . 1 . 2]"
1 39 TYR 0.439 0.105 18 0 "[ . 1 . 2]"
1 40 ARG 0.128 0.028 18 0 "[ . 1 . 2]"
1 41 ASP 0.079 0.037 18 0 "[ . 1 . 2]"
1 42 ARG 0.521 0.105 18 0 "[ . 1 . 2]"
1 43 PHE 0.153 0.023 18 0 "[ . 1 . 2]"
1 44 LEU 0.366 0.035 20 0 "[ . 1 . 2]"
1 45 SER 0.232 0.037 18 0 "[ . 1 . 2]"
1 46 GLU 0.067 0.017 9 0 "[ . 1 . 2]"
1 47 ARG 0.088 0.017 9 0 "[ . 1 . 2]"
1 48 VAL 0.122 0.017 3 0 "[ . 1 . 2]"
1 49 ASN 0.125 0.033 18 0 "[ . 1 . 2]"
1 50 GLY 0.200 0.028 19 0 "[ . 1 . 2]"
1 51 ARG 0.565 0.141 17 0 "[ . 1 . 2]"
1 52 LEU 0.671 0.076 6 0 "[ . 1 . 2]"
1 53 LEU 0.548 0.057 3 0 "[ . 1 . 2]"
1 54 LEU 0.127 0.057 3 0 "[ . 1 . 2]"
1 55 THR 0.130 0.057 3 0 "[ . 1 . 2]"
1 56 LEU 0.112 0.015 6 0 "[ . 1 . 2]"
1 57 THR 0.115 0.020 12 0 "[ . 1 . 2]"
1 58 GLU 0.132 0.036 17 0 "[ . 1 . 2]"
1 59 GLU 1.858 0.163 17 0 "[ . 1 . 2]"
1 60 GLU 0.409 0.039 15 0 "[ . 1 . 2]"
1 61 PHE 0.539 0.039 15 0 "[ . 1 . 2]"
1 62 SER 0.437 0.038 8 0 "[ . 1 . 2]"
1 63 ARG 0.345 0.055 13 0 "[ . 1 . 2]"
1 64 ALA 0.180 0.055 13 0 "[ . 1 . 2]"
1 65 PRO 0.075 0.030 17 0 "[ . 1 . 2]"
1 66 TYR 0.324 0.030 17 0 "[ . 1 . 2]"
1 67 THR 0.154 0.032 13 0 "[ . 1 . 2]"
1 68 ILE 0.088 0.016 19 0 "[ . 1 . 2]"
1 69 GLU 0.107 0.032 19 0 "[ . 1 . 2]"
1 70 ASN 0.175 0.032 19 0 "[ . 1 . 2]"
1 71 SER 0.052 0.010 19 0 "[ . 1 . 2]"
1 72 SER 0.005 0.003 12 0 "[ . 1 . 2]"
1 73 HIS 0.082 0.039 7 0 "[ . 1 . 2]"
1 74 ARG 0.273 0.041 7 0 "[ . 1 . 2]"
1 75 ARG 0.232 0.074 7 0 "[ . 1 . 2]"
1 76 VAL 0.362 0.074 7 0 "[ . 1 . 2]"
1 77 ILE 0.066 0.014 7 0 "[ . 1 . 2]"
1 78 LEU 0.203 0.020 18 0 "[ . 1 . 2]"
1 79 THR 0.111 0.021 7 0 "[ . 1 . 2]"
1 80 GLU 0.314 0.025 12 0 "[ . 1 . 2]"
1 81 LEU 0.732 0.065 12 0 "[ . 1 . 2]"
1 82 GLU 0.124 0.017 18 0 "[ . 1 . 2]"
1 83 ARG 0.092 0.020 9 0 "[ . 1 . 2]"
1 84 VAL 0.330 0.067 15 0 "[ . 1 . 2]"
1 85 ARG 0.322 0.067 15 0 "[ . 1 . 2]"
1 86 SER 0.203 0.073 10 0 "[ . 1 . 2]"
1 87 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 GLU HA 1 11 LEU QD . . 4.940 4.324 3.915 4.801 . 0 0 "[ . 1 . 2]" 1
2 1 8 GLU QB 1 11 LEU HB3 . . 4.350 3.917 3.349 4.343 . 0 0 "[ . 1 . 2]" 1
3 1 8 GLU QB 1 11 LEU QD . . 4.620 2.568 1.897 3.770 . 0 0 "[ . 1 . 2]" 1
4 1 9 HIS HA 1 12 LEU QD . . 5.220 2.899 2.079 3.449 . 0 0 "[ . 1 . 2]" 1
5 1 9 HIS HA 1 12 LEU HG . . 4.980 3.934 3.356 4.958 . 0 0 "[ . 1 . 2]" 1
6 1 9 HIS QB 1 10 GLY HA2 . . 5.180 4.530 4.260 5.016 . 0 0 "[ . 1 . 2]" 1
7 1 9 HIS QB 1 10 GLY HA3 . . 5.340 4.748 4.420 5.011 . 0 0 "[ . 1 . 2]" 1
8 1 9 HIS QB 1 11 LEU QD . . 5.280 4.788 4.473 5.252 . 0 0 "[ . 1 . 2]" 1
9 1 9 HIS QB 1 12 LEU QD . . 5.000 3.793 3.287 4.300 . 0 0 "[ . 1 . 2]" 1
10 1 10 GLY H 1 11 LEU HB3 . . 5.190 4.759 4.547 5.074 . 0 0 "[ . 1 . 2]" 1
11 1 10 GLY H 1 11 LEU QD . . 4.960 2.613 2.406 2.940 . 0 0 "[ . 1 . 2]" 1
12 1 10 GLY H 1 12 LEU HA . . 5.080 4.922 4.780 5.038 . 0 0 "[ . 1 . 2]" 1
13 1 10 GLY H 1 12 LEU HB3 . . 5.160 4.996 4.609 5.161 0.001 14 0 "[ . 1 . 2]" 1
14 1 10 GLY HA2 1 11 LEU QD . . 5.030 4.301 4.137 4.554 . 0 0 "[ . 1 . 2]" 1
15 1 10 GLY HA2 1 12 LEU HB2 . . 5.500 4.217 3.961 4.466 . 0 0 "[ . 1 . 2]" 1
16 1 10 GLY HA2 1 13 VAL MG1 . . 4.870 4.517 4.111 4.845 . 0 0 "[ . 1 . 2]" 1
17 1 10 GLY HA2 1 13 VAL MG2 . . 4.360 3.803 3.123 4.277 . 0 0 "[ . 1 . 2]" 1
18 1 10 GLY HA3 1 11 LEU H . . 3.420 2.729 2.350 2.949 . 0 0 "[ . 1 . 2]" 1
19 1 10 GLY HA3 1 11 LEU HB3 . . 5.500 4.644 4.483 4.782 . 0 0 "[ . 1 . 2]" 1
20 1 10 GLY HA3 1 11 LEU QD . . 5.270 3.960 3.695 4.158 . 0 0 "[ . 1 . 2]" 1
21 1 11 LEU H 1 11 LEU HB3 . . 3.190 2.335 2.155 2.515 . 0 0 "[ . 1 . 2]" 1
22 1 11 LEU H 1 11 LEU MD1 . . 4.810 1.975 1.743 4.210 . 0 0 "[ . 1 . 2]" 1
23 1 11 LEU H 1 11 LEU QD . . 4.200 1.879 1.740 2.376 . 0 0 "[ . 1 . 2]" 1
24 1 11 LEU H 1 11 LEU MD2 . . 4.810 3.715 2.389 4.015 . 0 0 "[ . 1 . 2]" 1
25 1 11 LEU H 1 11 LEU HG . . 4.400 3.740 3.600 3.985 . 0 0 "[ . 1 . 2]" 1
26 1 11 LEU HA 1 11 LEU MD1 . . 3.760 3.409 3.317 3.966 0.206 20 0 "[ . 1 . 2]" 1
27 1 11 LEU HA 1 11 LEU QD . . 3.170 3.020 2.928 3.372 0.202 20 0 "[ . 1 . 2]" 1
28 1 11 LEU HA 1 11 LEU MD2 . . 3.760 3.378 3.226 3.650 . 0 0 "[ . 1 . 2]" 1
29 1 11 LEU HA 1 12 LEU H . . 3.500 3.334 3.240 3.497 . 0 0 "[ . 1 . 2]" 1
30 1 11 LEU HA 1 13 VAL H . . 5.060 4.405 4.015 4.737 . 0 0 "[ . 1 . 2]" 1
31 1 11 LEU HA 1 13 VAL MG2 . . 4.160 3.702 3.495 4.124 . 0 0 "[ . 1 . 2]" 1
32 1 11 LEU HB2 1 12 LEU H . . 5.120 4.343 4.124 4.439 . 0 0 "[ . 1 . 2]" 1
33 1 11 LEU HB3 1 12 LEU H . . 5.410 4.096 3.687 4.267 . 0 0 "[ . 1 . 2]" 1
34 1 11 LEU QD 1 13 VAL H . . 4.680 4.155 3.966 4.695 0.015 20 0 "[ . 1 . 2]" 1
35 1 11 LEU QD 1 15 LYS HD2 . . 4.950 2.830 2.382 3.346 . 0 0 "[ . 1 . 2]" 1
36 1 11 LEU QD 1 20 TRP HE1 . . 4.540 4.213 3.797 4.547 0.007 20 0 "[ . 1 . 2]" 1
37 1 11 LEU QD 1 20 TRP HZ2 . . 5.430 4.857 4.484 5.398 . 0 0 "[ . 1 . 2]" 1
38 1 11 LEU MD1 1 12 LEU H . . 4.760 2.078 1.880 4.146 . 0 0 "[ . 1 . 2]" 1
39 1 11 LEU MD1 1 12 LEU HA . . 4.740 3.132 2.520 4.277 . 0 0 "[ . 1 . 2]" 1
40 1 11 LEU MD2 1 12 LEU H . . 4.760 3.064 2.013 3.417 . 0 0 "[ . 1 . 2]" 1
41 1 11 LEU MD2 1 12 LEU HA . . 4.740 2.416 2.232 3.352 . 0 0 "[ . 1 . 2]" 1
42 1 12 LEU H 1 12 LEU HB2 . . 3.380 2.312 2.165 2.497 . 0 0 "[ . 1 . 2]" 1
43 1 12 LEU H 1 12 LEU HB3 . . 4.150 3.550 3.482 3.588 . 0 0 "[ . 1 . 2]" 1
44 1 12 LEU H 1 12 LEU MD1 . . 4.980 3.556 2.438 3.889 . 0 0 "[ . 1 . 2]" 1
45 1 12 LEU H 1 12 LEU QD . . 4.370 2.874 1.849 3.333 . 0 0 "[ . 1 . 2]" 1
46 1 12 LEU H 1 12 LEU MD2 . . 4.980 3.310 1.854 4.210 . 0 0 "[ . 1 . 2]" 1
47 1 12 LEU H 1 12 LEU HG . . 4.040 2.944 2.225 3.975 . 0 0 "[ . 1 . 2]" 1
48 1 12 LEU H 1 13 VAL H . . 3.940 2.959 2.662 3.242 . 0 0 "[ . 1 . 2]" 1
49 1 12 LEU HA 1 12 LEU MD1 . . 4.030 3.370 1.967 3.911 . 0 0 "[ . 1 . 2]" 1
50 1 12 LEU HA 1 12 LEU QD . . 3.520 2.114 1.882 2.910 . 0 0 "[ . 1 . 2]" 1
51 1 12 LEU HA 1 12 LEU MD2 . . 4.030 2.257 1.968 3.556 . 0 0 "[ . 1 . 2]" 1
52 1 12 LEU HA 1 12 LEU HG . . 4.140 3.012 2.242 3.698 . 0 0 "[ . 1 . 2]" 1
53 1 12 LEU HA 1 15 LYS HB3 . . 5.060 3.415 3.029 3.817 . 0 0 "[ . 1 . 2]" 1
54 1 12 LEU HA 1 15 LYS HD2 . . 5.500 5.074 4.407 5.496 . 0 0 "[ . 1 . 2]" 1
55 1 12 LEU HA 1 15 LYS HD3 . . 5.500 4.444 4.002 4.905 . 0 0 "[ . 1 . 2]" 1
56 1 12 LEU HB2 1 13 VAL H . . 4.060 2.409 2.232 2.626 . 0 0 "[ . 1 . 2]" 1
57 1 12 LEU HB2 1 13 VAL MG1 . . 3.890 3.443 3.148 3.675 . 0 0 "[ . 1 . 2]" 1
58 1 12 LEU HB2 1 13 VAL MG2 . . 4.120 3.966 3.811 4.121 0.001 15 0 "[ . 1 . 2]" 1
59 1 12 LEU HB2 1 20 TRP HZ2 . . 4.890 4.153 3.766 4.512 . 0 0 "[ . 1 . 2]" 1
60 1 12 LEU HB2 1 28 TRP HD1 . . 5.380 4.210 3.760 4.542 . 0 0 "[ . 1 . 2]" 1
61 1 12 LEU HB3 1 13 VAL H . . 4.220 3.006 2.636 3.481 . 0 0 "[ . 1 . 2]" 1
62 1 12 LEU HB3 1 13 VAL MG1 . . 4.190 3.646 3.309 4.049 . 0 0 "[ . 1 . 2]" 1
63 1 12 LEU HB3 1 17 VAL MG2 . . 4.890 4.636 4.269 4.855 . 0 0 "[ . 1 . 2]" 1
64 1 12 LEU HB3 1 20 TRP HE1 . . 5.180 4.625 4.254 5.027 . 0 0 "[ . 1 . 2]" 1
65 1 12 LEU HB3 1 20 TRP HZ2 . . 4.440 2.558 2.308 2.932 . 0 0 "[ . 1 . 2]" 1
66 1 12 LEU HB3 1 28 TRP HA . . 5.500 5.170 4.919 5.513 0.013 18 0 "[ . 1 . 2]" 1
67 1 12 LEU QD 1 13 VAL H . . 5.030 3.862 3.723 4.055 . 0 0 "[ . 1 . 2]" 1
68 1 12 LEU QD 1 15 LYS HD2 . . 5.440 4.980 4.389 5.296 . 0 0 "[ . 1 . 2]" 1
69 1 12 LEU QD 1 15 LYS HD3 . . 5.440 4.257 3.517 4.853 . 0 0 "[ . 1 . 2]" 1
70 1 12 LEU QD 1 20 TRP HD1 . . 5.030 4.527 3.829 5.038 0.008 18 0 "[ . 1 . 2]" 1
71 1 12 LEU QD 1 20 TRP HE1 . . 4.540 3.600 2.892 4.159 . 0 0 "[ . 1 . 2]" 1
72 1 12 LEU QD 1 20 TRP HE3 . . 4.850 3.743 3.281 4.035 . 0 0 "[ . 1 . 2]" 1
73 1 12 LEU QD 1 20 TRP HH2 . . 5.200 2.872 2.447 3.242 . 0 0 "[ . 1 . 2]" 1
74 1 12 LEU QD 1 20 TRP HZ2 . . 4.150 2.899 2.453 3.340 . 0 0 "[ . 1 . 2]" 1
75 1 12 LEU QD 1 24 GLU HA . . 4.270 3.630 3.386 3.990 . 0 0 "[ . 1 . 2]" 1
76 1 12 LEU QD 1 24 GLU HB2 . . 4.690 4.016 3.484 4.462 . 0 0 "[ . 1 . 2]" 1
77 1 12 LEU QD 1 24 GLU HB3 . . 3.990 2.662 2.078 3.154 . 0 0 "[ . 1 . 2]" 1
78 1 12 LEU QD 1 24 GLU QG . . 4.450 3.546 3.260 3.876 . 0 0 "[ . 1 . 2]" 1
79 1 12 LEU QD 1 28 TRP H . . 4.220 3.151 2.830 3.611 . 0 0 "[ . 1 . 2]" 1
80 1 12 LEU QD 1 28 TRP HA . . 4.020 2.626 2.203 3.695 . 0 0 "[ . 1 . 2]" 1
81 1 12 LEU QD 1 28 TRP HB2 . . 3.690 1.971 1.772 2.391 . 0 0 "[ . 1 . 2]" 1
82 1 12 LEU QD 1 28 TRP HB3 . . 4.420 3.138 2.977 3.562 . 0 0 "[ . 1 . 2]" 1
83 1 12 LEU QD 1 28 TRP HD1 . . 4.010 2.619 2.198 3.706 . 0 0 "[ . 1 . 2]" 1
84 1 12 LEU MD1 1 24 GLU HA . . 5.160 4.693 3.718 5.139 . 0 0 "[ . 1 . 2]" 1
85 1 12 LEU MD1 1 28 TRP H . . 5.320 3.531 2.987 4.890 . 0 0 "[ . 1 . 2]" 1
86 1 12 LEU MD1 1 28 TRP HB2 . . 4.410 2.262 1.775 4.076 . 0 0 "[ . 1 . 2]" 1
87 1 12 LEU MD1 1 28 TRP HB3 . . 5.500 3.619 3.003 5.408 . 0 0 "[ . 1 . 2]" 1
88 1 12 LEU MD1 1 28 TRP HD1 . . 4.800 2.763 2.214 4.730 . 0 0 "[ . 1 . 2]" 1
89 1 12 LEU MD2 1 24 GLU HA . . 5.160 3.913 3.469 4.611 . 0 0 "[ . 1 . 2]" 1
90 1 12 LEU MD2 1 28 TRP H . . 5.320 3.762 3.156 4.816 . 0 0 "[ . 1 . 2]" 1
91 1 12 LEU MD2 1 28 TRP HB2 . . 4.410 2.683 1.883 4.012 . 0 0 "[ . 1 . 2]" 1
92 1 12 LEU MD2 1 28 TRP HB3 . . 5.500 3.882 3.151 5.290 . 0 0 "[ . 1 . 2]" 1
93 1 12 LEU MD2 1 28 TRP HD1 . . 4.800 4.058 2.570 4.801 0.001 7 0 "[ . 1 . 2]" 1
94 1 12 LEU HG 1 20 TRP HZ2 . . 5.500 4.917 3.942 5.251 . 0 0 "[ . 1 . 2]" 1
95 1 12 LEU HG 1 28 TRP HD1 . . 5.500 4.811 3.264 5.517 0.017 18 0 "[ . 1 . 2]" 1
96 1 13 VAL H 1 13 VAL HB . . 3.710 3.611 3.592 3.625 . 0 0 "[ . 1 . 2]" 1
97 1 13 VAL H 1 13 VAL MG1 . . 3.500 2.264 1.992 2.618 . 0 0 "[ . 1 . 2]" 1
98 1 13 VAL H 1 13 VAL MG2 . . 3.270 2.052 1.880 2.275 . 0 0 "[ . 1 . 2]" 1
99 1 13 VAL HA 1 13 VAL MG1 . . 2.890 2.305 2.123 2.405 . 0 0 "[ . 1 . 2]" 1
100 1 13 VAL HA 1 13 VAL MG2 . . 3.250 3.195 3.173 3.203 . 0 0 "[ . 1 . 2]" 1
101 1 13 VAL HA 1 20 TRP HZ2 . . 4.280 3.492 3.216 3.695 . 0 0 "[ . 1 . 2]" 1
102 1 13 VAL HA 1 84 VAL HA . . 3.420 2.810 2.223 3.422 0.002 9 0 "[ . 1 . 2]" 1
103 1 13 VAL HA 1 84 VAL MG2 . . 5.230 4.613 4.261 4.911 . 0 0 "[ . 1 . 2]" 1
104 1 13 VAL MG1 1 14 HIS H . . 4.760 3.950 3.785 4.207 . 0 0 "[ . 1 . 2]" 1
105 1 13 VAL MG1 1 20 TRP HH2 . . 5.110 4.649 4.409 4.897 . 0 0 "[ . 1 . 2]" 1
106 1 13 VAL MG1 1 20 TRP HZ2 . . 4.520 4.341 4.031 4.521 0.001 20 0 "[ . 1 . 2]" 1
107 1 13 VAL MG1 1 28 TRP HD1 . . 4.830 4.573 4.088 4.822 . 0 0 "[ . 1 . 2]" 1
108 1 13 VAL MG1 1 84 VAL H . . 4.840 4.117 3.590 4.405 . 0 0 "[ . 1 . 2]" 1
109 1 13 VAL MG1 1 84 VAL HA . . 4.610 2.405 1.979 2.959 . 0 0 "[ . 1 . 2]" 1
110 1 13 VAL MG2 1 14 HIS HA . . 4.450 3.289 2.978 3.809 . 0 0 "[ . 1 . 2]" 1
111 1 13 VAL MG2 1 14 HIS QB . . 4.770 3.297 2.908 3.722 . 0 0 "[ . 1 . 2]" 1
112 1 13 VAL MG2 1 14 HIS HD2 . . 5.500 4.146 2.068 5.534 0.034 12 0 "[ . 1 . 2]" 1
113 1 13 VAL MG2 1 20 TRP HZ2 . . 5.500 5.465 5.331 5.504 0.004 20 0 "[ . 1 . 2]" 1
114 1 13 VAL MG2 1 84 VAL HA . . 4.990 4.673 4.245 4.995 0.005 20 0 "[ . 1 . 2]" 1
115 1 15 LYS H 1 15 LYS HB2 . . 4.070 2.783 2.575 3.065 . 0 0 "[ . 1 . 2]" 1
116 1 15 LYS H 1 15 LYS HB3 . . 4.190 2.399 2.315 2.468 . 0 0 "[ . 1 . 2]" 1
117 1 15 LYS H 1 15 LYS HG2 . . 4.790 4.332 4.247 4.401 . 0 0 "[ . 1 . 2]" 1
118 1 15 LYS H 1 15 LYS HG3 . . 5.150 4.621 4.527 4.735 . 0 0 "[ . 1 . 2]" 1
119 1 15 LYS H 1 20 TRP HE1 . . 4.830 4.184 3.798 4.489 . 0 0 "[ . 1 . 2]" 1
120 1 15 LYS HA 1 15 LYS HD2 . . 5.100 4.577 4.494 4.662 . 0 0 "[ . 1 . 2]" 1
121 1 15 LYS HA 1 15 LYS HD3 . . 5.500 4.727 4.636 4.833 . 0 0 "[ . 1 . 2]" 1
122 1 15 LYS HA 1 15 LYS HE3 . . 5.500 5.140 5.013 5.290 . 0 0 "[ . 1 . 2]" 1
123 1 15 LYS HA 1 15 LYS HG2 . . 3.920 2.976 2.898 3.099 . 0 0 "[ . 1 . 2]" 1
124 1 15 LYS HA 1 15 LYS HG3 . . 3.490 2.868 2.743 2.943 . 0 0 "[ . 1 . 2]" 1
125 1 15 LYS HA 1 16 ALA H . . 2.960 2.159 2.140 2.223 . 0 0 "[ . 1 . 2]" 1
126 1 15 LYS HA 1 16 ALA HA . . 4.610 4.359 4.318 4.431 . 0 0 "[ . 1 . 2]" 1
127 1 15 LYS HA 1 16 ALA MB . . 4.110 3.992 3.934 4.027 . 0 0 "[ . 1 . 2]" 1
128 1 15 LYS HA 1 20 TRP HE1 . . 4.950 4.643 4.502 4.953 0.003 20 0 "[ . 1 . 2]" 1
129 1 15 LYS HB2 1 15 LYS HE2 . . 5.170 4.880 4.777 5.077 . 0 0 "[ . 1 . 2]" 1
130 1 15 LYS HB2 1 15 LYS HE3 . . 5.360 4.313 4.006 4.636 . 0 0 "[ . 1 . 2]" 1
131 1 15 LYS HB2 1 15 LYS HG3 . . 2.930 2.314 2.281 2.349 . 0 0 "[ . 1 . 2]" 1
132 1 15 LYS HB2 1 16 ALA H . . 4.350 4.164 3.964 4.353 0.003 18 0 "[ . 1 . 2]" 1
133 1 15 LYS HB2 1 20 TRP HE1 . . 4.850 4.547 4.315 4.700 . 0 0 "[ . 1 . 2]" 1
134 1 15 LYS HB3 1 15 LYS HE2 . . 5.280 4.515 4.318 4.694 . 0 0 "[ . 1 . 2]" 1
135 1 15 LYS HB3 1 15 LYS HE3 . . 5.500 4.427 4.296 4.500 . 0 0 "[ . 1 . 2]" 1
136 1 15 LYS HB3 1 16 ALA H . . 4.490 4.266 4.025 4.459 . 0 0 "[ . 1 . 2]" 1
137 1 15 LYS HB3 1 20 TRP HD1 . . 4.230 4.027 3.801 4.230 . 3 0 "[ . 1 . 2]" 1
138 1 15 LYS HB3 1 20 TRP HE1 . . 3.490 2.952 2.683 3.149 . 0 0 "[ . 1 . 2]" 1
139 1 15 LYS HD2 1 19 LYS HB2 . . 5.380 5.220 4.960 5.382 0.002 12 0 "[ . 1 . 2]" 1
140 1 15 LYS HD2 1 19 LYS HB3 . . 5.290 4.766 4.417 5.103 . 0 0 "[ . 1 . 2]" 1
141 1 15 LYS HD3 1 19 LYS HB2 . . 5.500 4.456 4.030 4.766 . 0 0 "[ . 1 . 2]" 1
142 1 15 LYS HD3 1 19 LYS HB3 . . 5.500 4.351 3.831 4.709 . 0 0 "[ . 1 . 2]" 1
143 1 15 LYS HD3 1 20 TRP H . . 4.980 4.687 4.419 4.924 . 0 0 "[ . 1 . 2]" 1
144 1 15 LYS HD3 1 20 TRP HA . . 4.160 3.337 3.184 3.497 . 0 0 "[ . 1 . 2]" 1
145 1 15 LYS HD3 1 20 TRP HD1 . . 3.600 2.212 2.004 2.396 . 0 0 "[ . 1 . 2]" 1
146 1 15 LYS HD3 1 20 TRP HE1 . . 3.640 3.011 2.635 3.237 . 0 0 "[ . 1 . 2]" 1
147 1 15 LYS HD3 1 21 THR H . . 5.500 5.346 5.099 5.508 0.008 18 0 "[ . 1 . 2]" 1
148 1 15 LYS HE2 1 19 LYS H . . 5.500 4.610 3.841 5.499 . 0 0 "[ . 1 . 2]" 1
149 1 15 LYS HE2 1 19 LYS HB2 . . 5.120 3.624 2.822 4.539 . 0 0 "[ . 1 . 2]" 1
150 1 15 LYS HE2 1 19 LYS HB3 . . 4.520 2.792 2.039 3.663 . 0 0 "[ . 1 . 2]" 1
151 1 15 LYS HE2 1 20 TRP H . . 5.500 4.007 3.357 4.880 . 0 0 "[ . 1 . 2]" 1
152 1 15 LYS HE2 1 20 TRP HA . . 4.230 2.658 2.010 3.203 . 0 0 "[ . 1 . 2]" 1
153 1 15 LYS HE2 1 20 TRP HD1 . . 4.150 2.680 2.119 3.442 . 0 0 "[ . 1 . 2]" 1
154 1 15 LYS HE2 1 21 THR H . . 5.500 4.716 3.874 5.160 . 0 0 "[ . 1 . 2]" 1
155 1 15 LYS HE3 1 15 LYS HG2 . . 4.120 2.789 2.365 3.061 . 0 0 "[ . 1 . 2]" 1
156 1 15 LYS HE3 1 15 LYS HG3 . . 3.640 2.414 2.149 2.782 . 0 0 "[ . 1 . 2]" 1
157 1 15 LYS HE3 1 19 LYS H . . 5.500 4.830 3.711 5.452 . 0 0 "[ . 1 . 2]" 1
158 1 15 LYS HE3 1 19 LYS HA . . 5.500 4.626 4.021 5.012 . 0 0 "[ . 1 . 2]" 1
159 1 15 LYS HE3 1 19 LYS HB2 . . 5.290 3.192 2.629 3.692 . 0 0 "[ . 1 . 2]" 1
160 1 15 LYS HE3 1 19 LYS HB3 . . 4.670 2.241 2.000 2.555 . 0 0 "[ . 1 . 2]" 1
161 1 15 LYS HE3 1 20 TRP H . . 5.500 4.773 3.531 5.423 . 0 0 "[ . 1 . 2]" 1
162 1 15 LYS HE3 1 20 TRP HD1 . . 4.460 3.480 2.215 4.118 . 0 0 "[ . 1 . 2]" 1
163 1 15 LYS HG2 1 16 ALA H . . 4.800 2.882 2.466 3.337 . 0 0 "[ . 1 . 2]" 1
164 1 15 LYS HG2 1 20 TRP HD1 . . 3.780 2.821 2.497 2.982 . 0 0 "[ . 1 . 2]" 1
165 1 15 LYS HG2 1 20 TRP HE1 . . 3.830 3.055 2.698 3.223 . 0 0 "[ . 1 . 2]" 1
166 1 15 LYS HG3 1 16 ALA H . . 4.220 3.461 2.960 4.032 . 0 0 "[ . 1 . 2]" 1
167 1 15 LYS HG3 1 19 LYS HB3 . . 3.940 3.664 3.133 3.949 0.009 9 0 "[ . 1 . 2]" 1
168 1 15 LYS HG3 1 20 TRP HD1 . . 4.360 4.202 3.913 4.342 . 0 0 "[ . 1 . 2]" 1
169 1 15 LYS HG3 1 20 TRP HE1 . . 4.970 4.616 4.346 4.779 . 0 0 "[ . 1 . 2]" 1
170 1 16 ALA H 1 16 ALA MB . . 2.980 2.171 2.042 2.249 . 0 0 "[ . 1 . 2]" 1
171 1 16 ALA H 1 17 VAL H . . 4.820 4.605 4.584 4.643 . 0 0 "[ . 1 . 2]" 1
172 1 16 ALA H 1 20 TRP HE1 . . 4.870 4.571 4.240 4.873 0.003 18 0 "[ . 1 . 2]" 1
173 1 16 ALA HA 1 17 VAL H . . 2.640 2.205 2.176 2.283 . 0 0 "[ . 1 . 2]" 1
174 1 16 ALA HA 1 17 VAL HA . . 4.430 4.336 4.326 4.345 . 0 0 "[ . 1 . 2]" 1
175 1 16 ALA HA 1 17 VAL HB . . 4.820 4.680 4.596 4.751 . 0 0 "[ . 1 . 2]" 1
176 1 16 ALA HA 1 17 VAL MG2 . . 3.810 3.643 3.535 3.775 . 0 0 "[ . 1 . 2]" 1
177 1 16 ALA HA 1 18 ASP H . . 4.280 3.947 3.791 4.093 . 0 0 "[ . 1 . 2]" 1
178 1 16 ALA HA 1 19 LYS H . . 4.810 4.742 4.661 4.813 0.003 10 0 "[ . 1 . 2]" 1
179 1 16 ALA HA 1 20 TRP HE1 . . 4.720 4.284 4.054 4.603 . 0 0 "[ . 1 . 2]" 1
180 1 16 ALA MB 1 17 VAL H . . 3.160 2.902 2.655 3.012 . 0 0 "[ . 1 . 2]" 1
181 1 16 ALA MB 1 17 VAL HB . . 4.890 4.581 4.466 4.691 . 0 0 "[ . 1 . 2]" 1
182 1 16 ALA MB 1 17 VAL MG1 . . 5.430 5.117 5.054 5.193 . 0 0 "[ . 1 . 2]" 1
183 1 16 ALA MB 1 17 VAL MG2 . . 4.630 4.392 4.256 4.519 . 0 0 "[ . 1 . 2]" 1
184 1 16 ALA MB 1 18 ASP H . . 3.280 2.718 2.548 2.920 . 0 0 "[ . 1 . 2]" 1
185 1 16 ALA MB 1 18 ASP HA . . 5.030 4.823 4.739 4.922 . 0 0 "[ . 1 . 2]" 1
186 1 16 ALA MB 1 18 ASP QB . . 3.970 3.583 2.902 3.891 . 0 0 "[ . 1 . 2]" 1
187 1 16 ALA MB 1 19 LYS H . . 3.560 3.109 2.987 3.264 . 0 0 "[ . 1 . 2]" 1
188 1 16 ALA MB 1 19 LYS HB2 . . 4.110 2.635 2.358 2.948 . 0 0 "[ . 1 . 2]" 1
189 1 16 ALA MB 1 19 LYS HB3 . . 4.470 4.120 3.915 4.452 . 0 0 "[ . 1 . 2]" 1
190 1 16 ALA MB 1 19 LYS HE2 . . 4.810 3.709 3.028 4.582 . 0 0 "[ . 1 . 2]" 1
191 1 16 ALA MB 1 19 LYS QE . . 4.100 3.213 2.796 3.776 . 0 0 "[ . 1 . 2]" 1
192 1 16 ALA MB 1 19 LYS HE3 . . 4.810 3.612 3.153 4.407 . 0 0 "[ . 1 . 2]" 1
193 1 16 ALA MB 1 19 LYS QG . . 3.890 3.422 2.991 3.666 . 0 0 "[ . 1 . 2]" 1
194 1 16 ALA MB 1 20 TRP H . . 5.500 4.796 4.644 4.944 . 0 0 "[ . 1 . 2]" 1
195 1 16 ALA MB 1 20 TRP HE1 . . 5.080 4.763 4.600 5.047 . 0 0 "[ . 1 . 2]" 1
196 1 16 ALA MB 1 54 LEU QD . . 4.730 3.979 3.779 4.140 . 0 0 "[ . 1 . 2]" 1
197 1 17 VAL H 1 17 VAL HB . . 3.150 2.489 2.420 2.574 . 0 0 "[ . 1 . 2]" 1
198 1 17 VAL H 1 17 VAL MG1 . . 3.810 3.758 3.744 3.766 . 0 0 "[ . 1 . 2]" 1
199 1 17 VAL H 1 17 VAL MG2 . . 2.760 2.236 1.991 2.422 . 0 0 "[ . 1 . 2]" 1
200 1 17 VAL H 1 18 ASP H . . 3.270 2.573 2.447 2.686 . 0 0 "[ . 1 . 2]" 1
201 1 17 VAL H 1 18 ASP QB . . 5.140 4.550 4.307 5.087 . 0 0 "[ . 1 . 2]" 1
202 1 17 VAL H 1 20 TRP HD1 . . 5.230 5.067 4.891 5.234 0.004 20 0 "[ . 1 . 2]" 1
203 1 17 VAL H 1 20 TRP HE1 . . 4.260 4.144 4.007 4.261 0.001 20 0 "[ . 1 . 2]" 1
204 1 17 VAL H 1 20 TRP HZ2 . . 5.080 4.846 4.652 5.023 . 0 0 "[ . 1 . 2]" 1
205 1 17 VAL H 1 54 LEU MD1 . . 5.010 3.600 3.283 3.814 . 0 0 "[ . 1 . 2]" 1
206 1 17 VAL H 1 54 LEU QD . . 4.260 3.438 3.170 3.602 . 0 0 "[ . 1 . 2]" 1
207 1 17 VAL H 1 54 LEU MD2 . . 5.010 4.379 3.854 4.639 . 0 0 "[ . 1 . 2]" 1
208 1 17 VAL H 1 54 LEU HG . . 5.500 5.332 5.078 5.511 0.011 1 0 "[ . 1 . 2]" 1
209 1 17 VAL H 1 85 ARG HA . . 4.830 3.569 3.014 4.149 . 0 0 "[ . 1 . 2]" 1
210 1 17 VAL H 1 85 ARG HB2 . . 5.420 4.841 4.406 5.328 . 0 0 "[ . 1 . 2]" 1
211 1 17 VAL HA 1 17 VAL MG1 . . 3.000 2.397 2.346 2.496 . 0 0 "[ . 1 . 2]" 1
212 1 17 VAL HA 1 17 VAL MG2 . . 2.900 2.380 2.318 2.440 . 0 0 "[ . 1 . 2]" 1
213 1 17 VAL HA 1 19 LYS H . . 3.840 3.378 3.333 3.405 . 0 0 "[ . 1 . 2]" 1
214 1 17 VAL HA 1 20 TRP H . . 3.660 3.296 3.179 3.422 . 0 0 "[ . 1 . 2]" 1
215 1 17 VAL HA 1 20 TRP HB2 . . 4.890 3.571 3.335 3.769 . 0 0 "[ . 1 . 2]" 1
216 1 17 VAL HA 1 20 TRP HB3 . . 4.930 4.517 4.313 4.692 . 0 0 "[ . 1 . 2]" 1
217 1 17 VAL HA 1 20 TRP HD1 . . 3.980 3.091 2.956 3.177 . 0 0 "[ . 1 . 2]" 1
218 1 17 VAL HA 1 20 TRP HE1 . . 3.320 2.848 2.729 2.924 . 0 0 "[ . 1 . 2]" 1
219 1 17 VAL HA 1 20 TRP HZ2 . . 4.580 3.803 3.695 3.956 . 0 0 "[ . 1 . 2]" 1
220 1 17 VAL HA 1 50 GLY HA2 . . 5.500 5.044 4.697 5.175 . 0 0 "[ . 1 . 2]" 1
221 1 17 VAL HA 1 50 GLY HA3 . . 4.940 4.354 4.275 4.438 . 0 0 "[ . 1 . 2]" 1
222 1 17 VAL HB 1 18 ASP H . . 3.590 2.856 2.765 3.049 . 0 0 "[ . 1 . 2]" 1
223 1 17 VAL HB 1 18 ASP HA . . 4.590 4.331 4.229 4.456 . 0 0 "[ . 1 . 2]" 1
224 1 17 VAL HB 1 20 TRP H . . 5.500 5.340 5.191 5.504 0.004 1 0 "[ . 1 . 2]" 1
225 1 17 VAL HB 1 20 TRP HE1 . . 5.500 5.472 5.301 5.514 0.014 18 0 "[ . 1 . 2]" 1
226 1 17 VAL HB 1 50 GLY HA3 . . 5.500 5.333 5.042 5.505 0.005 1 0 "[ . 1 . 2]" 1
227 1 17 VAL HB 1 54 LEU MD1 . . 3.370 2.315 1.987 2.671 . 0 0 "[ . 1 . 2]" 1
228 1 17 VAL HB 1 54 LEU MD2 . . 3.370 2.602 2.232 2.856 . 0 0 "[ . 1 . 2]" 1
229 1 17 VAL HB 1 54 LEU HG . . 4.660 3.025 2.660 3.324 . 0 0 "[ . 1 . 2]" 1
230 1 17 VAL HB 1 85 ARG HA . . 4.600 3.927 3.267 4.115 . 0 0 "[ . 1 . 2]" 1
231 1 17 VAL MG1 1 18 ASP H . . 3.640 3.612 3.498 3.654 0.014 6 0 "[ . 1 . 2]" 1
232 1 17 VAL MG1 1 18 ASP HA . . 4.070 3.598 3.359 3.689 . 0 0 "[ . 1 . 2]" 1
233 1 17 VAL MG1 1 18 ASP QB . . 4.670 4.409 4.196 4.706 0.036 1 0 "[ . 1 . 2]" 1
234 1 17 VAL MG1 1 19 LYS H . . 4.660 4.224 4.185 4.326 . 0 0 "[ . 1 . 2]" 1
235 1 17 VAL MG1 1 20 TRP H . . 4.420 3.783 3.662 4.047 . 0 0 "[ . 1 . 2]" 1
236 1 17 VAL MG1 1 20 TRP HB2 . . 4.270 3.062 2.787 3.371 . 0 0 "[ . 1 . 2]" 1
237 1 17 VAL MG1 1 20 TRP HD1 . . 5.150 4.603 4.430 4.754 . 0 0 "[ . 1 . 2]" 1
238 1 17 VAL MG1 1 20 TRP HE1 . . 4.880 4.631 4.528 4.708 . 0 0 "[ . 1 . 2]" 1
239 1 17 VAL MG1 1 20 TRP HE3 . . 4.080 3.011 2.823 3.243 . 0 0 "[ . 1 . 2]" 1
240 1 17 VAL MG1 1 20 TRP HH2 . . 4.930 4.015 3.766 4.185 . 0 0 "[ . 1 . 2]" 1
241 1 17 VAL MG1 1 20 TRP HZ2 . . 4.690 4.360 4.227 4.525 . 0 0 "[ . 1 . 2]" 1
242 1 17 VAL MG1 1 20 TRP HZ3 . . 4.640 3.398 3.163 3.597 . 0 0 "[ . 1 . 2]" 1
243 1 17 VAL MG1 1 25 VAL HA . . 5.040 4.517 4.310 4.714 . 0 0 "[ . 1 . 2]" 1
244 1 17 VAL MG1 1 25 VAL MG2 . . 4.700 3.740 3.526 3.986 . 0 0 "[ . 1 . 2]" 1
245 1 17 VAL MG1 1 50 GLY H . . 5.000 4.752 4.526 4.974 . 0 0 "[ . 1 . 2]" 1
246 1 17 VAL MG1 1 50 GLY HA2 . . 3.750 2.833 2.655 3.027 . 0 0 "[ . 1 . 2]" 1
247 1 17 VAL MG1 1 50 GLY HA3 . . 3.910 2.951 2.678 3.175 . 0 0 "[ . 1 . 2]" 1
248 1 17 VAL MG1 1 51 ARG H . . 5.200 4.640 4.284 4.812 . 0 0 "[ . 1 . 2]" 1
249 1 17 VAL MG1 1 51 ARG HA . . 5.230 4.604 4.171 4.814 . 0 0 "[ . 1 . 2]" 1
250 1 17 VAL MG1 1 53 LEU H . . 5.500 4.701 4.360 4.877 . 0 0 "[ . 1 . 2]" 1
251 1 17 VAL MG1 1 53 LEU HB2 . . 4.350 4.189 3.943 4.353 0.003 1 0 "[ . 1 . 2]" 1
252 1 17 VAL MG1 1 53 LEU HB3 . . 4.150 3.007 2.701 3.142 . 0 0 "[ . 1 . 2]" 1
253 1 17 VAL MG1 1 53 LEU QD . . 3.600 2.629 2.210 3.066 . 0 0 "[ . 1 . 2]" 1
254 1 17 VAL MG1 1 53 LEU HG . . 5.320 4.431 3.709 5.321 0.001 12 0 "[ . 1 . 2]" 1
255 1 17 VAL MG1 1 54 LEU H . . 4.370 3.684 3.407 4.150 . 0 0 "[ . 1 . 2]" 1
256 1 17 VAL MG1 1 54 LEU HA . . 4.830 4.039 3.780 4.193 . 0 0 "[ . 1 . 2]" 1
257 1 17 VAL MG1 1 54 LEU HB2 . . 4.620 4.167 3.998 4.399 . 0 0 "[ . 1 . 2]" 1
258 1 17 VAL MG1 1 54 LEU HB3 . . 5.470 4.695 4.435 4.975 . 0 0 "[ . 1 . 2]" 1
259 1 17 VAL MG1 1 54 LEU MD1 . . 3.240 2.806 2.456 3.184 . 0 0 "[ . 1 . 2]" 1
260 1 17 VAL MG1 1 54 LEU QD . . 2.720 2.357 1.850 2.728 0.008 19 0 "[ . 1 . 2]" 1
261 1 17 VAL MG1 1 54 LEU MD2 . . 3.240 2.572 1.906 2.985 . 0 0 "[ . 1 . 2]" 1
262 1 17 VAL MG1 1 54 LEU HG . . 3.220 2.025 1.951 2.381 . 0 0 "[ . 1 . 2]" 1
263 1 17 VAL MG1 1 81 LEU HA . . 4.780 4.616 4.337 4.744 . 0 0 "[ . 1 . 2]" 1
264 1 17 VAL MG1 1 81 LEU MD1 . . 4.590 3.129 2.220 4.317 . 0 0 "[ . 1 . 2]" 1
265 1 17 VAL MG1 1 81 LEU QD . . 3.360 2.362 2.195 2.508 . 0 0 "[ . 1 . 2]" 1
266 1 17 VAL MG1 1 81 LEU MD2 . . 4.590 3.120 2.311 3.867 . 0 0 "[ . 1 . 2]" 1
267 1 17 VAL MG1 1 84 VAL MG1 . . 4.780 4.734 4.587 4.800 0.020 9 0 "[ . 1 . 2]" 1
268 1 17 VAL MG1 1 84 VAL MG2 . . 3.930 3.195 2.911 3.403 . 0 0 "[ . 1 . 2]" 1
269 1 17 VAL MG1 1 85 ARG HA . . 5.130 5.003 4.493 5.134 0.004 4 0 "[ . 1 . 2]" 1
270 1 17 VAL MG1 1 85 ARG HB3 . . 4.740 4.468 3.949 4.748 0.008 3 0 "[ . 1 . 2]" 1
271 1 17 VAL MG2 1 18 ASP H . . 4.020 3.949 3.864 4.048 0.028 1 0 "[ . 1 . 2]" 1
272 1 17 VAL MG2 1 18 ASP HA . . 5.500 5.420 5.395 5.452 . 0 0 "[ . 1 . 2]" 1
273 1 17 VAL MG2 1 20 TRP H . . 5.500 5.107 5.026 5.193 . 0 0 "[ . 1 . 2]" 1
274 1 17 VAL MG2 1 20 TRP HB2 . . 5.400 4.891 4.690 5.023 . 0 0 "[ . 1 . 2]" 1
275 1 17 VAL MG2 1 20 TRP HD1 . . 4.780 4.728 4.553 4.789 0.009 4 0 "[ . 1 . 2]" 1
276 1 17 VAL MG2 1 20 TRP HE1 . . 3.990 3.434 3.184 3.607 . 0 0 "[ . 1 . 2]" 1
277 1 17 VAL MG2 1 20 TRP HE3 . . 4.350 4.079 3.765 4.282 . 0 0 "[ . 1 . 2]" 1
278 1 17 VAL MG2 1 20 TRP HH2 . . 3.960 2.882 2.651 3.071 . 0 0 "[ . 1 . 2]" 1
279 1 17 VAL MG2 1 20 TRP HZ2 . . 3.570 2.646 2.464 2.785 . 0 0 "[ . 1 . 2]" 1
280 1 17 VAL MG2 1 20 TRP HZ3 . . 4.350 3.543 3.264 3.723 . 0 0 "[ . 1 . 2]" 1
281 1 17 VAL MG2 1 28 TRP HB3 . . 5.500 5.466 5.261 5.508 0.008 3 0 "[ . 1 . 2]" 1
282 1 17 VAL MG2 1 50 GLY HA2 . . 5.390 5.332 5.148 5.395 0.005 10 0 "[ . 1 . 2]" 1
283 1 17 VAL MG2 1 50 GLY HA3 . . 5.500 5.361 5.149 5.528 0.028 19 0 "[ . 1 . 2]" 1
284 1 17 VAL MG2 1 53 LEU HB3 . . 5.500 5.354 4.983 5.504 0.004 17 0 "[ . 1 . 2]" 1
285 1 17 VAL MG2 1 54 LEU MD1 . . 4.040 3.729 3.317 4.049 0.009 3 0 "[ . 1 . 2]" 1
286 1 17 VAL MG2 1 54 LEU QD . . 3.140 2.974 2.618 3.144 0.004 11 0 "[ . 1 . 2]" 1
287 1 17 VAL MG2 1 54 LEU MD2 . . 4.040 3.132 2.693 3.353 . 0 0 "[ . 1 . 2]" 1
288 1 17 VAL MG2 1 54 LEU HG . . 4.700 4.172 3.786 4.520 . 0 0 "[ . 1 . 2]" 1
289 1 17 VAL MG2 1 81 LEU HA . . 5.000 3.958 3.731 4.259 . 0 0 "[ . 1 . 2]" 1
290 1 17 VAL MG2 1 81 LEU HB3 . . 5.500 5.391 5.058 5.507 0.007 18 0 "[ . 1 . 2]" 1
291 1 17 VAL MG2 1 81 LEU QD . . 3.460 2.936 2.598 3.033 . 0 0 "[ . 1 . 2]" 1
292 1 17 VAL MG2 1 81 LEU HG . . 5.260 4.090 3.397 5.020 . 0 0 "[ . 1 . 2]" 1
293 1 17 VAL MG2 1 84 VAL HA . . 5.080 4.158 3.869 4.356 . 0 0 "[ . 1 . 2]" 1
294 1 17 VAL MG2 1 84 VAL HB . . 3.700 2.396 2.253 2.550 . 0 0 "[ . 1 . 2]" 1
295 1 17 VAL MG2 1 84 VAL MG1 . . 3.450 3.389 3.234 3.453 0.003 19 0 "[ . 1 . 2]" 1
296 1 17 VAL MG2 1 84 VAL MG2 . . 3.210 1.843 1.661 1.933 . 0 0 "[ . 1 . 2]" 1
297 1 17 VAL MG2 1 85 ARG H . . 4.380 3.303 3.007 3.707 . 0 0 "[ . 1 . 2]" 1
298 1 17 VAL MG2 1 85 ARG HA . . 3.680 2.866 2.567 3.254 . 0 0 "[ . 1 . 2]" 1
299 1 17 VAL MG2 1 85 ARG HB2 . . 4.240 3.874 3.300 4.247 0.007 4 0 "[ . 1 . 2]" 1
300 1 17 VAL MG2 1 85 ARG HB3 . . 4.510 3.065 2.620 3.612 . 0 0 "[ . 1 . 2]" 1
301 1 17 VAL MG2 1 85 ARG QD . . 5.340 4.862 4.409 5.351 0.011 19 0 "[ . 1 . 2]" 1
302 1 17 VAL MG2 1 85 ARG HG2 . . 5.500 4.903 4.565 5.447 . 0 0 "[ . 1 . 2]" 1
303 1 18 ASP H 1 18 ASP HB2 . . 3.730 3.458 2.868 3.583 . 0 0 "[ . 1 . 2]" 1
304 1 18 ASP H 1 18 ASP QB . . 3.150 2.339 2.119 2.788 . 0 0 "[ . 1 . 2]" 1
305 1 18 ASP H 1 18 ASP HB3 . . 3.730 2.420 2.165 3.572 . 0 0 "[ . 1 . 2]" 1
306 1 18 ASP H 1 19 LYS H . . 3.070 2.654 2.576 2.673 . 0 0 "[ . 1 . 2]" 1
307 1 18 ASP H 1 19 LYS HB2 . . 4.850 4.436 4.319 4.517 . 0 0 "[ . 1 . 2]" 1
308 1 18 ASP H 1 19 LYS QD . . 4.480 3.725 3.506 3.928 . 0 0 "[ . 1 . 2]" 1
309 1 18 ASP H 1 20 TRP H . . 4.460 4.162 4.118 4.214 . 0 0 "[ . 1 . 2]" 1
310 1 18 ASP H 1 54 LEU MD1 . . 4.510 2.330 2.060 2.579 . 0 0 "[ . 1 . 2]" 1
311 1 18 ASP H 1 54 LEU QD . . 3.510 2.319 2.054 2.563 . 0 0 "[ . 1 . 2]" 1
312 1 18 ASP H 1 54 LEU MD2 . . 4.510 4.244 4.011 4.462 . 0 0 "[ . 1 . 2]" 1
313 1 18 ASP HA 1 19 LYS HA . . 5.020 4.533 4.521 4.557 . 0 0 "[ . 1 . 2]" 1
314 1 18 ASP HA 1 20 TRP H . . 4.000 3.812 3.739 3.852 . 0 0 "[ . 1 . 2]" 1
315 1 18 ASP HA 1 50 GLY HA2 . . 4.680 4.540 4.383 4.685 0.005 18 0 "[ . 1 . 2]" 1
316 1 18 ASP HA 1 50 GLY HA3 . . 4.030 3.497 3.387 3.604 . 0 0 "[ . 1 . 2]" 1
317 1 18 ASP HA 1 51 ARG H . . 3.460 3.044 2.679 3.199 . 0 0 "[ . 1 . 2]" 1
318 1 18 ASP HA 1 51 ARG HA . . 3.350 2.251 2.083 2.448 . 0 0 "[ . 1 . 2]" 1
319 1 18 ASP HA 1 51 ARG HB2 . . 4.200 3.627 3.010 3.822 . 0 0 "[ . 1 . 2]" 1
320 1 18 ASP HA 1 51 ARG QG . . 4.310 3.557 3.297 4.172 . 0 0 "[ . 1 . 2]" 1
321 1 18 ASP HA 1 54 LEU HB2 . . 4.970 4.112 3.836 4.559 . 0 0 "[ . 1 . 2]" 1
322 1 18 ASP HA 1 54 LEU QD . . 3.230 2.367 2.017 2.834 . 0 0 "[ . 1 . 2]" 1
323 1 18 ASP HA 1 54 LEU HG . . 4.400 3.790 3.442 4.406 0.006 17 0 "[ . 1 . 2]" 1
324 1 18 ASP QB 1 19 LYS H . . 3.900 3.759 3.422 3.848 . 0 0 "[ . 1 . 2]" 1
325 1 18 ASP QB 1 19 LYS HA . . 5.130 4.680 4.174 4.794 . 0 0 "[ . 1 . 2]" 1
326 1 18 ASP QB 1 20 TRP H . . 5.340 4.988 4.856 5.039 . 0 0 "[ . 1 . 2]" 1
327 1 18 ASP QB 1 51 ARG H . . 4.510 4.417 4.299 4.513 0.003 14 0 "[ . 1 . 2]" 1
328 1 18 ASP QB 1 51 ARG HA . . 3.680 2.780 2.564 3.078 . 0 0 "[ . 1 . 2]" 1
329 1 18 ASP QB 1 51 ARG HB2 . . 4.330 3.946 3.737 4.103 . 0 0 "[ . 1 . 2]" 1
330 1 18 ASP QB 1 51 ARG HB3 . . 5.000 4.930 4.720 5.019 0.019 17 0 "[ . 1 . 2]" 1
331 1 18 ASP QB 1 51 ARG QD . . 4.360 3.861 1.883 4.379 0.019 18 0 "[ . 1 . 2]" 1
332 1 18 ASP QB 1 51 ARG QG . . 3.760 2.622 2.210 3.617 . 0 0 "[ . 1 . 2]" 1
333 1 18 ASP QB 1 54 LEU HB2 . . 5.340 3.963 3.786 4.540 . 0 0 "[ . 1 . 2]" 1
334 1 18 ASP QB 1 54 LEU QD . . 2.980 1.952 1.769 2.684 . 0 0 "[ . 1 . 2]" 1
335 1 18 ASP QB 1 54 LEU HG . . 4.770 4.151 3.864 4.788 0.018 1 0 "[ . 1 . 2]" 1
336 1 18 ASP HB2 1 19 LYS H . . 4.540 4.366 3.621 4.526 . 0 0 "[ . 1 . 2]" 1
337 1 18 ASP HB2 1 51 ARG HA . . 4.240 2.985 2.606 4.242 0.002 1 0 "[ . 1 . 2]" 1
338 1 18 ASP HB3 1 19 LYS H . . 4.540 4.155 3.552 4.489 . 0 0 "[ . 1 . 2]" 1
339 1 18 ASP HB3 1 51 ARG HA . . 4.240 3.781 2.725 4.272 0.032 18 0 "[ . 1 . 2]" 1
340 1 19 LYS H 1 19 LYS HB2 . . 3.380 2.373 2.319 2.401 . 0 0 "[ . 1 . 2]" 1
341 1 19 LYS H 1 19 LYS HB3 . . 3.640 3.551 3.510 3.583 . 0 0 "[ . 1 . 2]" 1
342 1 19 LYS H 1 19 LYS HD2 . . 3.560 3.395 3.113 3.594 0.034 18 0 "[ . 1 . 2]" 1
343 1 19 LYS H 1 19 LYS QD . . 3.090 2.893 2.788 2.996 . 0 0 "[ . 1 . 2]" 1
344 1 19 LYS H 1 19 LYS HD3 . . 3.560 3.154 2.957 3.414 . 0 0 "[ . 1 . 2]" 1
345 1 19 LYS H 1 19 LYS QG . . 4.200 3.914 3.870 3.934 . 0 0 "[ . 1 . 2]" 1
346 1 19 LYS H 1 20 TRP H . . 2.740 2.062 2.014 2.156 . 0 0 "[ . 1 . 2]" 1
347 1 19 LYS H 1 20 TRP HA . . 4.570 4.498 4.460 4.577 0.007 18 0 "[ . 1 . 2]" 1
348 1 19 LYS H 1 20 TRP HB2 . . 4.540 4.285 4.254 4.360 . 0 0 "[ . 1 . 2]" 1
349 1 19 LYS H 1 20 TRP HB3 . . 5.500 5.519 5.486 5.573 0.073 18 0 "[ . 1 . 2]" 1
350 1 19 LYS H 1 20 TRP HD1 . . 3.940 3.347 3.208 3.529 . 0 0 "[ . 1 . 2]" 1
351 1 19 LYS H 1 50 GLY HA3 . . 4.860 4.287 4.142 4.457 . 0 0 "[ . 1 . 2]" 1
352 1 19 LYS H 1 54 LEU QD . . 4.830 4.212 4.022 4.457 . 0 0 "[ . 1 . 2]" 1
353 1 19 LYS HA 1 19 LYS HB2 . . 3.010 2.974 2.965 2.984 . 0 0 "[ . 1 . 2]" 1
354 1 19 LYS HA 1 19 LYS HD2 . . 3.830 2.724 2.292 2.945 . 0 0 "[ . 1 . 2]" 1
355 1 19 LYS HA 1 19 LYS QD . . 3.150 2.647 2.261 2.841 . 0 0 "[ . 1 . 2]" 1
356 1 19 LYS HA 1 19 LYS HD3 . . 3.830 3.624 3.373 3.789 . 0 0 "[ . 1 . 2]" 1
357 1 19 LYS HA 1 19 LYS HE2 . . 5.500 4.892 4.068 5.303 . 0 0 "[ . 1 . 2]" 1
358 1 19 LYS HA 1 19 LYS HE3 . . 5.500 4.947 4.527 5.154 . 0 0 "[ . 1 . 2]" 1
359 1 19 LYS HA 1 19 LYS HG2 . . 3.710 3.584 3.540 3.638 . 0 0 "[ . 1 . 2]" 1
360 1 19 LYS HA 1 19 LYS QG . . 3.170 2.294 2.209 2.451 . 0 0 "[ . 1 . 2]" 1
361 1 19 LYS HA 1 19 LYS HG3 . . 3.710 2.322 2.232 2.492 . 0 0 "[ . 1 . 2]" 1
362 1 19 LYS HA 1 20 TRP HD1 . . 5.020 4.871 4.686 5.024 0.004 20 0 "[ . 1 . 2]" 1
363 1 19 LYS HA 1 51 ARG H . . 5.120 4.802 4.519 5.135 0.015 18 0 "[ . 1 . 2]" 1
364 1 19 LYS HB2 1 19 LYS HD2 . . 3.590 3.154 2.973 3.286 . 0 0 "[ . 1 . 2]" 1
365 1 19 LYS HB2 1 19 LYS HD3 . . 3.590 2.314 2.197 2.542 . 0 0 "[ . 1 . 2]" 1
366 1 19 LYS HB2 1 19 LYS HE2 . . 5.220 4.502 3.971 4.666 . 0 0 "[ . 1 . 2]" 1
367 1 19 LYS HB2 1 19 LYS QE . . 4.490 3.885 3.642 4.222 . 0 0 "[ . 1 . 2]" 1
368 1 19 LYS HB2 1 19 LYS HE3 . . 5.220 4.295 3.878 4.840 . 0 0 "[ . 1 . 2]" 1
369 1 19 LYS HB2 1 20 TRP H . . 4.300 3.617 3.553 3.768 . 0 0 "[ . 1 . 2]" 1
370 1 19 LYS HB2 1 20 TRP HD1 . . 4.860 3.592 3.425 3.765 . 0 0 "[ . 1 . 2]" 1
371 1 19 LYS HB3 1 19 LYS HD2 . . 4.200 3.847 3.708 3.915 . 0 0 "[ . 1 . 2]" 1
372 1 19 LYS HB3 1 19 LYS QD . . 3.660 3.291 3.268 3.306 . 0 0 "[ . 1 . 2]" 1
373 1 19 LYS HB3 1 19 LYS HD3 . . 4.200 3.579 3.504 3.713 . 0 0 "[ . 1 . 2]" 1
374 1 19 LYS HB3 1 20 TRP H . . 4.350 4.007 3.945 4.140 . 0 0 "[ . 1 . 2]" 1
375 1 19 LYS HB3 1 20 TRP HA . . 4.730 4.385 4.324 4.451 . 0 0 "[ . 1 . 2]" 1
376 1 19 LYS HB3 1 20 TRP HD1 . . 4.680 3.936 3.693 4.052 . 0 0 "[ . 1 . 2]" 1
377 1 19 LYS QD 1 19 LYS QG . . 2.330 2.083 2.073 2.092 . 0 0 "[ . 1 . 2]" 1
378 1 19 LYS HD2 1 20 TRP H . . 5.500 4.956 4.673 5.147 . 0 0 "[ . 1 . 2]" 1
379 1 19 LYS HD3 1 20 TRP H . . 5.500 5.031 4.836 5.285 . 0 0 "[ . 1 . 2]" 1
380 1 19 LYS QE 1 19 LYS QG . . 3.230 2.231 2.114 2.374 . 0 0 "[ . 1 . 2]" 1
381 1 20 TRP H 1 20 TRP HB2 . . 2.990 2.425 2.385 2.458 . 0 0 "[ . 1 . 2]" 1
382 1 20 TRP H 1 20 TRP HB3 . . 3.730 3.586 3.580 3.597 . 0 0 "[ . 1 . 2]" 1
383 1 20 TRP H 1 20 TRP HD1 . . 3.250 2.622 2.503 2.744 . 0 0 "[ . 1 . 2]" 1
384 1 20 TRP H 1 20 TRP HE1 . . 4.960 4.689 4.596 4.813 . 0 0 "[ . 1 . 2]" 1
385 1 20 TRP H 1 20 TRP HE3 . . 5.360 5.139 5.049 5.203 . 0 0 "[ . 1 . 2]" 1
386 1 20 TRP H 1 21 THR H . . 4.620 4.615 4.584 4.633 0.013 10 0 "[ . 1 . 2]" 1
387 1 20 TRP H 1 21 THR MG . . 5.500 5.227 5.095 5.330 . 0 0 "[ . 1 . 2]" 1
388 1 20 TRP H 1 24 GLU HB2 . . 5.500 5.471 5.368 5.519 0.019 10 0 "[ . 1 . 2]" 1
389 1 20 TRP H 1 25 VAL MG2 . . 4.680 4.550 4.367 4.668 . 0 0 "[ . 1 . 2]" 1
390 1 20 TRP H 1 50 GLY H . . 4.350 4.306 4.218 4.358 0.008 15 0 "[ . 1 . 2]" 1
391 1 20 TRP H 1 50 GLY HA2 . . 4.770 4.484 4.073 4.734 . 0 0 "[ . 1 . 2]" 1
392 1 20 TRP H 1 50 GLY HA3 . . 3.470 2.888 2.624 3.052 . 0 0 "[ . 1 . 2]" 1
393 1 20 TRP HA 1 20 TRP HD1 . . 3.120 2.367 2.285 2.444 . 0 0 "[ . 1 . 2]" 1
394 1 20 TRP HA 1 20 TRP HE1 . . 4.730 4.720 4.680 4.773 0.043 18 0 "[ . 1 . 2]" 1
395 1 20 TRP HA 1 20 TRP HE3 . . 5.220 5.086 5.062 5.129 . 0 0 "[ . 1 . 2]" 1
396 1 20 TRP HA 1 21 THR H . . 2.750 2.442 2.377 2.526 . 0 0 "[ . 1 . 2]" 1
397 1 20 TRP HA 1 21 THR MG . . 3.730 3.647 3.549 3.740 0.010 15 0 "[ . 1 . 2]" 1
398 1 20 TRP HA 1 24 GLU H . . 5.380 5.265 5.143 5.395 0.015 15 0 "[ . 1 . 2]" 1
399 1 20 TRP HA 1 24 GLU HB2 . . 3.880 3.269 3.147 3.364 . 0 0 "[ . 1 . 2]" 1
400 1 20 TRP HA 1 24 GLU HB3 . . 4.320 4.114 3.987 4.249 . 0 0 "[ . 1 . 2]" 1
401 1 20 TRP HA 1 25 VAL MG2 . . 4.850 4.418 4.227 4.595 . 0 0 "[ . 1 . 2]" 1
402 1 20 TRP HB2 1 20 TRP HE3 . . 3.770 3.031 2.961 3.073 . 0 0 "[ . 1 . 2]" 1
403 1 20 TRP HB2 1 21 THR H . . 4.240 3.603 3.427 3.755 . 0 0 "[ . 1 . 2]" 1
404 1 20 TRP HB2 1 24 GLU HB2 . . 4.270 3.997 3.832 4.085 . 0 0 "[ . 1 . 2]" 1
405 1 20 TRP HB2 1 24 GLU HB3 . . 4.950 4.741 4.449 4.904 . 0 0 "[ . 1 . 2]" 1
406 1 20 TRP HB2 1 25 VAL H . . 4.600 4.405 4.249 4.525 . 0 0 "[ . 1 . 2]" 1
407 1 20 TRP HB2 1 25 VAL HA . . 4.780 4.256 4.114 4.347 . 0 0 "[ . 1 . 2]" 1
408 1 20 TRP HB2 1 25 VAL MG2 . . 3.340 2.566 2.454 2.666 . 0 0 "[ . 1 . 2]" 1
409 1 20 TRP HB2 1 50 GLY H . . 3.570 3.047 2.916 3.178 . 0 0 "[ . 1 . 2]" 1
410 1 20 TRP HB2 1 50 GLY HA2 . . 3.730 2.908 2.479 3.202 . 0 0 "[ . 1 . 2]" 1
411 1 20 TRP HB2 1 50 GLY HA3 . . 3.630 2.051 1.988 2.210 . 0 0 "[ . 1 . 2]" 1
412 1 20 TRP HB2 1 51 ARG H . . 4.580 4.426 4.296 4.563 . 0 0 "[ . 1 . 2]" 1
413 1 20 TRP HB3 1 20 TRP HE3 . . 3.830 2.863 2.823 2.931 . 0 0 "[ . 1 . 2]" 1
414 1 20 TRP HB3 1 21 THR H . . 3.680 2.348 2.172 2.493 . 0 0 "[ . 1 . 2]" 1
415 1 20 TRP HB3 1 21 THR MG . . 4.880 4.820 4.699 4.895 0.015 19 0 "[ . 1 . 2]" 1
416 1 20 TRP HB3 1 24 GLU H . . 4.640 4.404 4.272 4.551 . 0 0 "[ . 1 . 2]" 1
417 1 20 TRP HB3 1 24 GLU HB2 . . 3.790 2.249 2.079 2.344 . 0 0 "[ . 1 . 2]" 1
418 1 20 TRP HB3 1 24 GLU HB3 . . 3.880 3.095 2.805 3.247 . 0 0 "[ . 1 . 2]" 1
419 1 20 TRP HB3 1 25 VAL H . . 3.840 3.143 3.021 3.263 . 0 0 "[ . 1 . 2]" 1
420 1 20 TRP HB3 1 25 VAL HA . . 4.800 3.674 3.516 3.875 . 0 0 "[ . 1 . 2]" 1
421 1 20 TRP HB3 1 25 VAL MG2 . . 3.370 2.420 2.208 2.607 . 0 0 "[ . 1 . 2]" 1
422 1 20 TRP HB3 1 50 GLY H . . 4.340 3.814 3.648 4.008 . 0 0 "[ . 1 . 2]" 1
423 1 20 TRP HB3 1 50 GLY HA3 . . 4.340 3.681 3.540 3.841 . 0 0 "[ . 1 . 2]" 1
424 1 20 TRP HD1 1 21 THR H . . 4.780 4.653 4.531 4.736 . 0 0 "[ . 1 . 2]" 1
425 1 20 TRP HD1 1 24 GLU HB3 . . 5.100 4.901 4.638 5.063 . 0 0 "[ . 1 . 2]" 1
426 1 20 TRP HE3 1 25 VAL H . . 4.150 3.970 3.749 4.146 . 0 0 "[ . 1 . 2]" 1
427 1 20 TRP HE3 1 25 VAL HA . . 3.200 2.193 2.044 2.322 . 0 0 "[ . 1 . 2]" 1
428 1 20 TRP HE3 1 25 VAL HB . . 5.130 4.878 4.742 4.986 . 0 0 "[ . 1 . 2]" 1
429 1 20 TRP HE3 1 25 VAL MG1 . . 3.980 3.785 3.559 3.954 . 0 0 "[ . 1 . 2]" 1
430 1 20 TRP HE3 1 25 VAL MG2 . . 2.800 2.719 2.551 2.819 0.019 18 0 "[ . 1 . 2]" 1
431 1 20 TRP HE3 1 28 TRP HB3 . . 4.910 3.551 3.421 3.672 . 0 0 "[ . 1 . 2]" 1
432 1 20 TRP HE3 1 28 TRP HE3 . . 4.940 4.412 4.173 4.716 . 0 0 "[ . 1 . 2]" 1
433 1 20 TRP HE3 1 50 GLY H . . 5.310 5.110 4.868 5.315 0.005 17 0 "[ . 1 . 2]" 1
434 1 20 TRP HE3 1 50 GLY HA2 . . 4.780 3.868 3.676 4.143 . 0 0 "[ . 1 . 2]" 1
435 1 20 TRP HE3 1 50 GLY HA3 . . 4.800 4.336 4.084 4.639 . 0 0 "[ . 1 . 2]" 1
436 1 20 TRP HE3 1 53 LEU QD . . 3.860 3.250 2.876 3.652 . 0 0 "[ . 1 . 2]" 1
437 1 20 TRP HE3 1 81 LEU QD . . 5.260 4.699 4.540 4.924 . 0 0 "[ . 1 . 2]" 1
438 1 20 TRP HH2 1 28 TRP HB2 . . 4.720 3.075 2.859 3.315 . 0 0 "[ . 1 . 2]" 1
439 1 20 TRP HH2 1 28 TRP HB3 . . 5.170 3.879 3.582 4.072 . 0 0 "[ . 1 . 2]" 1
440 1 20 TRP HH2 1 28 TRP HD1 . . 4.000 2.895 2.688 3.105 . 0 0 "[ . 1 . 2]" 1
441 1 20 TRP HH2 1 28 TRP HE1 . . 4.140 3.776 3.555 3.972 . 0 0 "[ . 1 . 2]" 1
442 1 20 TRP HH2 1 81 LEU QD . . 5.440 4.369 4.156 4.668 . 0 0 "[ . 1 . 2]" 1
443 1 20 TRP HH2 1 84 VAL MG1 . . 3.700 2.309 1.973 2.796 . 0 0 "[ . 1 . 2]" 1
444 1 20 TRP HH2 1 84 VAL MG2 . . 3.630 2.994 2.587 3.429 . 0 0 "[ . 1 . 2]" 1
445 1 20 TRP HZ2 1 84 VAL HB . . 4.710 2.876 2.447 3.467 . 0 0 "[ . 1 . 2]" 1
446 1 20 TRP HZ2 1 84 VAL MG2 . . 4.310 3.965 3.511 4.318 0.008 9 0 "[ . 1 . 2]" 1
447 1 20 TRP HZ3 1 25 VAL HA . . 3.930 3.524 3.416 3.669 . 0 0 "[ . 1 . 2]" 1
448 1 20 TRP HZ3 1 25 VAL MG1 . . 4.660 4.594 4.388 4.663 0.003 9 0 "[ . 1 . 2]" 1
449 1 20 TRP HZ3 1 25 VAL MG2 . . 4.810 4.677 4.503 4.775 . 0 0 "[ . 1 . 2]" 1
450 1 20 TRP HZ3 1 28 TRP H . . 4.870 4.338 4.096 4.699 . 0 0 "[ . 1 . 2]" 1
451 1 20 TRP HZ3 1 28 TRP HB2 . . 4.250 2.686 2.374 3.006 . 0 0 "[ . 1 . 2]" 1
452 1 20 TRP HZ3 1 28 TRP HB3 . . 4.230 2.231 2.000 2.557 . 0 0 "[ . 1 . 2]" 1
453 1 20 TRP HZ3 1 28 TRP HD1 . . 4.800 3.979 3.752 4.101 . 0 0 "[ . 1 . 2]" 1
454 1 20 TRP HZ3 1 28 TRP HE1 . . 4.990 4.792 4.676 4.936 . 0 0 "[ . 1 . 2]" 1
455 1 20 TRP HZ3 1 28 TRP HE3 . . 4.690 3.072 2.722 3.334 . 0 0 "[ . 1 . 2]" 1
456 1 20 TRP HZ3 1 29 LEU H . . 5.110 4.718 4.416 4.989 . 0 0 "[ . 1 . 2]" 1
457 1 20 TRP HZ3 1 53 LEU QD . . 3.870 3.350 2.982 3.843 . 0 0 "[ . 1 . 2]" 1
458 1 20 TRP HZ3 1 81 LEU QD . . 4.590 3.863 3.618 4.132 . 0 0 "[ . 1 . 2]" 1
459 1 20 TRP HZ3 1 84 VAL MG1 . . 4.550 4.107 3.747 4.445 . 0 0 "[ . 1 . 2]" 1
460 1 20 TRP HZ3 1 84 VAL MG2 . . 4.760 3.954 3.566 4.343 . 0 0 "[ . 1 . 2]" 1
461 1 21 THR H 1 21 THR MG . . 3.080 3.025 2.869 3.087 0.007 4 0 "[ . 1 . 2]" 1
462 1 21 THR H 1 22 THR H . . 5.110 4.495 4.467 4.531 . 0 0 "[ . 1 . 2]" 1
463 1 21 THR H 1 23 GLU H . . 5.250 4.239 4.049 4.489 . 0 0 "[ . 1 . 2]" 1
464 1 21 THR H 1 24 GLU H . . 3.820 3.070 2.975 3.212 . 0 0 "[ . 1 . 2]" 1
465 1 21 THR H 1 24 GLU HA . . 4.930 4.740 4.670 4.792 . 0 0 "[ . 1 . 2]" 1
466 1 21 THR H 1 24 GLU HB2 . . 3.150 1.918 1.884 2.013 . 0 0 "[ . 1 . 2]" 1
467 1 21 THR H 1 24 GLU HB3 . . 3.640 3.567 3.483 3.631 . 0 0 "[ . 1 . 2]" 1
468 1 21 THR H 1 24 GLU HG2 . . 4.510 3.638 2.759 4.353 . 0 0 "[ . 1 . 2]" 1
469 1 21 THR H 1 24 GLU HG3 . . 4.510 3.218 2.668 3.800 . 0 0 "[ . 1 . 2]" 1
470 1 21 THR H 1 25 VAL H . . 4.600 3.317 3.122 3.547 . 0 0 "[ . 1 . 2]" 1
471 1 21 THR H 1 50 GLY H . . 5.500 4.291 4.170 4.484 . 0 0 "[ . 1 . 2]" 1
472 1 21 THR HB 1 22 THR H . . 2.820 2.510 2.320 2.610 . 0 0 "[ . 1 . 2]" 1
473 1 21 THR HB 1 22 THR HA . . 4.900 4.773 4.690 4.834 . 0 0 "[ . 1 . 2]" 1
474 1 21 THR HB 1 22 THR HB . . 4.380 4.252 4.157 4.354 . 0 0 "[ . 1 . 2]" 1
475 1 21 THR HB 1 22 THR MG . . 5.430 5.326 5.272 5.375 . 0 0 "[ . 1 . 2]" 1
476 1 21 THR HB 1 23 GLU H . . 3.440 2.663 2.627 2.688 . 0 0 "[ . 1 . 2]" 1
477 1 21 THR HB 1 23 GLU HA . . 5.500 5.476 5.429 5.510 0.010 15 0 "[ . 1 . 2]" 1
478 1 21 THR HB 1 23 GLU HB2 . . 4.580 3.905 3.838 3.991 . 0 0 "[ . 1 . 2]" 1
479 1 21 THR HB 1 23 GLU HB3 . . 4.880 4.292 4.205 4.440 . 0 0 "[ . 1 . 2]" 1
480 1 21 THR HB 1 24 GLU H . . 4.390 3.936 3.833 4.072 . 0 0 "[ . 1 . 2]" 1
481 1 21 THR HB 1 24 GLU QG . . 4.890 4.524 4.089 4.904 0.014 10 0 "[ . 1 . 2]" 1
482 1 21 THR HG1 1 23 GLU H . . 5.070 2.940 2.278 4.035 . 0 0 "[ . 1 . 2]" 1
483 1 21 THR HG1 1 24 GLU H . . 4.620 2.389 1.893 3.391 . 0 0 "[ . 1 . 2]" 1
484 1 21 THR MG 1 22 THR H . . 3.630 3.509 3.414 3.570 . 0 0 "[ . 1 . 2]" 1
485 1 21 THR MG 1 23 GLU H . . 4.230 4.207 4.148 4.281 0.051 19 0 "[ . 1 . 2]" 1
486 1 21 THR MG 1 23 GLU HB2 . . 5.060 4.982 4.942 5.058 . 0 0 "[ . 1 . 2]" 1
487 1 21 THR MG 1 24 GLU H . . 4.540 4.470 4.399 4.533 . 0 0 "[ . 1 . 2]" 1
488 1 21 THR MG 1 24 GLU HB2 . . 4.730 4.495 4.352 4.567 . 0 0 "[ . 1 . 2]" 1
489 1 21 THR MG 1 24 GLU QG . . 4.080 3.895 3.693 4.068 . 0 0 "[ . 1 . 2]" 1
490 1 21 THR MG 1 25 VAL H . . 5.500 5.470 5.392 5.524 0.024 10 0 "[ . 1 . 2]" 1
491 1 21 THR MG 1 49 ASN HB2 . . 4.830 4.458 4.247 4.633 . 0 0 "[ . 1 . 2]" 1
492 1 21 THR MG 1 50 GLY H . . 5.500 4.945 4.757 5.166 . 0 0 "[ . 1 . 2]" 1
493 1 22 THR H 1 22 THR HB . . 3.070 2.965 2.836 3.089 0.019 19 0 "[ . 1 . 2]" 1
494 1 22 THR H 1 22 THR MG . . 3.790 3.676 3.603 3.739 . 0 0 "[ . 1 . 2]" 1
495 1 22 THR H 1 23 GLU H . . 3.310 2.896 2.802 2.953 . 0 0 "[ . 1 . 2]" 1
496 1 22 THR H 1 23 GLU HA . . 5.500 5.456 5.372 5.504 0.004 19 0 "[ . 1 . 2]" 1
497 1 22 THR H 1 23 GLU HB2 . . 5.030 4.955 4.836 5.007 . 0 0 "[ . 1 . 2]" 1
498 1 22 THR H 1 24 GLU H . . 4.940 4.820 4.673 4.947 0.007 4 0 "[ . 1 . 2]" 1
499 1 22 THR H 1 25 VAL H . . 5.040 4.851 4.772 4.970 . 0 0 "[ . 1 . 2]" 1
500 1 22 THR H 1 25 VAL MG2 . . 4.730 3.788 3.619 4.065 . 0 0 "[ . 1 . 2]" 1
501 1 22 THR H 1 49 ASN HA . . 4.530 3.425 3.224 3.689 . 0 0 "[ . 1 . 2]" 1
502 1 22 THR H 1 49 ASN HB2 . . 4.190 3.636 3.300 4.002 . 0 0 "[ . 1 . 2]" 1
503 1 22 THR H 1 49 ASN HB3 . . 3.860 3.621 3.236 3.861 0.001 4 0 "[ . 1 . 2]" 1
504 1 22 THR HA 1 22 THR MG . . 3.070 2.270 2.066 2.353 . 0 0 "[ . 1 . 2]" 1
505 1 22 THR HA 1 23 GLU HA . . 4.980 4.710 4.664 4.742 . 0 0 "[ . 1 . 2]" 1
506 1 22 THR HA 1 24 GLU H . . 5.260 5.070 4.864 5.266 0.006 15 0 "[ . 1 . 2]" 1
507 1 22 THR HA 1 25 VAL H . . 4.110 3.956 3.816 4.094 . 0 0 "[ . 1 . 2]" 1
508 1 22 THR HA 1 25 VAL HB . . 3.260 2.848 2.690 3.071 . 0 0 "[ . 1 . 2]" 1
509 1 22 THR HA 1 25 VAL MG1 . . 4.140 3.935 3.827 4.093 . 0 0 "[ . 1 . 2]" 1
510 1 22 THR HA 1 25 VAL MG2 . . 3.400 2.736 2.574 2.916 . 0 0 "[ . 1 . 2]" 1
511 1 22 THR HA 1 26 VAL H . . 4.610 4.399 4.176 4.613 0.003 15 0 "[ . 1 . 2]" 1
512 1 22 THR HA 1 26 VAL MG2 . . 4.280 4.086 3.829 4.247 . 0 0 "[ . 1 . 2]" 1
513 1 22 THR HA 1 44 LEU HA . . 5.270 5.011 4.813 5.114 . 0 0 "[ . 1 . 2]" 1
514 1 22 THR HA 1 44 LEU QD . . 4.260 4.000 3.871 4.092 . 0 0 "[ . 1 . 2]" 1
515 1 22 THR HA 1 47 ARG HA . . 5.440 4.630 4.317 4.872 . 0 0 "[ . 1 . 2]" 1
516 1 22 THR HA 1 48 VAL H . . 5.080 4.988 4.745 5.088 0.008 19 0 "[ . 1 . 2]" 1
517 1 22 THR HA 1 49 ASN HB2 . . 4.730 4.481 4.103 4.735 0.005 18 0 "[ . 1 . 2]" 1
518 1 22 THR HA 1 49 ASN HB3 . . 4.360 4.169 3.717 4.362 0.002 14 0 "[ . 1 . 2]" 1
519 1 22 THR HB 1 23 GLU H . . 3.200 2.967 2.805 3.172 . 0 0 "[ . 1 . 2]" 1
520 1 22 THR HB 1 23 GLU HA . . 4.580 4.116 3.977 4.203 . 0 0 "[ . 1 . 2]" 1
521 1 22 THR HB 1 23 GLU HB2 . . 4.910 4.143 4.041 4.185 . 0 0 "[ . 1 . 2]" 1
522 1 22 THR HB 1 23 GLU QG . . 5.340 5.223 5.099 5.476 0.136 15 0 "[ . 1 . 2]" 1
523 1 22 THR HB 1 26 VAL MG2 . . 5.260 4.914 4.717 5.082 . 0 0 "[ . 1 . 2]" 1
524 1 22 THR HB 1 44 LEU HA . . 4.690 4.568 4.275 4.701 0.011 9 0 "[ . 1 . 2]" 1
525 1 22 THR HB 1 44 LEU QD . . 3.820 3.392 2.991 3.574 . 0 0 "[ . 1 . 2]" 1
526 1 22 THR HB 1 47 ARG HA . . 5.070 4.393 4.270 4.635 . 0 0 "[ . 1 . 2]" 1
527 1 22 THR MG 1 23 GLU H . . 4.230 4.011 3.842 4.154 . 0 0 "[ . 1 . 2]" 1
528 1 22 THR MG 1 23 GLU HA . . 4.330 4.125 3.839 4.283 . 0 0 "[ . 1 . 2]" 1
529 1 22 THR MG 1 25 VAL H . . 5.500 5.238 5.098 5.386 . 0 0 "[ . 1 . 2]" 1
530 1 22 THR MG 1 25 VAL HB . . 4.340 3.998 3.877 4.179 . 0 0 "[ . 1 . 2]" 1
531 1 22 THR MG 1 26 VAL HB . . 5.400 5.039 4.740 5.406 0.006 15 0 "[ . 1 . 2]" 1
532 1 22 THR MG 1 44 LEU H . . 4.440 4.225 4.048 4.314 . 0 0 "[ . 1 . 2]" 1
533 1 22 THR MG 1 44 LEU HA . . 2.920 2.220 2.044 2.286 . 0 0 "[ . 1 . 2]" 1
534 1 22 THR MG 1 44 LEU HB2 . . 4.640 4.611 4.513 4.651 0.011 18 0 "[ . 1 . 2]" 1
535 1 22 THR MG 1 44 LEU HB3 . . 4.410 3.871 3.627 4.006 . 0 0 "[ . 1 . 2]" 1
536 1 22 THR MG 1 44 LEU QD . . 2.890 1.984 1.893 2.076 . 0 0 "[ . 1 . 2]" 1
537 1 22 THR MG 1 44 LEU HG . . 4.660 4.450 4.254 4.538 . 0 0 "[ . 1 . 2]" 1
538 1 22 THR MG 1 46 GLU H . . 5.500 5.161 5.093 5.304 . 0 0 "[ . 1 . 2]" 1
539 1 22 THR MG 1 47 ARG H . . 3.600 3.560 3.430 3.605 0.005 18 0 "[ . 1 . 2]" 1
540 1 22 THR MG 1 47 ARG HA . . 2.940 1.935 1.768 2.059 . 0 0 "[ . 1 . 2]" 1
541 1 22 THR MG 1 47 ARG QB . . 3.630 3.261 2.941 3.479 . 0 0 "[ . 1 . 2]" 1
542 1 22 THR MG 1 47 ARG QD . . 4.010 2.606 2.078 4.026 0.016 4 0 "[ . 1 . 2]" 1
543 1 22 THR MG 1 47 ARG QG . . 4.080 3.786 2.506 4.076 . 0 0 "[ . 1 . 2]" 1
544 1 22 THR MG 1 48 VAL H . . 3.230 3.073 2.898 3.197 . 0 0 "[ . 1 . 2]" 1
545 1 22 THR MG 1 48 VAL HB . . 4.630 4.135 3.694 4.408 . 0 0 "[ . 1 . 2]" 1
546 1 22 THR MG 1 49 ASN H . . 4.700 4.426 4.239 4.622 . 0 0 "[ . 1 . 2]" 1
547 1 22 THR MG 1 49 ASN HA . . 4.350 3.855 3.496 4.038 . 0 0 "[ . 1 . 2]" 1
548 1 22 THR MG 1 49 ASN HB2 . . 5.500 5.294 4.861 5.492 . 0 0 "[ . 1 . 2]" 1
549 1 22 THR MG 1 49 ASN HB3 . . 4.550 4.376 4.070 4.557 0.007 18 0 "[ . 1 . 2]" 1
550 1 23 GLU H 1 23 GLU HB2 . . 3.080 2.314 2.203 2.406 . 0 0 "[ . 1 . 2]" 1
551 1 23 GLU H 1 23 GLU HB3 . . 3.450 2.844 2.812 2.948 . 0 0 "[ . 1 . 2]" 1
552 1 23 GLU H 1 23 GLU HG2 . . 4.700 4.568 4.474 4.644 . 0 0 "[ . 1 . 2]" 1
553 1 23 GLU H 1 23 GLU QG . . 4.090 3.935 3.893 4.052 . 0 0 "[ . 1 . 2]" 1
554 1 23 GLU H 1 23 GLU HG3 . . 4.700 4.298 4.229 4.625 . 0 0 "[ . 1 . 2]" 1
555 1 23 GLU H 1 24 GLU H . . 3.240 2.649 2.499 2.746 . 0 0 "[ . 1 . 2]" 1
556 1 23 GLU H 1 24 GLU QG . . 5.060 4.429 4.084 4.686 . 0 0 "[ . 1 . 2]" 1
557 1 23 GLU H 1 44 LEU QD . . 4.750 4.512 4.127 4.614 . 0 0 "[ . 1 . 2]" 1
558 1 23 GLU HA 1 23 GLU HG2 . . 3.650 2.897 2.480 3.582 . 0 0 "[ . 1 . 2]" 1
559 1 23 GLU HA 1 23 GLU QG . . 2.880 2.284 2.154 2.819 . 0 0 "[ . 1 . 2]" 1
560 1 23 GLU HA 1 23 GLU HG3 . . 3.650 2.438 2.197 2.960 . 0 0 "[ . 1 . 2]" 1
561 1 23 GLU HA 1 25 VAL H . . 4.590 4.508 4.397 4.590 . 4 0 "[ . 1 . 2]" 1
562 1 23 GLU HA 1 26 VAL H . . 3.950 3.799 3.614 3.924 . 0 0 "[ . 1 . 2]" 1
563 1 23 GLU HA 1 26 VAL HB . . 3.810 3.517 3.345 3.673 . 0 0 "[ . 1 . 2]" 1
564 1 23 GLU HA 1 26 VAL MG2 . . 3.850 3.626 3.305 3.820 . 0 0 "[ . 1 . 2]" 1
565 1 23 GLU HA 1 27 LEU H . . 4.660 4.448 4.294 4.566 . 0 0 "[ . 1 . 2]" 1
566 1 23 GLU HA 1 27 LEU QB . . 5.340 5.250 5.115 5.341 0.001 10 0 "[ . 1 . 2]" 1
567 1 23 GLU HA 1 44 LEU QD . . 3.440 3.145 2.761 3.272 . 0 0 "[ . 1 . 2]" 1
568 1 23 GLU HB2 1 24 GLU H . . 3.540 3.364 3.216 3.471 . 0 0 "[ . 1 . 2]" 1
569 1 23 GLU HB3 1 24 GLU H . . 3.890 2.197 2.071 2.351 . 0 0 "[ . 1 . 2]" 1
570 1 23 GLU HB3 1 27 LEU QD . . 4.870 3.839 3.643 4.014 . 0 0 "[ . 1 . 2]" 1
571 1 23 GLU QG 1 24 GLU H . . 4.540 3.832 3.719 3.954 . 0 0 "[ . 1 . 2]" 1
572 1 23 GLU QG 1 27 LEU QD . . 4.200 2.999 2.783 3.218 . 0 0 "[ . 1 . 2]" 1
573 1 23 GLU QG 1 27 LEU HG . . 5.080 3.297 3.112 3.543 . 0 0 "[ . 1 . 2]" 1
574 1 23 GLU QG 1 44 LEU QD . . 4.140 3.958 3.725 4.152 0.012 15 0 "[ . 1 . 2]" 1
575 1 24 GLU H 1 24 GLU HB2 . . 3.020 2.485 2.322 2.691 . 0 0 "[ . 1 . 2]" 1
576 1 24 GLU H 1 24 GLU HB3 . . 3.630 3.586 3.558 3.593 . 0 0 "[ . 1 . 2]" 1
577 1 24 GLU H 1 24 GLU QG . . 3.030 2.311 1.879 2.550 . 0 0 "[ . 1 . 2]" 1
578 1 24 GLU H 1 25 VAL H . . 3.030 2.768 2.659 2.893 . 0 0 "[ . 1 . 2]" 1
579 1 24 GLU H 1 25 VAL HB . . 5.080 4.907 4.775 5.088 0.008 15 0 "[ . 1 . 2]" 1
580 1 24 GLU H 1 25 VAL MG2 . . 4.650 4.313 4.139 4.546 . 0 0 "[ . 1 . 2]" 1
581 1 24 GLU H 1 26 VAL H . . 4.510 4.486 4.370 4.518 0.008 19 0 "[ . 1 . 2]" 1
582 1 24 GLU H 1 27 LEU QD . . 5.000 4.191 4.090 4.411 . 0 0 "[ . 1 . 2]" 1
583 1 24 GLU HA 1 24 GLU HG2 . . 3.560 2.843 2.355 3.349 . 0 0 "[ . 1 . 2]" 1
584 1 24 GLU HA 1 24 GLU HG3 . . 3.560 3.410 3.130 3.671 0.111 10 0 "[ . 1 . 2]" 1
585 1 24 GLU HA 1 26 VAL H . . 4.800 4.441 4.321 4.528 . 0 0 "[ . 1 . 2]" 1
586 1 24 GLU HA 1 27 LEU H . . 3.360 3.221 3.158 3.289 . 0 0 "[ . 1 . 2]" 1
587 1 24 GLU HA 1 27 LEU HA . . 5.400 4.945 4.882 5.012 . 0 0 "[ . 1 . 2]" 1
588 1 24 GLU HA 1 27 LEU HB2 . . 3.610 2.078 2.021 2.122 . 0 0 "[ . 1 . 2]" 1
589 1 24 GLU HA 1 27 LEU QB . . 3.100 2.065 2.010 2.107 . 0 0 "[ . 1 . 2]" 1
590 1 24 GLU HA 1 27 LEU HB3 . . 3.610 3.574 3.509 3.620 0.010 3 0 "[ . 1 . 2]" 1
591 1 24 GLU HA 1 27 LEU MD1 . . 4.770 2.663 2.527 2.858 . 0 0 "[ . 1 . 2]" 1
592 1 24 GLU HA 1 27 LEU QD . . 3.330 2.645 2.514 2.832 . 0 0 "[ . 1 . 2]" 1
593 1 24 GLU HA 1 27 LEU MD2 . . 4.770 4.550 4.495 4.644 . 0 0 "[ . 1 . 2]" 1
594 1 24 GLU HA 1 27 LEU HG . . 4.170 3.471 3.376 3.617 . 0 0 "[ . 1 . 2]" 1
595 1 24 GLU HA 1 28 TRP H . . 4.610 3.840 3.708 3.930 . 0 0 "[ . 1 . 2]" 1
596 1 24 GLU HB2 1 25 VAL H . . 3.450 2.607 2.533 2.677 . 0 0 "[ . 1 . 2]" 1
597 1 24 GLU HB2 1 25 VAL HA . . 5.150 4.271 4.120 4.458 . 0 0 "[ . 1 . 2]" 1
598 1 24 GLU HB2 1 25 VAL HB . . 5.310 5.091 4.939 5.225 . 0 0 "[ . 1 . 2]" 1
599 1 24 GLU HB2 1 25 VAL MG2 . . 4.210 3.531 3.364 3.658 . 0 0 "[ . 1 . 2]" 1
600 1 24 GLU HB3 1 25 VAL H . . 4.210 3.583 3.339 3.708 . 0 0 "[ . 1 . 2]" 1
601 1 24 GLU QG 1 25 VAL H . . 4.210 4.093 3.909 4.214 0.004 16 0 "[ . 1 . 2]" 1
602 1 24 GLU QG 1 27 LEU QB . . 5.180 4.220 3.821 4.626 . 0 0 "[ . 1 . 2]" 1
603 1 24 GLU QG 1 27 LEU QD . . 4.050 3.522 2.993 4.062 0.012 19 0 "[ . 1 . 2]" 1
604 1 25 VAL H 1 25 VAL HB . . 2.750 2.540 2.433 2.633 . 0 0 "[ . 1 . 2]" 1
605 1 25 VAL H 1 25 VAL MG1 . . 3.840 3.763 3.747 3.772 . 0 0 "[ . 1 . 2]" 1
606 1 25 VAL H 1 25 VAL MG2 . . 2.770 2.278 2.092 2.446 . 0 0 "[ . 1 . 2]" 1
607 1 25 VAL H 1 26 VAL H . . 3.080 2.915 2.848 2.973 . 0 0 "[ . 1 . 2]" 1
608 1 25 VAL H 1 26 VAL HA . . 5.500 5.471 5.427 5.515 0.015 18 0 "[ . 1 . 2]" 1
609 1 25 VAL H 1 27 LEU H . . 4.420 4.058 3.970 4.149 . 0 0 "[ . 1 . 2]" 1
610 1 25 VAL H 1 28 TRP H . . 4.950 4.904 4.845 4.957 0.007 15 0 "[ . 1 . 2]" 1
611 1 25 VAL HA 1 25 VAL MG1 . . 3.030 2.448 2.378 2.495 . 0 0 "[ . 1 . 2]" 1
612 1 25 VAL HA 1 25 VAL MG2 . . 2.890 2.266 2.189 2.347 . 0 0 "[ . 1 . 2]" 1
613 1 25 VAL HA 1 27 LEU H . . 4.540 4.434 4.270 4.544 0.004 19 0 "[ . 1 . 2]" 1
614 1 25 VAL HA 1 28 TRP H . . 4.000 3.936 3.880 3.967 . 0 0 "[ . 1 . 2]" 1
615 1 25 VAL HA 1 28 TRP HB3 . . 3.500 3.338 3.259 3.386 . 0 0 "[ . 1 . 2]" 1
616 1 25 VAL HA 1 28 TRP HE3 . . 4.020 3.791 3.536 3.987 . 0 0 "[ . 1 . 2]" 1
617 1 25 VAL HA 1 29 LEU H . . 4.850 4.529 4.397 4.663 . 0 0 "[ . 1 . 2]" 1
618 1 25 VAL HA 1 53 LEU QD . . 4.110 3.114 2.872 3.348 . 0 0 "[ . 1 . 2]" 1
619 1 25 VAL HB 1 26 VAL H . . 3.210 2.460 2.383 2.531 . 0 0 "[ . 1 . 2]" 1
620 1 25 VAL HB 1 26 VAL HA . . 4.940 4.360 4.274 4.473 . 0 0 "[ . 1 . 2]" 1
621 1 25 VAL HB 1 26 VAL HB . . 4.960 4.731 4.612 4.863 . 0 0 "[ . 1 . 2]" 1
622 1 25 VAL HB 1 26 VAL MG1 . . 5.500 5.427 5.358 5.503 0.003 17 0 "[ . 1 . 2]" 1
623 1 25 VAL HB 1 26 VAL MG2 . . 3.960 3.085 2.931 3.226 . 0 0 "[ . 1 . 2]" 1
624 1 25 VAL HB 1 27 LEU H . . 4.910 4.783 4.684 4.862 . 0 0 "[ . 1 . 2]" 1
625 1 25 VAL HB 1 44 LEU QD . . 5.060 4.516 4.402 4.605 . 0 0 "[ . 1 . 2]" 1
626 1 25 VAL HB 1 48 VAL MG1 . . 4.880 4.589 4.150 4.852 . 0 0 "[ . 1 . 2]" 1
627 1 25 VAL HB 1 49 ASN HA . . 4.370 3.718 3.440 3.930 . 0 0 "[ . 1 . 2]" 1
628 1 25 VAL MG1 1 26 VAL H . . 3.510 3.204 3.045 3.441 . 0 0 "[ . 1 . 2]" 1
629 1 25 VAL MG1 1 26 VAL HA . . 3.760 3.319 3.126 3.559 . 0 0 "[ . 1 . 2]" 1
630 1 25 VAL MG1 1 28 TRP H . . 5.140 5.044 4.974 5.109 . 0 0 "[ . 1 . 2]" 1
631 1 25 VAL MG1 1 28 TRP HB3 . . 5.500 4.472 4.358 4.588 . 0 0 "[ . 1 . 2]" 1
632 1 25 VAL MG1 1 28 TRP HE3 . . 3.780 3.566 3.292 3.749 . 0 0 "[ . 1 . 2]" 1
633 1 25 VAL MG1 1 28 TRP HZ3 . . 4.340 4.188 3.824 4.344 0.004 5 0 "[ . 1 . 2]" 1
634 1 25 VAL MG1 1 29 LEU H . . 4.680 4.426 4.340 4.578 . 0 0 "[ . 1 . 2]" 1
635 1 25 VAL MG1 1 29 LEU HB2 . . 5.010 4.152 3.941 4.373 . 0 0 "[ . 1 . 2]" 1
636 1 25 VAL MG1 1 29 LEU HB3 . . 4.930 4.184 4.022 4.387 . 0 0 "[ . 1 . 2]" 1
637 1 25 VAL MG1 1 29 LEU MD2 . . 4.280 3.995 3.786 4.242 . 0 0 "[ . 1 . 2]" 1
638 1 25 VAL MG1 1 43 PHE HA . . 4.890 4.588 4.388 4.755 . 0 0 "[ . 1 . 2]" 1
639 1 25 VAL MG1 1 43 PHE HB2 . . 4.600 4.386 3.986 4.601 0.001 15 0 "[ . 1 . 2]" 1
640 1 25 VAL MG1 1 43 PHE HB3 . . 3.830 3.162 2.718 3.410 . 0 0 "[ . 1 . 2]" 1
641 1 25 VAL MG1 1 43 PHE QD . . 3.260 1.980 1.837 2.374 . 0 0 "[ . 1 . 2]" 1
642 1 25 VAL MG1 1 43 PHE QE . . 3.790 2.816 2.246 3.252 . 0 0 "[ . 1 . 2]" 1
643 1 25 VAL MG1 1 48 VAL HA . . 5.500 4.878 4.553 5.120 . 0 0 "[ . 1 . 2]" 1
644 1 25 VAL MG1 1 48 VAL HB . . 3.700 3.254 2.860 3.632 . 0 0 "[ . 1 . 2]" 1
645 1 25 VAL MG1 1 50 GLY H . . 4.960 4.255 4.059 4.559 . 0 0 "[ . 1 . 2]" 1
646 1 25 VAL MG1 1 50 GLY HA2 . . 4.760 3.445 3.014 3.763 . 0 0 "[ . 1 . 2]" 1
647 1 25 VAL MG1 1 53 LEU H . . 5.160 4.249 3.796 4.576 . 0 0 "[ . 1 . 2]" 1
648 1 25 VAL MG1 1 53 LEU HA . . 4.770 4.376 3.935 4.642 . 0 0 "[ . 1 . 2]" 1
649 1 25 VAL MG1 1 53 LEU HB2 . . 4.660 2.547 2.051 2.917 . 0 0 "[ . 1 . 2]" 1
650 1 25 VAL MG1 1 53 LEU HB3 . . 4.330 3.646 3.257 4.039 . 0 0 "[ . 1 . 2]" 1
651 1 25 VAL MG1 1 53 LEU QD . . 3.020 1.883 1.674 2.195 . 0 0 "[ . 1 . 2]" 1
652 1 25 VAL MG1 1 53 LEU HG . . 4.770 3.654 2.748 4.533 . 0 0 "[ . 1 . 2]" 1
653 1 25 VAL MG2 1 26 VAL H . . 4.060 3.844 3.774 3.932 . 0 0 "[ . 1 . 2]" 1
654 1 25 VAL MG2 1 27 LEU H . . 5.500 5.299 5.189 5.420 . 0 0 "[ . 1 . 2]" 1
655 1 25 VAL MG2 1 28 TRP H . . 5.500 5.480 5.449 5.501 0.001 6 0 "[ . 1 . 2]" 1
656 1 25 VAL MG2 1 28 TRP HB3 . . 5.500 5.057 4.944 5.141 . 0 0 "[ . 1 . 2]" 1
657 1 25 VAL MG2 1 28 TRP HE3 . . 5.500 5.160 4.979 5.335 . 0 0 "[ . 1 . 2]" 1
658 1 25 VAL MG2 1 48 VAL HA . . 5.500 5.195 5.026 5.331 . 0 0 "[ . 1 . 2]" 1
659 1 25 VAL MG2 1 49 ASN H . . 4.370 4.294 4.177 4.391 0.021 18 0 "[ . 1 . 2]" 1
660 1 25 VAL MG2 1 49 ASN HA . . 3.240 2.100 1.959 2.328 . 0 0 "[ . 1 . 2]" 1
661 1 25 VAL MG2 1 49 ASN HB2 . . 4.030 3.576 3.355 3.827 . 0 0 "[ . 1 . 2]" 1
662 1 25 VAL MG2 1 49 ASN HB3 . . 4.780 4.206 3.983 4.434 . 0 0 "[ . 1 . 2]" 1
663 1 25 VAL MG2 1 49 ASN QD . . 5.340 4.955 4.413 5.288 . 0 0 "[ . 1 . 2]" 1
664 1 25 VAL MG2 1 50 GLY H . . 3.380 2.138 1.968 2.363 . 0 0 "[ . 1 . 2]" 1
665 1 25 VAL MG2 1 50 GLY HA2 . . 3.560 2.159 1.960 2.320 . 0 0 "[ . 1 . 2]" 1
666 1 25 VAL MG2 1 50 GLY HA3 . . 4.070 2.940 2.763 3.112 . 0 0 "[ . 1 . 2]" 1
667 1 25 VAL MG2 1 51 ARG H . . 4.830 4.387 4.190 4.551 . 0 0 "[ . 1 . 2]" 1
668 1 25 VAL MG2 1 53 LEU H . . 4.640 3.938 3.663 4.180 . 0 0 "[ . 1 . 2]" 1
669 1 25 VAL MG2 1 53 LEU HA . . 5.500 5.150 4.937 5.414 . 0 0 "[ . 1 . 2]" 1
670 1 25 VAL MG2 1 53 LEU HB2 . . 3.590 2.945 2.595 3.224 . 0 0 "[ . 1 . 2]" 1
671 1 25 VAL MG2 1 53 LEU HB3 . . 4.150 3.710 3.460 4.130 . 0 0 "[ . 1 . 2]" 1
672 1 25 VAL MG2 1 53 LEU QD . . 3.120 2.838 2.313 3.112 . 0 0 "[ . 1 . 2]" 1
673 1 26 VAL H 1 26 VAL HB . . 2.940 2.485 2.424 2.532 . 0 0 "[ . 1 . 2]" 1
674 1 26 VAL H 1 26 VAL MG1 . . 3.840 3.761 3.746 3.769 . 0 0 "[ . 1 . 2]" 1
675 1 26 VAL H 1 26 VAL MG2 . . 2.830 2.281 2.170 2.385 . 0 0 "[ . 1 . 2]" 1
676 1 26 VAL H 1 27 LEU H . . 3.150 2.540 2.468 2.580 . 0 0 "[ . 1 . 2]" 1
677 1 26 VAL H 1 27 LEU HA . . 5.500 5.151 5.094 5.188 . 0 0 "[ . 1 . 2]" 1
678 1 26 VAL H 1 29 LEU MD2 . . 5.500 5.385 5.221 5.505 0.005 19 0 "[ . 1 . 2]" 1
679 1 26 VAL HA 1 26 VAL MG1 . . 3.000 2.400 2.333 2.458 . 0 0 "[ . 1 . 2]" 1
680 1 26 VAL HA 1 26 VAL MG2 . . 2.880 2.380 2.335 2.432 . 0 0 "[ . 1 . 2]" 1
681 1 26 VAL HA 1 27 LEU HA . . 5.500 4.818 4.794 4.835 . 0 0 "[ . 1 . 2]" 1
682 1 26 VAL HA 1 28 TRP H . . 4.770 4.651 4.558 4.751 . 0 0 "[ . 1 . 2]" 1
683 1 26 VAL HA 1 29 LEU H . . 3.660 3.509 3.462 3.562 . 0 0 "[ . 1 . 2]" 1
684 1 26 VAL HA 1 29 LEU HA . . 5.500 5.501 5.466 5.519 0.019 19 0 "[ . 1 . 2]" 1
685 1 26 VAL HA 1 29 LEU HB2 . . 4.080 4.040 3.964 4.084 0.004 15 0 "[ . 1 . 2]" 1
686 1 26 VAL HA 1 29 LEU HB3 . . 3.280 2.648 2.601 2.699 . 0 0 "[ . 1 . 2]" 1
687 1 26 VAL HA 1 29 LEU MD2 . . 3.650 2.973 2.775 3.096 . 0 0 "[ . 1 . 2]" 1
688 1 26 VAL HA 1 29 LEU HG . . 5.080 4.852 4.714 4.993 . 0 0 "[ . 1 . 2]" 1
689 1 26 VAL HA 1 30 GLU H . . 4.530 4.110 3.998 4.303 . 0 0 "[ . 1 . 2]" 1
690 1 26 VAL HA 1 40 ARG HA . . 4.420 4.221 4.092 4.354 . 0 0 "[ . 1 . 2]" 1
691 1 26 VAL HA 1 40 ARG HB2 . . 4.910 4.523 4.181 4.912 0.002 19 0 "[ . 1 . 2]" 1
692 1 26 VAL HA 1 43 PHE HB3 . . 4.700 4.204 4.087 4.485 . 0 0 "[ . 1 . 2]" 1
693 1 26 VAL HB 1 27 LEU H . . 3.340 2.785 2.681 2.901 . 0 0 "[ . 1 . 2]" 1
694 1 26 VAL HB 1 27 LEU HA . . 4.880 4.279 4.210 4.337 . 0 0 "[ . 1 . 2]" 1
695 1 26 VAL HB 1 27 LEU QB . . 5.040 4.574 4.507 4.625 . 0 0 "[ . 1 . 2]" 1
696 1 26 VAL HB 1 44 LEU MD1 . . 4.330 3.429 3.131 3.661 . 0 0 "[ . 1 . 2]" 1
697 1 26 VAL HB 1 44 LEU QD . . 3.470 2.994 2.859 3.128 . 0 0 "[ . 1 . 2]" 1
698 1 26 VAL HB 1 44 LEU MD2 . . 4.330 3.330 3.052 3.663 . 0 0 "[ . 1 . 2]" 1
699 1 26 VAL HB 1 44 LEU HG . . 5.500 5.357 5.227 5.503 0.003 3 0 "[ . 1 . 2]" 1
700 1 26 VAL MG1 1 27 LEU H . . 3.730 3.530 3.368 3.617 . 0 0 "[ . 1 . 2]" 1
701 1 26 VAL MG1 1 27 LEU HA . . 3.870 3.466 3.309 3.559 . 0 0 "[ . 1 . 2]" 1
702 1 26 VAL MG1 1 29 LEU H . . 4.990 4.588 4.440 4.679 . 0 0 "[ . 1 . 2]" 1
703 1 26 VAL MG1 1 29 LEU MD2 . . 3.760 3.267 3.040 3.454 . 0 0 "[ . 1 . 2]" 1
704 1 26 VAL MG1 1 30 GLU H . . 4.390 3.857 3.722 3.954 . 0 0 "[ . 1 . 2]" 1
705 1 26 VAL MG1 1 30 GLU HG2 . . 4.310 3.324 3.137 3.590 . 0 0 "[ . 1 . 2]" 1
706 1 26 VAL MG1 1 30 GLU HG3 . . 3.510 2.031 1.898 2.274 . 0 0 "[ . 1 . 2]" 1
707 1 26 VAL MG1 1 40 ARG H . . 4.320 4.283 4.078 4.332 0.012 16 0 "[ . 1 . 2]" 1
708 1 26 VAL MG1 1 40 ARG HA . . 3.620 2.801 2.332 3.040 . 0 0 "[ . 1 . 2]" 1
709 1 26 VAL MG1 1 40 ARG HB2 . . 3.270 1.876 1.775 2.048 . 0 0 "[ . 1 . 2]" 1
710 1 26 VAL MG1 1 40 ARG HB3 . . 3.300 2.693 2.520 2.847 . 0 0 "[ . 1 . 2]" 1
711 1 26 VAL MG1 1 40 ARG HD2 . . 3.900 3.249 2.965 3.518 . 0 0 "[ . 1 . 2]" 1
712 1 26 VAL MG1 1 40 ARG HD3 . . 4.990 4.407 4.190 4.680 . 0 0 "[ . 1 . 2]" 1
713 1 26 VAL MG1 1 40 ARG HG2 . . 4.810 4.317 4.127 4.517 . 0 0 "[ . 1 . 2]" 1
714 1 26 VAL MG1 1 43 PHE H . . 5.390 5.189 4.906 5.400 0.010 18 0 "[ . 1 . 2]" 1
715 1 26 VAL MG1 1 43 PHE HB2 . . 3.920 3.668 3.401 3.925 0.005 18 0 "[ . 1 . 2]" 1
716 1 26 VAL MG1 1 43 PHE HB3 . . 4.660 4.370 4.190 4.665 0.005 17 0 "[ . 1 . 2]" 1
717 1 26 VAL MG1 1 43 PHE QD . . 4.530 4.424 4.310 4.533 0.003 3 0 "[ . 1 . 2]" 1
718 1 26 VAL MG2 1 27 LEU H . . 3.960 3.923 3.859 3.962 0.002 18 0 "[ . 1 . 2]" 1
719 1 26 VAL MG2 1 29 LEU MD2 . . 3.990 3.766 3.630 3.914 . 0 0 "[ . 1 . 2]" 1
720 1 26 VAL MG2 1 40 ARG H . . 5.410 5.163 5.000 5.327 . 0 0 "[ . 1 . 2]" 1
721 1 26 VAL MG2 1 40 ARG HA . . 3.720 2.854 2.654 3.098 . 0 0 "[ . 1 . 2]" 1
722 1 26 VAL MG2 1 40 ARG HB2 . . 3.480 2.949 2.542 3.186 . 0 0 "[ . 1 . 2]" 1
723 1 26 VAL MG2 1 40 ARG HD2 . . 5.500 5.102 4.707 5.362 . 0 0 "[ . 1 . 2]" 1
724 1 26 VAL MG2 1 40 ARG HG2 . . 5.500 5.368 5.067 5.505 0.005 19 0 "[ . 1 . 2]" 1
725 1 26 VAL MG2 1 40 ARG HG3 . . 5.030 4.519 4.190 4.781 . 0 0 "[ . 1 . 2]" 1
726 1 26 VAL MG2 1 43 PHE H . . 4.130 4.080 3.871 4.136 0.006 3 0 "[ . 1 . 2]" 1
727 1 26 VAL MG2 1 43 PHE HB2 . . 3.390 2.151 1.967 2.238 . 0 0 "[ . 1 . 2]" 1
728 1 26 VAL MG2 1 43 PHE HB3 . . 3.390 2.259 2.119 2.447 . 0 0 "[ . 1 . 2]" 1
729 1 26 VAL MG2 1 43 PHE QD . . 4.260 3.086 2.502 3.439 . 0 0 "[ . 1 . 2]" 1
730 1 26 VAL MG2 1 44 LEU HA . . 3.770 3.643 3.444 3.784 0.014 18 0 "[ . 1 . 2]" 1
731 1 26 VAL MG2 1 44 LEU HB3 . . 4.720 4.651 4.564 4.712 . 0 0 "[ . 1 . 2]" 1
732 1 26 VAL MG2 1 44 LEU MD1 . . 3.370 1.948 1.751 2.151 . 0 0 "[ . 1 . 2]" 1
733 1 26 VAL MG2 1 44 LEU QD . . 2.800 1.638 1.577 1.685 . 0 0 "[ . 1 . 2]" 1
734 1 26 VAL MG2 1 44 LEU MD2 . . 3.370 1.773 1.645 1.897 . 0 0 "[ . 1 . 2]" 1
735 1 26 VAL MG2 1 44 LEU HG . . 3.700 3.669 3.569 3.717 0.017 7 0 "[ . 1 . 2]" 1
736 1 27 LEU H 1 27 LEU HB2 . . 3.610 2.174 2.165 2.182 . 0 0 "[ . 1 . 2]" 1
737 1 27 LEU H 1 27 LEU QB . . 2.780 2.154 2.144 2.161 . 0 0 "[ . 1 . 2]" 1
738 1 27 LEU H 1 27 LEU HB3 . . 3.610 3.489 3.482 3.493 . 0 0 "[ . 1 . 2]" 1
739 1 27 LEU H 1 27 LEU MD1 . . 4.360 3.887 3.833 3.965 . 0 0 "[ . 1 . 2]" 1
740 1 27 LEU H 1 27 LEU MD2 . . 4.360 3.761 3.714 3.802 . 0 0 "[ . 1 . 2]" 1
741 1 27 LEU H 1 27 LEU HG . . 3.470 2.921 2.896 2.963 . 0 0 "[ . 1 . 2]" 1
742 1 27 LEU H 1 28 TRP HB2 . . 5.500 5.505 5.492 5.511 0.011 16 0 "[ . 1 . 2]" 1
743 1 27 LEU H 1 29 LEU H . . 4.600 4.094 3.986 4.175 . 0 0 "[ . 1 . 2]" 1
744 1 27 LEU H 1 30 GLU H . . 4.710 4.521 4.464 4.607 . 0 0 "[ . 1 . 2]" 1
745 1 27 LEU H 1 30 GLU HB2 . . 4.930 4.593 4.518 4.711 . 0 0 "[ . 1 . 2]" 1
746 1 27 LEU HA 1 27 LEU MD1 . . 4.010 3.788 3.765 3.800 . 0 0 "[ . 1 . 2]" 1
747 1 27 LEU HA 1 27 LEU QD . . 2.830 1.981 1.935 2.056 . 0 0 "[ . 1 . 2]" 1
748 1 27 LEU HA 1 27 LEU MD2 . . 4.010 1.988 1.941 2.065 . 0 0 "[ . 1 . 2]" 1
749 1 27 LEU HA 1 29 LEU H . . 4.990 4.410 4.356 4.482 . 0 0 "[ . 1 . 2]" 1
750 1 27 LEU HA 1 30 GLU H . . 3.730 3.338 3.302 3.402 . 0 0 "[ . 1 . 2]" 1
751 1 27 LEU HA 1 30 GLU HA . . 5.500 5.223 5.186 5.312 . 0 0 "[ . 1 . 2]" 1
752 1 27 LEU HA 1 30 GLU HB2 . . 3.380 2.326 2.285 2.426 . 0 0 "[ . 1 . 2]" 1
753 1 27 LEU HA 1 30 GLU HB3 . . 4.050 3.829 3.764 3.971 . 0 0 "[ . 1 . 2]" 1
754 1 27 LEU HA 1 30 GLU HG2 . . 5.050 4.987 4.899 5.053 0.003 15 0 "[ . 1 . 2]" 1
755 1 27 LEU HA 1 30 GLU HG3 . . 4.230 3.740 3.566 3.912 . 0 0 "[ . 1 . 2]" 1
756 1 27 LEU HA 1 31 GLN H . . 5.500 5.232 5.126 5.352 . 0 0 "[ . 1 . 2]" 1
757 1 27 LEU QB 1 27 LEU QD . . 2.620 1.916 1.910 1.922 . 0 0 "[ . 1 . 2]" 1
758 1 27 LEU QB 1 28 TRP H . . 3.350 2.456 2.410 2.514 . 0 0 "[ . 1 . 2]" 1
759 1 27 LEU QB 1 28 TRP HA . . 5.340 3.742 3.725 3.768 . 0 0 "[ . 1 . 2]" 1
760 1 27 LEU HB2 1 28 TRP H . . 4.040 2.603 2.556 2.659 . 0 0 "[ . 1 . 2]" 1
761 1 27 LEU HB3 1 28 TRP H . . 4.040 3.014 2.948 3.097 . 0 0 "[ . 1 . 2]" 1
762 1 27 LEU QD 1 28 TRP HA . . 4.750 4.747 4.724 4.761 0.011 19 0 "[ . 1 . 2]" 1
763 1 27 LEU QD 1 30 GLU HB3 . . 4.550 3.953 3.828 4.077 . 0 0 "[ . 1 . 2]" 1
764 1 27 LEU QD 1 30 GLU HG2 . . 5.440 5.249 5.098 5.362 . 0 0 "[ . 1 . 2]" 1
765 1 27 LEU QD 1 31 GLN HE21 . . 4.550 4.048 3.739 4.215 . 0 0 "[ . 1 . 2]" 1
766 1 27 LEU QD 1 31 GLN HE22 . . 4.570 4.490 4.134 4.580 0.010 3 0 "[ . 1 . 2]" 1
767 1 27 LEU QD 1 31 GLN HG2 . . 5.440 5.059 4.811 5.272 . 0 0 "[ . 1 . 2]" 1
768 1 27 LEU QD 1 31 GLN HG3 . . 4.990 4.088 3.923 4.243 . 0 0 "[ . 1 . 2]" 1
769 1 27 LEU MD1 1 28 TRP H . . 4.670 4.424 4.358 4.510 . 0 0 "[ . 1 . 2]" 1
770 1 27 LEU MD1 1 28 TRP HA . . 5.500 5.506 5.493 5.514 0.014 19 0 "[ . 1 . 2]" 1
771 1 27 LEU MD1 1 31 GLN HE21 . . 5.430 5.026 4.702 5.202 . 0 0 "[ . 1 . 2]" 1
772 1 27 LEU MD1 1 31 GLN HE22 . . 5.390 5.127 4.667 5.290 . 0 0 "[ . 1 . 2]" 1
773 1 27 LEU MD2 1 28 TRP H . . 4.670 4.518 4.491 4.539 . 0 0 "[ . 1 . 2]" 1
774 1 27 LEU MD2 1 28 TRP HA . . 5.500 5.184 5.145 5.205 . 0 0 "[ . 1 . 2]" 1
775 1 27 LEU MD2 1 31 GLN HE21 . . 5.430 4.270 3.926 4.455 . 0 0 "[ . 1 . 2]" 1
776 1 27 LEU MD2 1 31 GLN HE22 . . 5.390 4.963 4.576 5.094 . 0 0 "[ . 1 . 2]" 1
777 1 28 TRP H 1 28 TRP HB2 . . 3.100 2.784 2.744 2.851 . 0 0 "[ . 1 . 2]" 1
778 1 28 TRP H 1 28 TRP HB3 . . 3.010 2.299 2.249 2.333 . 0 0 "[ . 1 . 2]" 1
779 1 28 TRP H 1 28 TRP HD1 . . 5.360 5.181 5.150 5.229 . 0 0 "[ . 1 . 2]" 1
780 1 28 TRP H 1 29 LEU H . . 3.150 2.745 2.680 2.784 . 0 0 "[ . 1 . 2]" 1
781 1 28 TRP H 1 29 LEU HB2 . . 5.500 5.395 5.344 5.436 . 0 0 "[ . 1 . 2]" 1
782 1 28 TRP HA 1 28 TRP HD1 . . 3.540 3.187 3.161 3.238 . 0 0 "[ . 1 . 2]" 1
783 1 28 TRP HA 1 28 TRP HE1 . . 5.450 5.279 5.248 5.327 . 0 0 "[ . 1 . 2]" 1
784 1 28 TRP HA 1 28 TRP HE3 . . 4.870 4.788 4.767 4.803 . 0 0 "[ . 1 . 2]" 1
785 1 28 TRP HA 1 29 LEU HA . . 4.960 4.721 4.710 4.730 . 0 0 "[ . 1 . 2]" 1
786 1 28 TRP HA 1 30 GLU H . . 4.470 4.176 4.100 4.244 . 0 0 "[ . 1 . 2]" 1
787 1 28 TRP HA 1 31 GLN H . . 4.310 4.112 4.033 4.209 . 0 0 "[ . 1 . 2]" 1
788 1 28 TRP HA 1 31 GLN HE22 . . 4.490 2.773 2.404 3.080 . 0 0 "[ . 1 . 2]" 1
789 1 28 TRP HA 1 31 GLN HG2 . . 5.150 5.111 4.954 5.165 0.015 3 0 "[ . 1 . 2]" 1
790 1 28 TRP HA 1 31 GLN HG3 . . 3.950 3.814 3.753 3.861 . 0 0 "[ . 1 . 2]" 1
791 1 28 TRP HA 1 32 LEU MD2 . . 5.140 4.177 4.051 4.256 . 0 0 "[ . 1 . 2]" 1
792 1 28 TRP HB2 1 28 TRP HD1 . . 3.840 2.721 2.710 2.730 . 0 0 "[ . 1 . 2]" 1
793 1 28 TRP HB2 1 28 TRP HE1 . . 5.270 4.809 4.805 4.812 . 0 0 "[ . 1 . 2]" 1
794 1 28 TRP HB2 1 29 LEU H . . 4.170 4.052 4.007 4.098 . 0 0 "[ . 1 . 2]" 1
795 1 28 TRP HB3 1 28 TRP HE3 . . 3.780 2.505 2.498 2.516 . 0 0 "[ . 1 . 2]" 1
796 1 28 TRP HB3 1 28 TRP HZ3 . . 5.200 4.903 4.897 4.912 . 0 0 "[ . 1 . 2]" 1
797 1 28 TRP HB3 1 29 LEU H . . 3.180 2.745 2.675 2.819 . 0 0 "[ . 1 . 2]" 1
798 1 28 TRP HB3 1 81 LEU QD . . 5.440 5.202 5.038 5.450 0.010 12 0 "[ . 1 . 2]" 1
799 1 28 TRP HD1 1 29 LEU H . . 5.500 5.506 5.475 5.522 0.022 19 0 "[ . 1 . 2]" 1
800 1 28 TRP HD1 1 84 VAL MG1 . . 3.590 2.687 2.292 3.087 . 0 0 "[ . 1 . 2]" 1
801 1 28 TRP HE1 1 32 LEU MD2 . . 3.760 3.149 3.089 3.259 . 0 0 "[ . 1 . 2]" 1
802 1 28 TRP HE1 1 32 LEU HG . . 5.500 5.487 5.449 5.505 0.005 2 0 "[ . 1 . 2]" 1
803 1 28 TRP HE1 1 80 GLU HB2 . . 4.540 4.063 3.787 4.192 . 0 0 "[ . 1 . 2]" 1
804 1 28 TRP HE1 1 80 GLU HB3 . . 3.700 2.603 2.517 2.670 . 0 0 "[ . 1 . 2]" 1
805 1 28 TRP HE1 1 80 GLU HG2 . . 5.480 5.463 5.335 5.505 0.025 12 0 "[ . 1 . 2]" 1
806 1 28 TRP HE1 1 80 GLU HG3 . . 5.030 4.836 4.734 4.974 . 0 0 "[ . 1 . 2]" 1
807 1 28 TRP HE1 1 81 LEU HA . . 4.740 4.232 4.036 4.464 . 0 0 "[ . 1 . 2]" 1
808 1 28 TRP HE1 1 84 VAL HB . . 4.910 4.627 4.407 4.822 . 0 0 "[ . 1 . 2]" 1
809 1 28 TRP HE1 1 84 VAL MG1 . . 3.500 2.001 1.841 2.250 . 0 0 "[ . 1 . 2]" 1
810 1 28 TRP HE1 1 84 VAL MG2 . . 3.770 3.145 2.735 3.492 . 0 0 "[ . 1 . 2]" 1
811 1 28 TRP HE3 1 29 LEU H . . 3.370 2.728 2.650 2.783 . 0 0 "[ . 1 . 2]" 1
812 1 28 TRP HE3 1 29 LEU HA . . 4.050 3.487 3.382 3.545 . 0 0 "[ . 1 . 2]" 1
813 1 28 TRP HE3 1 29 LEU HB2 . . 4.390 2.636 2.543 2.694 . 0 0 "[ . 1 . 2]" 1
814 1 28 TRP HE3 1 29 LEU HB3 . . 4.560 3.615 3.521 3.682 . 0 0 "[ . 1 . 2]" 1
815 1 28 TRP HE3 1 29 LEU MD1 . . 4.700 4.089 3.912 4.185 . 0 0 "[ . 1 . 2]" 1
816 1 28 TRP HE3 1 29 LEU MD2 . . 4.730 4.601 4.500 4.687 . 0 0 "[ . 1 . 2]" 1
817 1 28 TRP HE3 1 29 LEU HG . . 5.500 5.481 5.386 5.510 0.010 18 0 "[ . 1 . 2]" 1
818 1 28 TRP HE3 1 32 LEU MD1 . . 4.980 4.184 4.021 4.489 . 0 0 "[ . 1 . 2]" 1
819 1 28 TRP HE3 1 32 LEU MD2 . . 5.200 4.889 4.811 5.084 . 0 0 "[ . 1 . 2]" 1
820 1 28 TRP HE3 1 53 LEU MD1 . . 4.830 3.433 2.550 4.264 . 0 0 "[ . 1 . 2]" 1
821 1 28 TRP HE3 1 53 LEU QD . . 3.990 2.748 2.436 3.008 . 0 0 "[ . 1 . 2]" 1
822 1 28 TRP HE3 1 53 LEU MD2 . . 4.830 3.555 2.467 4.760 . 0 0 "[ . 1 . 2]" 1
823 1 28 TRP HE3 1 77 ILE HG12 . . 5.500 5.401 5.122 5.508 0.008 8 0 "[ . 1 . 2]" 1
824 1 28 TRP HE3 1 77 ILE MG . . 5.500 4.880 4.287 5.114 . 0 0 "[ . 1 . 2]" 1
825 1 28 TRP HH2 1 29 LEU MD1 . . 4.770 4.130 3.979 4.294 . 0 0 "[ . 1 . 2]" 1
826 1 28 TRP HH2 1 32 LEU MD1 . . 4.190 3.110 2.952 3.251 . 0 0 "[ . 1 . 2]" 1
827 1 28 TRP HH2 1 32 LEU MD2 . . 4.820 4.603 4.469 4.789 . 0 0 "[ . 1 . 2]" 1
828 1 28 TRP HH2 1 53 LEU MD1 . . 4.400 4.015 3.567 4.410 0.010 3 0 "[ . 1 . 2]" 1
829 1 28 TRP HH2 1 53 LEU QD . . 3.750 3.341 3.021 3.659 . 0 0 "[ . 1 . 2]" 1
830 1 28 TRP HH2 1 53 LEU MD2 . . 4.400 3.582 3.248 3.909 . 0 0 "[ . 1 . 2]" 1
831 1 28 TRP HH2 1 77 ILE HA . . 3.870 2.500 2.203 2.830 . 0 0 "[ . 1 . 2]" 1
832 1 28 TRP HH2 1 77 ILE MG . . 3.400 2.042 1.871 2.146 . 0 0 "[ . 1 . 2]" 1
833 1 28 TRP HH2 1 80 GLU HB2 . . 4.840 3.379 3.258 3.590 . 0 0 "[ . 1 . 2]" 1
834 1 28 TRP HH2 1 80 GLU HB3 . . 4.800 4.280 4.137 4.653 . 0 0 "[ . 1 . 2]" 1
835 1 28 TRP HH2 1 81 LEU H . . 3.770 3.308 3.116 3.505 . 0 0 "[ . 1 . 2]" 1
836 1 28 TRP HH2 1 81 LEU HA . . 4.370 3.919 3.636 4.201 . 0 0 "[ . 1 . 2]" 1
837 1 28 TRP HH2 1 81 LEU HB2 . . 4.540 2.980 2.237 3.589 . 0 0 "[ . 1 . 2]" 1
838 1 28 TRP HH2 1 81 LEU MD1 . . 4.490 2.424 2.098 2.906 . 0 0 "[ . 1 . 2]" 1
839 1 28 TRP HH2 1 81 LEU QD . . 3.620 2.395 2.090 2.800 . 0 0 "[ . 1 . 2]" 1
840 1 28 TRP HH2 1 81 LEU MD2 . . 4.490 3.910 3.648 4.391 . 0 0 "[ . 1 . 2]" 1
841 1 28 TRP HH2 1 81 LEU HG . . 5.270 3.788 2.001 5.057 . 0 0 "[ . 1 . 2]" 1
842 1 28 TRP HH2 1 84 VAL MG1 . . 5.500 5.506 5.492 5.515 0.015 3 0 "[ . 1 . 2]" 1
843 1 28 TRP HZ2 1 32 LEU MD1 . . 4.300 3.083 2.893 3.197 . 0 0 "[ . 1 . 2]" 1
844 1 28 TRP HZ2 1 32 LEU MD2 . . 3.660 3.433 3.333 3.601 . 0 0 "[ . 1 . 2]" 1
845 1 28 TRP HZ2 1 77 ILE HA . . 4.680 3.746 3.524 3.885 . 0 0 "[ . 1 . 2]" 1
846 1 28 TRP HZ2 1 77 ILE MG . . 4.230 4.170 3.867 4.239 0.009 19 0 "[ . 1 . 2]" 1
847 1 28 TRP HZ2 1 80 GLU H . . 4.830 4.111 3.971 4.245 . 0 0 "[ . 1 . 2]" 1
848 1 28 TRP HZ2 1 80 GLU HA . . 4.660 3.921 3.773 4.025 . 0 0 "[ . 1 . 2]" 1
849 1 28 TRP HZ2 1 80 GLU HB2 . . 3.710 2.113 1.997 2.321 . 0 0 "[ . 1 . 2]" 1
850 1 28 TRP HZ2 1 80 GLU HB3 . . 3.400 2.078 1.990 2.426 . 0 0 "[ . 1 . 2]" 1
851 1 28 TRP HZ2 1 80 GLU HG2 . . 4.670 4.532 4.434 4.673 0.003 2 0 "[ . 1 . 2]" 1
852 1 28 TRP HZ2 1 80 GLU HG3 . . 4.130 3.992 3.769 4.147 0.017 15 0 "[ . 1 . 2]" 1
853 1 28 TRP HZ2 1 81 LEU H . . 3.700 2.640 2.424 2.819 . 0 0 "[ . 1 . 2]" 1
854 1 28 TRP HZ2 1 81 LEU HA . . 3.560 2.880 2.602 3.162 . 0 0 "[ . 1 . 2]" 1
855 1 28 TRP HZ2 1 81 LEU HB2 . . 4.800 3.591 3.094 4.157 . 0 0 "[ . 1 . 2]" 1
856 1 28 TRP HZ2 1 81 LEU QD . . 4.560 3.365 3.050 3.743 . 0 0 "[ . 1 . 2]" 1
857 1 28 TRP HZ2 1 81 LEU HG . . 5.030 4.180 2.783 5.055 0.025 15 0 "[ . 1 . 2]" 1
858 1 28 TRP HZ2 1 84 VAL MG1 . . 4.160 3.717 3.635 3.803 . 0 0 "[ . 1 . 2]" 1
859 1 28 TRP HZ2 1 84 VAL MG2 . . 3.680 3.312 2.953 3.598 . 0 0 "[ . 1 . 2]" 1
860 1 28 TRP HZ3 1 29 LEU H . . 4.840 4.735 4.660 4.786 . 0 0 "[ . 1 . 2]" 1
861 1 28 TRP HZ3 1 29 LEU HA . . 4.730 4.138 4.028 4.216 . 0 0 "[ . 1 . 2]" 1
862 1 28 TRP HZ3 1 29 LEU HB2 . . 4.910 2.925 2.849 2.987 . 0 0 "[ . 1 . 2]" 1
863 1 28 TRP HZ3 1 29 LEU MD1 . . 4.520 3.223 2.960 3.472 . 0 0 "[ . 1 . 2]" 1
864 1 28 TRP HZ3 1 29 LEU MD2 . . 4.510 4.438 4.226 4.512 0.002 15 0 "[ . 1 . 2]" 1
865 1 28 TRP HZ3 1 32 LEU MD1 . . 4.890 3.620 3.440 3.932 . 0 0 "[ . 1 . 2]" 1
866 1 28 TRP HZ3 1 53 LEU MD1 . . 4.050 2.510 2.108 2.945 . 0 0 "[ . 1 . 2]" 1
867 1 28 TRP HZ3 1 53 LEU QD . . 3.410 2.216 1.893 2.556 . 0 0 "[ . 1 . 2]" 1
868 1 28 TRP HZ3 1 53 LEU MD2 . . 4.050 2.597 1.996 3.115 . 0 0 "[ . 1 . 2]" 1
869 1 28 TRP HZ3 1 77 ILE HA . . 4.820 4.030 3.762 4.321 . 0 0 "[ . 1 . 2]" 1
870 1 28 TRP HZ3 1 77 ILE MD . . 4.890 4.281 4.006 4.568 . 0 0 "[ . 1 . 2]" 1
871 1 28 TRP HZ3 1 77 ILE HG12 . . 4.490 3.521 3.093 3.792 . 0 0 "[ . 1 . 2]" 1
872 1 28 TRP HZ3 1 77 ILE HG13 . . 5.500 5.209 4.767 5.412 . 0 0 "[ . 1 . 2]" 1
873 1 28 TRP HZ3 1 77 ILE MG . . 3.740 2.793 2.149 3.056 . 0 0 "[ . 1 . 2]" 1
874 1 28 TRP HZ3 1 81 LEU HB2 . . 5.500 4.967 4.234 5.565 0.065 12 0 "[ . 1 . 2]" 1
875 1 28 TRP HZ3 1 81 LEU QD . . 4.580 2.911 2.666 3.195 . 0 0 "[ . 1 . 2]" 1
876 1 29 LEU H 1 29 LEU HB2 . . 3.010 2.780 2.712 2.840 . 0 0 "[ . 1 . 2]" 1
877 1 29 LEU H 1 29 LEU HB3 . . 3.080 2.298 2.259 2.346 . 0 0 "[ . 1 . 2]" 1
878 1 29 LEU H 1 29 LEU MD1 . . 4.390 4.299 4.223 4.346 . 0 0 "[ . 1 . 2]" 1
879 1 29 LEU H 1 29 LEU MD2 . . 4.150 4.070 4.016 4.129 . 0 0 "[ . 1 . 2]" 1
880 1 29 LEU H 1 29 LEU HG . . 4.340 4.324 4.281 4.371 0.031 12 0 "[ . 1 . 2]" 1
881 1 29 LEU H 1 30 GLU H . . 3.250 2.465 2.437 2.483 . 0 0 "[ . 1 . 2]" 1
882 1 29 LEU H 1 30 GLU HB2 . . 4.970 4.410 4.369 4.465 . 0 0 "[ . 1 . 2]" 1
883 1 29 LEU H 1 30 GLU HG3 . . 4.940 4.811 4.682 4.941 0.001 19 0 "[ . 1 . 2]" 1
884 1 29 LEU H 1 31 GLN H . . 4.620 4.085 4.039 4.148 . 0 0 "[ . 1 . 2]" 1
885 1 29 LEU H 1 32 LEU MD1 . . 5.030 4.765 4.651 5.018 . 0 0 "[ . 1 . 2]" 1
886 1 29 LEU H 1 32 LEU HG . . 5.330 4.611 4.564 4.679 . 0 0 "[ . 1 . 2]" 1
887 1 29 LEU H 1 36 ALA MB . . 5.220 4.923 4.799 5.034 . 0 0 "[ . 1 . 2]" 1
888 1 29 LEU HA 1 29 LEU MD1 . . 3.160 2.461 2.207 2.651 . 0 0 "[ . 1 . 2]" 1
889 1 29 LEU HA 1 29 LEU MD2 . . 4.180 3.994 3.976 4.012 . 0 0 "[ . 1 . 2]" 1
890 1 29 LEU HA 1 29 LEU HG . . 3.930 3.098 3.051 3.176 . 0 0 "[ . 1 . 2]" 1
891 1 29 LEU HA 1 31 GLN H . . 4.310 3.335 3.312 3.371 . 0 0 "[ . 1 . 2]" 1
892 1 29 LEU HA 1 32 LEU H . . 3.760 3.317 3.287 3.349 . 0 0 "[ . 1 . 2]" 1
893 1 29 LEU HA 1 32 LEU HA . . 5.500 5.478 5.449 5.502 0.002 18 0 "[ . 1 . 2]" 1
894 1 29 LEU HA 1 32 LEU HB2 . . 4.510 3.983 3.894 4.068 . 0 0 "[ . 1 . 2]" 1
895 1 29 LEU HA 1 32 LEU HB3 . . 4.960 4.875 4.822 4.936 . 0 0 "[ . 1 . 2]" 1
896 1 29 LEU HA 1 32 LEU MD1 . . 3.260 2.480 2.289 2.752 . 0 0 "[ . 1 . 2]" 1
897 1 29 LEU HA 1 32 LEU MD2 . . 4.130 3.175 3.051 3.265 . 0 0 "[ . 1 . 2]" 1
898 1 29 LEU HA 1 32 LEU HG . . 3.200 2.004 1.996 2.043 . 0 0 "[ . 1 . 2]" 1
899 1 29 LEU HA 1 33 GLY H . . 5.370 5.210 5.116 5.314 . 0 0 "[ . 1 . 2]" 1
900 1 29 LEU HA 1 36 ALA MB . . 4.240 3.933 3.852 4.043 . 0 0 "[ . 1 . 2]" 1
901 1 29 LEU HA 1 76 VAL MG1 . . 5.270 4.983 4.749 5.261 . 0 0 "[ . 1 . 2]" 1
902 1 29 LEU HB2 1 29 LEU MD1 . . 3.350 2.192 2.058 2.294 . 0 0 "[ . 1 . 2]" 1
903 1 29 LEU HB2 1 29 LEU MD2 . . 3.650 2.605 2.542 2.661 . 0 0 "[ . 1 . 2]" 1
904 1 29 LEU HB2 1 30 GLU H . . 4.340 4.167 4.141 4.215 . 0 0 "[ . 1 . 2]" 1
905 1 29 LEU HB2 1 31 GLN H . . 5.500 5.274 5.263 5.297 . 0 0 "[ . 1 . 2]" 1
906 1 29 LEU HB2 1 32 LEU HG . . 5.340 4.248 4.176 4.308 . 0 0 "[ . 1 . 2]" 1
907 1 29 LEU HB2 1 36 ALA MB . . 4.830 4.374 4.229 4.549 . 0 0 "[ . 1 . 2]" 1
908 1 29 LEU HB2 1 77 ILE MG . . 5.250 4.541 3.885 4.735 . 0 0 "[ . 1 . 2]" 1
909 1 29 LEU HB3 1 29 LEU MD2 . . 3.420 2.068 2.015 2.176 . 0 0 "[ . 1 . 2]" 1
910 1 29 LEU HB3 1 30 GLU H . . 3.260 2.986 2.944 3.053 . 0 0 "[ . 1 . 2]" 1
911 1 29 LEU HB3 1 30 GLU HA . . 4.700 4.551 4.492 4.616 . 0 0 "[ . 1 . 2]" 1
912 1 29 LEU HB3 1 30 GLU HG3 . . 5.040 4.102 3.906 4.286 . 0 0 "[ . 1 . 2]" 1
913 1 29 LEU HB3 1 31 GLN H . . 5.070 4.840 4.814 4.886 . 0 0 "[ . 1 . 2]" 1
914 1 29 LEU HB3 1 32 LEU HG . . 5.500 4.885 4.831 4.937 . 0 0 "[ . 1 . 2]" 1
915 1 29 LEU HB3 1 36 ALA MB . . 4.050 3.694 3.485 3.918 . 0 0 "[ . 1 . 2]" 1
916 1 29 LEU MD1 1 30 GLU H . . 4.950 4.715 4.623 4.765 . 0 0 "[ . 1 . 2]" 1
917 1 29 LEU MD1 1 30 GLU HA . . 5.050 4.833 4.691 4.960 . 0 0 "[ . 1 . 2]" 1
918 1 29 LEU MD1 1 32 LEU H . . 4.370 4.354 4.218 4.386 0.016 18 0 "[ . 1 . 2]" 1
919 1 29 LEU MD1 1 32 LEU MD1 . . 3.350 2.122 1.971 2.267 . 0 0 "[ . 1 . 2]" 1
920 1 29 LEU MD1 1 32 LEU HG . . 3.520 3.061 2.883 3.205 . 0 0 "[ . 1 . 2]" 1
921 1 29 LEU MD1 1 35 TRP HH2 . . 3.920 2.596 2.201 2.946 . 0 0 "[ . 1 . 2]" 1
922 1 29 LEU MD1 1 35 TRP HZ3 . . 4.470 2.036 1.963 2.364 . 0 0 "[ . 1 . 2]" 1
923 1 29 LEU MD1 1 36 ALA HA . . 3.630 3.422 3.116 3.581 . 0 0 "[ . 1 . 2]" 1
924 1 29 LEU MD1 1 36 ALA MB . . 3.830 2.893 2.512 3.061 . 0 0 "[ . 1 . 2]" 1
925 1 29 LEU MD1 1 39 TYR HB2 . . 4.200 4.003 3.817 4.200 0.000 11 0 "[ . 1 . 2]" 1
926 1 29 LEU MD1 1 39 TYR HB3 . . 5.500 4.935 4.675 5.182 . 0 0 "[ . 1 . 2]" 1
927 1 29 LEU MD1 1 43 PHE QE . . 4.070 3.565 3.259 3.815 . 0 0 "[ . 1 . 2]" 1
928 1 29 LEU MD1 1 43 PHE HZ . . 3.930 3.166 2.818 3.421 . 0 0 "[ . 1 . 2]" 1
929 1 29 LEU MD1 1 53 LEU QD . . 5.440 3.936 3.593 4.200 . 0 0 "[ . 1 . 2]" 1
930 1 29 LEU MD1 1 77 ILE H . . 5.270 4.466 4.189 4.629 . 0 0 "[ . 1 . 2]" 1
931 1 29 LEU MD1 1 77 ILE HA . . 5.000 3.535 3.442 3.633 . 0 0 "[ . 1 . 2]" 1
932 1 29 LEU MD1 1 77 ILE HG12 . . 3.230 1.913 1.835 1.970 . 0 0 "[ . 1 . 2]" 1
933 1 29 LEU MD1 1 77 ILE HG13 . . 4.250 2.761 2.603 2.898 . 0 0 "[ . 1 . 2]" 1
934 1 29 LEU MD1 1 77 ILE MG . . 3.850 3.259 2.771 3.479 . 0 0 "[ . 1 . 2]" 1
935 1 29 LEU MD1 1 80 GLU HG3 . . 5.500 5.414 5.215 5.506 0.006 5 0 "[ . 1 . 2]" 1
936 1 29 LEU MD2 1 30 GLU H . . 4.590 4.247 4.091 4.398 . 0 0 "[ . 1 . 2]" 1
937 1 29 LEU MD2 1 30 GLU HA . . 5.500 4.440 4.327 4.641 . 0 0 "[ . 1 . 2]" 1
938 1 29 LEU MD2 1 30 GLU HG2 . . 5.160 4.534 4.268 4.830 . 0 0 "[ . 1 . 2]" 1
939 1 29 LEU MD2 1 30 GLU HG3 . . 5.020 4.051 3.636 4.348 . 0 0 "[ . 1 . 2]" 1
940 1 29 LEU MD2 1 36 ALA HA . . 4.280 3.104 2.848 3.362 . 0 0 "[ . 1 . 2]" 1
941 1 29 LEU MD2 1 36 ALA MB . . 4.090 2.666 2.408 2.827 . 0 0 "[ . 1 . 2]" 1
942 1 29 LEU MD2 1 39 TYR H . . 4.580 4.020 3.918 4.194 . 0 0 "[ . 1 . 2]" 1
943 1 29 LEU MD2 1 39 TYR HA . . 5.080 5.007 4.910 5.082 0.002 7 0 "[ . 1 . 2]" 1
944 1 29 LEU MD2 1 39 TYR HB2 . . 3.760 2.651 2.466 2.777 . 0 0 "[ . 1 . 2]" 1
945 1 29 LEU MD2 1 39 TYR HB3 . . 4.030 3.667 3.483 3.951 . 0 0 "[ . 1 . 2]" 1
946 1 29 LEU MD2 1 39 TYR QD . . 4.380 3.876 3.717 4.106 . 0 0 "[ . 1 . 2]" 1
947 1 29 LEU MD2 1 40 ARG H . . 3.900 3.336 3.022 3.676 . 0 0 "[ . 1 . 2]" 1
948 1 29 LEU MD2 1 40 ARG HA . . 3.380 3.080 2.847 3.372 . 0 0 "[ . 1 . 2]" 1
949 1 29 LEU MD2 1 40 ARG HB2 . . 4.770 4.273 3.960 4.728 . 0 0 "[ . 1 . 2]" 1
950 1 29 LEU MD2 1 40 ARG HB3 . . 4.490 3.638 3.216 3.990 . 0 0 "[ . 1 . 2]" 1
951 1 29 LEU MD2 1 43 PHE H . . 4.970 4.889 4.755 4.979 0.009 20 0 "[ . 1 . 2]" 1
952 1 29 LEU MD2 1 43 PHE HB2 . . 4.380 4.058 3.880 4.275 . 0 0 "[ . 1 . 2]" 1
953 1 29 LEU MD2 1 43 PHE HB3 . . 5.030 4.552 4.310 4.907 . 0 0 "[ . 1 . 2]" 1
954 1 29 LEU MD2 1 43 PHE QD . . 4.140 3.193 2.993 3.533 . 0 0 "[ . 1 . 2]" 1
955 1 29 LEU MD2 1 43 PHE QE . . 3.980 2.514 2.125 2.945 . 0 0 "[ . 1 . 2]" 1
956 1 29 LEU MD2 1 43 PHE HZ . . 3.990 2.586 2.324 3.075 . 0 0 "[ . 1 . 2]" 1
957 1 29 LEU MD2 1 53 LEU QD . . 5.440 4.079 3.757 4.454 . 0 0 "[ . 1 . 2]" 1
958 1 29 LEU HG 1 30 GLU H . . 4.130 3.831 3.731 3.948 . 0 0 "[ . 1 . 2]" 1
959 1 29 LEU HG 1 30 GLU HA . . 4.640 3.567 3.484 3.688 . 0 0 "[ . 1 . 2]" 1
960 1 29 LEU HG 1 32 LEU H . . 5.070 4.761 4.642 4.879 . 0 0 "[ . 1 . 2]" 1
961 1 29 LEU HG 1 36 ALA HA . . 4.450 3.268 3.111 3.409 . 0 0 "[ . 1 . 2]" 1
962 1 29 LEU HG 1 36 ALA MB . . 3.460 1.920 1.805 2.119 . 0 0 "[ . 1 . 2]" 1
963 1 30 GLU H 1 30 GLU HB2 . . 2.950 2.208 2.183 2.243 . 0 0 "[ . 1 . 2]" 1
964 1 30 GLU H 1 30 GLU HB3 . . 3.580 3.505 3.484 3.530 . 0 0 "[ . 1 . 2]" 1
965 1 30 GLU H 1 30 GLU HG2 . . 3.930 3.856 3.669 3.934 0.004 2 0 "[ . 1 . 2]" 1
966 1 30 GLU H 1 30 GLU HG3 . . 3.130 3.010 2.825 3.136 0.006 13 0 "[ . 1 . 2]" 1
967 1 30 GLU H 1 31 GLN H . . 3.090 2.676 2.631 2.713 . 0 0 "[ . 1 . 2]" 1
968 1 30 GLU H 1 31 GLN HA . . 5.100 5.098 5.073 5.111 0.011 19 0 "[ . 1 . 2]" 1
969 1 30 GLU H 1 32 LEU H . . 4.570 4.332 4.287 4.371 . 0 0 "[ . 1 . 2]" 1
970 1 30 GLU H 1 32 LEU HG . . 4.780 4.601 4.566 4.711 . 0 0 "[ . 1 . 2]" 1
971 1 30 GLU H 1 36 ALA MB . . 4.100 3.657 3.557 3.759 . 0 0 "[ . 1 . 2]" 1
972 1 30 GLU HA 1 30 GLU HG2 . . 3.250 2.263 2.177 2.437 . 0 0 "[ . 1 . 2]" 1
973 1 30 GLU HA 1 30 GLU HG3 . . 3.630 3.000 2.829 3.166 . 0 0 "[ . 1 . 2]" 1
974 1 30 GLU HA 1 31 GLN HA . . 4.780 4.527 4.501 4.550 . 0 0 "[ . 1 . 2]" 1
975 1 30 GLU HA 1 32 LEU H . . 4.310 4.199 4.080 4.291 . 0 0 "[ . 1 . 2]" 1
976 1 30 GLU HA 1 33 GLY H . . 4.620 4.013 3.913 4.111 . 0 0 "[ . 1 . 2]" 1
977 1 30 GLU HA 1 36 ALA H . . 4.720 4.408 4.260 4.502 . 0 0 "[ . 1 . 2]" 1
978 1 30 GLU HA 1 36 ALA MB . . 3.000 1.937 1.803 2.009 . 0 0 "[ . 1 . 2]" 1
979 1 30 GLU HA 1 37 SER H . . 4.890 4.496 4.175 4.717 . 0 0 "[ . 1 . 2]" 1
980 1 30 GLU HB2 1 31 GLN H . . 4.190 3.798 3.725 3.880 . 0 0 "[ . 1 . 2]" 1
981 1 30 GLU HB2 1 36 ALA MB . . 4.760 4.211 4.100 4.280 . 0 0 "[ . 1 . 2]" 1
982 1 30 GLU HB3 1 31 GLN H . . 4.290 4.162 4.125 4.204 . 0 0 "[ . 1 . 2]" 1
983 1 30 GLU HB3 1 31 GLN HA . . 4.730 4.470 4.438 4.505 . 0 0 "[ . 1 . 2]" 1
984 1 30 GLU HB3 1 36 ALA MB . . 4.740 3.969 3.776 4.065 . 0 0 "[ . 1 . 2]" 1
985 1 30 GLU HG2 1 31 GLN H . . 5.470 5.173 5.084 5.307 . 0 0 "[ . 1 . 2]" 1
986 1 30 GLU HG2 1 36 ALA MB . . 4.020 2.699 2.542 2.800 . 0 0 "[ . 1 . 2]" 1
987 1 30 GLU HG2 1 37 SER H . . 4.930 4.028 3.729 4.301 . 0 0 "[ . 1 . 2]" 1
988 1 30 GLU HG2 1 37 SER HA . . 4.150 3.586 3.274 3.754 . 0 0 "[ . 1 . 2]" 1
989 1 30 GLU HG2 1 37 SER QB . . 5.340 3.901 3.686 4.083 . 0 0 "[ . 1 . 2]" 1
990 1 30 GLU HG2 1 40 ARG HD2 . . 4.980 3.660 2.954 4.478 . 0 0 "[ . 1 . 2]" 1
991 1 30 GLU HG3 1 31 GLN H . . 5.290 5.134 4.956 5.263 . 0 0 "[ . 1 . 2]" 1
992 1 30 GLU HG3 1 36 ALA MB . . 4.430 3.357 3.028 3.565 . 0 0 "[ . 1 . 2]" 1
993 1 30 GLU HG3 1 37 SER HA . . 5.070 4.574 4.396 4.843 . 0 0 "[ . 1 . 2]" 1
994 1 30 GLU HG3 1 40 ARG HD2 . . 5.000 3.971 3.383 4.566 . 0 0 "[ . 1 . 2]" 1
995 1 31 GLN H 1 31 GLN HB2 . . 2.750 2.421 2.383 2.475 . 0 0 "[ . 1 . 2]" 1
996 1 31 GLN H 1 31 GLN HE21 . . 5.230 4.002 3.835 4.152 . 0 0 "[ . 1 . 2]" 1
997 1 31 GLN H 1 31 GLN HG2 . . 4.260 4.251 4.205 4.273 0.013 20 0 "[ . 1 . 2]" 1
998 1 31 GLN H 1 31 GLN HG3 . . 3.230 3.194 3.081 3.234 0.004 13 0 "[ . 1 . 2]" 1
999 1 31 GLN H 1 32 LEU H . . 2.880 1.961 1.891 2.016 . 0 0 "[ . 1 . 2]" 1
1000 1 31 GLN H 1 32 LEU HA . . 4.810 4.645 4.582 4.690 . 0 0 "[ . 1 . 2]" 1
1001 1 31 GLN H 1 32 LEU HB3 . . 5.500 5.462 5.390 5.510 0.010 18 0 "[ . 1 . 2]" 1
1002 1 31 GLN H 1 32 LEU MD2 . . 4.710 3.493 3.375 3.589 . 0 0 "[ . 1 . 2]" 1
1003 1 31 GLN H 1 32 LEU HG . . 3.980 3.116 3.050 3.234 . 0 0 "[ . 1 . 2]" 1
1004 1 31 GLN H 1 33 GLY H . . 4.330 3.682 3.629 3.749 . 0 0 "[ . 1 . 2]" 1
1005 1 31 GLN H 1 36 ALA MB . . 4.430 3.871 3.728 3.944 . 0 0 "[ . 1 . 2]" 1
1006 1 31 GLN HA 1 31 GLN HG2 . . 3.410 2.515 2.440 2.620 . 0 0 "[ . 1 . 2]" 1
1007 1 31 GLN HA 1 31 GLN HG3 . . 3.740 2.803 2.712 2.913 . 0 0 "[ . 1 . 2]" 1
1008 1 31 GLN HA 1 32 LEU H . . 3.560 3.467 3.434 3.487 . 0 0 "[ . 1 . 2]" 1
1009 1 31 GLN HA 1 32 LEU MD2 . . 5.500 4.746 4.675 4.856 . 0 0 "[ . 1 . 2]" 1
1010 1 31 GLN HA 1 33 GLY H . . 4.180 3.836 3.714 3.939 . 0 0 "[ . 1 . 2]" 1
1011 1 31 GLN HB2 1 31 GLN HE22 . . 4.890 3.758 3.739 3.798 . 0 0 "[ . 1 . 2]" 1
1012 1 31 GLN HB2 1 32 LEU H . . 3.610 3.022 2.953 3.140 . 0 0 "[ . 1 . 2]" 1
1013 1 31 GLN HB2 1 32 LEU HA . . 4.990 4.549 4.460 4.598 . 0 0 "[ . 1 . 2]" 1
1014 1 31 GLN HB2 1 32 LEU MD2 . . 4.250 3.031 2.923 3.126 . 0 0 "[ . 1 . 2]" 1
1015 1 31 GLN HB2 1 33 GLY H . . 5.500 5.128 5.037 5.210 . 0 0 "[ . 1 . 2]" 1
1016 1 31 GLN HB3 1 32 LEU HA . . 5.340 4.312 4.254 4.370 . 0 0 "[ . 1 . 2]" 1
1017 1 31 GLN HB3 1 33 GLY H . . 5.500 5.239 5.129 5.359 . 0 0 "[ . 1 . 2]" 1
1018 1 31 GLN HE21 1 32 LEU H . . 5.500 5.399 5.274 5.465 . 0 0 "[ . 1 . 2]" 1
1019 1 31 GLN HE21 1 32 LEU MD2 . . 5.120 4.853 4.690 4.973 . 0 0 "[ . 1 . 2]" 1
1020 1 31 GLN HE22 1 31 GLN HG3 . . 3.990 3.502 3.479 3.530 . 0 0 "[ . 1 . 2]" 1
1021 1 31 GLN HE22 1 32 LEU MD2 . . 5.500 5.510 5.500 5.521 0.021 19 0 "[ . 1 . 2]" 1
1022 1 31 GLN HG2 1 32 LEU H . . 5.300 5.212 5.178 5.254 . 0 0 "[ . 1 . 2]" 1
1023 1 31 GLN HG3 1 32 LEU H . . 4.700 4.679 4.588 4.713 0.013 19 0 "[ . 1 . 2]" 1
1024 1 32 LEU H 1 32 LEU HB2 . . 3.480 2.803 2.775 2.828 . 0 0 "[ . 1 . 2]" 1
1025 1 32 LEU H 1 32 LEU HB3 . . 3.730 3.554 3.544 3.573 . 0 0 "[ . 1 . 2]" 1
1026 1 32 LEU H 1 32 LEU MD1 . . 4.360 3.619 3.595 3.658 . 0 0 "[ . 1 . 2]" 1
1027 1 32 LEU H 1 32 LEU MD2 . . 3.480 2.536 2.438 2.697 . 0 0 "[ . 1 . 2]" 1
1028 1 32 LEU H 1 32 LEU HG . . 2.670 1.948 1.911 2.012 . 0 0 "[ . 1 . 2]" 1
1029 1 32 LEU H 1 33 GLY H . . 2.910 2.603 2.492 2.659 . 0 0 "[ . 1 . 2]" 1
1030 1 32 LEU H 1 35 TRP HH2 . . 5.500 5.414 5.206 5.505 0.005 11 0 "[ . 1 . 2]" 1
1031 1 32 LEU H 1 36 ALA MB . . 4.120 3.920 3.837 4.022 . 0 0 "[ . 1 . 2]" 1
1032 1 32 LEU HA 1 32 LEU MD1 . . 4.310 3.865 3.809 3.891 . 0 0 "[ . 1 . 2]" 1
1033 1 32 LEU HA 1 32 LEU MD2 . . 2.760 2.009 1.975 2.064 . 0 0 "[ . 1 . 2]" 1
1034 1 32 LEU HA 1 32 LEU HG . . 4.020 3.510 3.477 3.538 . 0 0 "[ . 1 . 2]" 1
1035 1 32 LEU HA 1 35 TRP HZ2 . . 5.500 5.043 4.860 5.124 . 0 0 "[ . 1 . 2]" 1
1036 1 32 LEU HB2 1 32 LEU MD1 . . 3.430 2.379 2.307 2.506 . 0 0 "[ . 1 . 2]" 1
1037 1 32 LEU HB2 1 33 GLY H . . 3.320 2.958 2.890 3.042 . 0 0 "[ . 1 . 2]" 1
1038 1 32 LEU HB2 1 35 TRP HH2 . . 3.960 2.902 2.736 2.999 . 0 0 "[ . 1 . 2]" 1
1039 1 32 LEU HB2 1 35 TRP HZ2 . . 4.400 3.010 2.913 3.105 . 0 0 "[ . 1 . 2]" 1
1040 1 32 LEU HB2 1 35 TRP HZ3 . . 5.380 4.523 4.392 4.631 . 0 0 "[ . 1 . 2]" 1
1041 1 32 LEU HB2 1 36 ALA H . . 5.500 5.450 5.416 5.497 . 0 0 "[ . 1 . 2]" 1
1042 1 32 LEU HB2 1 36 ALA MB . . 3.820 3.725 3.614 3.823 0.003 10 0 "[ . 1 . 2]" 1
1043 1 32 LEU HB3 1 32 LEU MD1 . . 3.350 2.304 2.171 2.376 . 0 0 "[ . 1 . 2]" 1
1044 1 32 LEU HB3 1 32 LEU MD2 . . 3.130 2.463 2.416 2.516 . 0 0 "[ . 1 . 2]" 1
1045 1 32 LEU HB3 1 33 GLY H . . 4.280 4.128 4.083 4.186 . 0 0 "[ . 1 . 2]" 1
1046 1 32 LEU HB3 1 35 TRP HE1 . . 5.500 5.503 5.491 5.511 0.011 3 0 "[ . 1 . 2]" 1
1047 1 32 LEU HB3 1 35 TRP HH2 . . 4.280 3.809 3.559 3.967 . 0 0 "[ . 1 . 2]" 1
1048 1 32 LEU HB3 1 35 TRP HZ2 . . 3.860 3.363 3.258 3.445 . 0 0 "[ . 1 . 2]" 1
1049 1 32 LEU HB3 1 36 ALA MB . . 5.350 5.260 5.151 5.350 . 0 0 "[ . 1 . 2]" 1
1050 1 32 LEU HB3 1 76 VAL MG1 . . 3.080 1.908 1.853 2.094 . 0 0 "[ . 1 . 2]" 1
1051 1 32 LEU HB3 1 77 ILE HA . . 5.270 5.081 4.798 5.218 . 0 0 "[ . 1 . 2]" 1
1052 1 32 LEU MD1 1 33 GLY H . . 4.810 4.743 4.674 4.813 0.003 18 0 "[ . 1 . 2]" 1
1053 1 32 LEU MD1 1 35 TRP HH2 . . 3.610 2.561 2.358 2.832 . 0 0 "[ . 1 . 2]" 1
1054 1 32 LEU MD1 1 35 TRP HZ2 . . 4.510 3.751 3.633 3.940 . 0 0 "[ . 1 . 2]" 1
1055 1 32 LEU MD1 1 35 TRP HZ3 . . 4.720 4.174 3.931 4.304 . 0 0 "[ . 1 . 2]" 1
1056 1 32 LEU MD1 1 36 ALA MB . . 4.480 4.241 4.161 4.332 . 0 0 "[ . 1 . 2]" 1
1057 1 32 LEU MD1 1 76 VAL MG1 . . 3.190 1.918 1.783 2.040 . 0 0 "[ . 1 . 2]" 1
1058 1 32 LEU MD1 1 77 ILE H . . 4.630 3.645 3.242 3.783 . 0 0 "[ . 1 . 2]" 1
1059 1 32 LEU MD1 1 77 ILE HA . . 3.340 2.379 2.105 2.490 . 0 0 "[ . 1 . 2]" 1
1060 1 32 LEU MD1 1 77 ILE MD . . 4.120 4.022 3.852 4.120 0.000 6 0 "[ . 1 . 2]" 1
1061 1 32 LEU MD1 1 77 ILE HG12 . . 3.200 2.901 2.536 3.087 . 0 0 "[ . 1 . 2]" 1
1062 1 32 LEU MD1 1 77 ILE HG13 . . 3.710 3.164 2.931 3.489 . 0 0 "[ . 1 . 2]" 1
1063 1 32 LEU MD1 1 77 ILE MG . . 3.990 3.683 3.296 3.834 . 0 0 "[ . 1 . 2]" 1
1064 1 32 LEU MD1 1 80 GLU HB2 . . 4.160 2.417 2.172 2.702 . 0 0 "[ . 1 . 2]" 1
1065 1 32 LEU MD1 1 80 GLU HG2 . . 4.940 3.493 3.382 3.697 . 0 0 "[ . 1 . 2]" 1
1066 1 32 LEU MD1 1 80 GLU HG3 . . 4.140 2.048 1.961 2.324 . 0 0 "[ . 1 . 2]" 1
1067 1 32 LEU MD2 1 33 GLY H . . 4.530 4.344 4.297 4.395 . 0 0 "[ . 1 . 2]" 1
1068 1 32 LEU MD2 1 35 TRP HH2 . . 5.080 5.008 4.883 5.082 0.002 1 0 "[ . 1 . 2]" 1
1069 1 32 LEU MD2 1 76 VAL MG1 . . 3.370 3.231 3.139 3.370 . 13 0 "[ . 1 . 2]" 1
1070 1 32 LEU MD2 1 77 ILE HA . . 4.580 4.383 4.102 4.491 . 0 0 "[ . 1 . 2]" 1
1071 1 32 LEU MD2 1 80 GLU H . . 4.880 4.808 4.541 4.887 0.007 3 0 "[ . 1 . 2]" 1
1072 1 32 LEU MD2 1 80 GLU HA . . 4.590 4.440 4.153 4.596 0.006 4 0 "[ . 1 . 2]" 1
1073 1 32 LEU MD2 1 80 GLU HB2 . . 3.480 2.989 2.677 3.113 . 0 0 "[ . 1 . 2]" 1
1074 1 32 LEU MD2 1 80 GLU HB3 . . 3.910 2.481 2.144 2.707 . 0 0 "[ . 1 . 2]" 1
1075 1 32 LEU MD2 1 80 GLU HG2 . . 3.550 3.506 3.302 3.561 0.011 11 0 "[ . 1 . 2]" 1
1076 1 32 LEU MD2 1 80 GLU HG3 . . 3.030 2.155 1.983 2.289 . 0 0 "[ . 1 . 2]" 1
1077 1 32 LEU MD2 1 81 LEU H . . 5.370 5.204 4.848 5.357 . 0 0 "[ . 1 . 2]" 1
1078 1 32 LEU HG 1 33 GLY H . . 5.100 3.946 3.874 4.026 . 0 0 "[ . 1 . 2]" 1
1079 1 33 GLY H 1 34 PRO HA . . 4.950 4.899 4.886 4.908 . 0 0 "[ . 1 . 2]" 1
1080 1 33 GLY H 1 34 PRO HD2 . . 5.330 4.805 4.804 4.805 . 0 0 "[ . 1 . 2]" 1
1081 1 33 GLY H 1 34 PRO HD3 . . 5.500 4.818 4.798 4.835 . 0 0 "[ . 1 . 2]" 1
1082 1 33 GLY H 1 36 ALA H . . 4.180 4.185 4.165 4.195 0.015 19 0 "[ . 1 . 2]" 1
1083 1 33 GLY H 1 36 ALA MB . . 3.480 3.173 3.105 3.224 . 0 0 "[ . 1 . 2]" 1
1084 1 33 GLY QA 1 34 PRO HD2 . . 3.160 2.237 2.235 2.239 . 0 0 "[ . 1 . 2]" 1
1085 1 33 GLY QA 1 34 PRO HG3 . . 4.980 4.252 4.247 4.255 . 0 0 "[ . 1 . 2]" 1
1086 1 33 GLY QA 1 35 TRP H . . 3.620 3.134 3.058 3.180 . 0 0 "[ . 1 . 2]" 1
1087 1 33 GLY QA 1 35 TRP HD1 . . 4.370 3.704 3.538 3.776 . 0 0 "[ . 1 . 2]" 1
1088 1 33 GLY QA 1 35 TRP HE1 . . 3.550 2.883 2.577 2.963 . 0 0 "[ . 1 . 2]" 1
1089 1 33 GLY QA 1 35 TRP HZ2 . . 4.640 3.728 3.515 3.846 . 0 0 "[ . 1 . 2]" 1
1090 1 33 GLY QA 1 36 ALA H . . 4.870 3.791 3.766 3.838 . 0 0 "[ . 1 . 2]" 1
1091 1 33 GLY HA2 1 34 PRO HG2 . . 4.950 4.631 4.605 4.650 . 0 0 "[ . 1 . 2]" 1
1092 1 33 GLY HA2 1 35 TRP H . . 4.180 4.139 4.055 4.183 0.003 15 0 "[ . 1 . 2]" 1
1093 1 33 GLY HA2 1 35 TRP HD1 . . 5.200 5.075 4.844 5.168 . 0 0 "[ . 1 . 2]" 1
1094 1 33 GLY HA2 1 35 TRP HZ2 . . 5.500 5.315 5.052 5.452 . 0 0 "[ . 1 . 2]" 1
1095 1 33 GLY HA3 1 34 PRO HG2 . . 4.950 4.502 4.484 4.527 . 0 0 "[ . 1 . 2]" 1
1096 1 33 GLY HA3 1 35 TRP H . . 4.180 3.245 3.164 3.296 . 0 0 "[ . 1 . 2]" 1
1097 1 33 GLY HA3 1 35 TRP HD1 . . 5.200 3.806 3.637 3.882 . 0 0 "[ . 1 . 2]" 1
1098 1 33 GLY HA3 1 35 TRP HZ2 . . 5.500 3.807 3.586 3.931 . 0 0 "[ . 1 . 2]" 1
1099 1 34 PRO HA 1 36 ALA H . . 4.100 3.655 3.623 3.678 . 0 0 "[ . 1 . 2]" 1
1100 1 34 PRO HA 1 36 ALA MB . . 4.740 4.004 3.955 4.089 . 0 0 "[ . 1 . 2]" 1
1101 1 34 PRO HA 1 37 SER H . . 4.420 4.010 3.927 4.160 . 0 0 "[ . 1 . 2]" 1
1102 1 34 PRO HA 1 37 SER HB2 . . 5.500 4.619 4.149 5.127 . 0 0 "[ . 1 . 2]" 1
1103 1 34 PRO HA 1 37 SER HB3 . . 5.500 5.036 4.486 5.454 . 0 0 "[ . 1 . 2]" 1
1104 1 34 PRO HB2 1 35 TRP H . . 3.730 3.515 3.461 3.607 . 0 0 "[ . 1 . 2]" 1
1105 1 34 PRO HB2 1 35 TRP HA . . 4.740 4.142 4.120 4.182 . 0 0 "[ . 1 . 2]" 1
1106 1 34 PRO HB2 1 36 ALA H . . 5.270 4.999 4.973 5.024 . 0 0 "[ . 1 . 2]" 1
1107 1 34 PRO HB3 1 35 TRP H . . 4.470 4.246 4.214 4.299 . 0 0 "[ . 1 . 2]" 1
1108 1 34 PRO HB3 1 36 ALA H . . 5.500 5.504 5.484 5.510 0.010 11 0 "[ . 1 . 2]" 1
1109 1 34 PRO HD2 1 35 TRP H . . 3.370 2.677 2.661 2.712 . 0 0 "[ . 1 . 2]" 1
1110 1 34 PRO HD2 1 35 TRP HD1 . . 4.150 3.208 2.881 3.282 . 0 0 "[ . 1 . 2]" 1
1111 1 34 PRO HD2 1 35 TRP HE1 . . 4.260 3.858 3.444 3.964 . 0 0 "[ . 1 . 2]" 1
1112 1 34 PRO HD2 1 36 ALA H . . 4.810 4.680 4.639 4.742 . 0 0 "[ . 1 . 2]" 1
1113 1 34 PRO HG2 1 35 TRP H . . 3.400 2.609 2.535 2.742 . 0 0 "[ . 1 . 2]" 1
1114 1 34 PRO HG2 1 35 TRP HA . . 4.480 4.232 4.204 4.275 . 0 0 "[ . 1 . 2]" 1
1115 1 34 PRO HG2 1 35 TRP HB3 . . 4.930 3.945 3.900 4.063 . 0 0 "[ . 1 . 2]" 1
1116 1 34 PRO HG2 1 35 TRP HD1 . . 4.120 3.576 3.211 3.667 . 0 0 "[ . 1 . 2]" 1
1117 1 34 PRO HG2 1 36 ALA H . . 5.090 4.979 4.944 5.045 . 0 0 "[ . 1 . 2]" 1
1118 1 35 TRP H 1 35 TRP HB2 . . 3.600 3.571 3.547 3.579 . 0 0 "[ . 1 . 2]" 1
1119 1 35 TRP H 1 35 TRP HB3 . . 3.230 2.782 2.754 2.853 . 0 0 "[ . 1 . 2]" 1
1120 1 35 TRP H 1 35 TRP HD1 . . 3.120 2.866 2.583 2.937 . 0 0 "[ . 1 . 2]" 1
1121 1 35 TRP H 1 35 TRP HE1 . . 4.540 4.236 4.024 4.279 . 0 0 "[ . 1 . 2]" 1
1122 1 35 TRP H 1 36 ALA H . . 3.030 2.555 2.508 2.588 . 0 0 "[ . 1 . 2]" 1
1123 1 35 TRP H 1 36 ALA MB . . 4.380 4.214 4.159 4.264 . 0 0 "[ . 1 . 2]" 1
1124 1 35 TRP H 1 37 SER H . . 4.800 4.508 4.372 4.608 . 0 0 "[ . 1 . 2]" 1
1125 1 35 TRP HA 1 35 TRP HD1 . . 4.590 4.487 4.298 4.522 . 0 0 "[ . 1 . 2]" 1
1126 1 35 TRP HA 1 36 ALA H . . 3.450 3.394 3.374 3.408 . 0 0 "[ . 1 . 2]" 1
1127 1 35 TRP HA 1 36 ALA HA . . 4.980 4.865 4.841 4.891 . 0 0 "[ . 1 . 2]" 1
1128 1 35 TRP HA 1 37 SER H . . 4.330 3.763 3.426 3.978 . 0 0 "[ . 1 . 2]" 1
1129 1 35 TRP HA 1 38 LEU H . . 4.100 3.577 3.489 3.664 . 0 0 "[ . 1 . 2]" 1
1130 1 35 TRP HA 1 38 LEU MD1 . . 3.720 2.154 1.937 2.484 . 0 0 "[ . 1 . 2]" 1
1131 1 35 TRP HA 1 38 LEU MD2 . . 4.600 3.944 3.727 4.156 . 0 0 "[ . 1 . 2]" 1
1132 1 35 TRP HA 1 38 LEU HG . . 3.890 2.640 2.395 2.885 . 0 0 "[ . 1 . 2]" 1
1133 1 35 TRP HB2 1 36 ALA H . . 4.500 3.989 3.901 4.033 . 0 0 "[ . 1 . 2]" 1
1134 1 35 TRP HB2 1 38 LEU H . . 4.860 4.486 4.395 4.542 . 0 0 "[ . 1 . 2]" 1
1135 1 35 TRP HB2 1 38 LEU MD1 . . 3.570 2.246 1.982 2.756 . 0 0 "[ . 1 . 2]" 1
1136 1 35 TRP HB2 1 38 LEU MD2 . . 5.100 4.952 4.561 5.102 0.002 19 0 "[ . 1 . 2]" 1
1137 1 35 TRP HB2 1 39 TYR QE . . 4.800 2.699 2.279 3.406 . 0 0 "[ . 1 . 2]" 1
1138 1 35 TRP HB3 1 35 TRP HD1 . . 3.840 2.569 2.561 2.616 . 0 0 "[ . 1 . 2]" 1
1139 1 35 TRP HB3 1 36 ALA H . . 4.880 4.312 4.290 4.337 . 0 0 "[ . 1 . 2]" 1
1140 1 35 TRP HB3 1 38 LEU H . . 5.500 5.492 5.424 5.508 0.008 17 0 "[ . 1 . 2]" 1
1141 1 35 TRP HB3 1 38 LEU MD1 . . 4.330 2.766 2.629 2.947 . 0 0 "[ . 1 . 2]" 1
1142 1 35 TRP HD1 1 36 ALA H . . 5.150 4.894 4.768 4.971 . 0 0 "[ . 1 . 2]" 1
1143 1 35 TRP HE1 1 73 HIS HD2 . . 5.500 5.188 3.612 5.505 0.005 12 0 "[ . 1 . 2]" 1
1144 1 35 TRP HE1 1 76 VAL MG1 . . 4.610 4.049 3.885 4.295 . 0 0 "[ . 1 . 2]" 1
1145 1 35 TRP HE1 1 76 VAL MG2 . . 4.770 3.521 3.249 3.985 . 0 0 "[ . 1 . 2]" 1
1146 1 35 TRP HE3 1 36 ALA HA . . 3.260 2.140 2.029 2.544 . 0 0 "[ . 1 . 2]" 1
1147 1 35 TRP HE3 1 36 ALA MB . . 4.960 3.397 3.304 3.604 . 0 0 "[ . 1 . 2]" 1
1148 1 35 TRP HE3 1 38 LEU MD1 . . 4.730 4.087 3.823 4.491 . 0 0 "[ . 1 . 2]" 1
1149 1 35 TRP HE3 1 39 TYR QD . . 4.110 2.503 2.260 2.801 . 0 0 "[ . 1 . 2]" 1
1150 1 35 TRP HE3 1 39 TYR QE . . 3.360 2.630 2.323 2.819 . 0 0 "[ . 1 . 2]" 1
1151 1 35 TRP HH2 1 73 HIS HA . . 4.440 4.008 3.588 4.339 . 0 0 "[ . 1 . 2]" 1
1152 1 35 TRP HH2 1 73 HIS QB . . 5.340 5.166 4.234 5.350 0.010 2 0 "[ . 1 . 2]" 1
1153 1 35 TRP HH2 1 76 VAL H . . 5.500 5.248 4.889 5.499 . 0 0 "[ . 1 . 2]" 1
1154 1 35 TRP HH2 1 76 VAL HB . . 3.680 2.804 2.482 3.029 . 0 0 "[ . 1 . 2]" 1
1155 1 35 TRP HH2 1 76 VAL MG1 . . 3.260 2.349 2.106 2.662 . 0 0 "[ . 1 . 2]" 1
1156 1 35 TRP HH2 1 76 VAL MG2 . . 3.990 3.795 3.627 3.897 . 0 0 "[ . 1 . 2]" 1
1157 1 35 TRP HH2 1 77 ILE H . . 4.220 3.892 3.373 4.163 . 0 0 "[ . 1 . 2]" 1
1158 1 35 TRP HH2 1 77 ILE HA . . 5.090 4.356 3.936 4.557 . 0 0 "[ . 1 . 2]" 1
1159 1 35 TRP HH2 1 77 ILE MD . . 4.130 3.850 3.524 4.087 . 0 0 "[ . 1 . 2]" 1
1160 1 35 TRP HH2 1 77 ILE HG12 . . 3.920 3.693 3.221 3.921 0.001 11 0 "[ . 1 . 2]" 1
1161 1 35 TRP HH2 1 77 ILE HG13 . . 3.750 2.834 2.335 3.063 . 0 0 "[ . 1 . 2]" 1
1162 1 35 TRP HZ2 1 36 ALA MB . . 5.270 4.899 4.723 5.137 . 0 0 "[ . 1 . 2]" 1
1163 1 35 TRP HZ2 1 73 HIS HA . . 4.640 4.111 3.779 4.374 . 0 0 "[ . 1 . 2]" 1
1164 1 35 TRP HZ2 1 76 VAL H . . 5.500 5.106 4.959 5.375 . 0 0 "[ . 1 . 2]" 1
1165 1 35 TRP HZ2 1 76 VAL HA . . 5.380 4.968 4.802 5.200 . 0 0 "[ . 1 . 2]" 1
1166 1 35 TRP HZ2 1 76 VAL HB . . 3.740 2.843 2.704 3.130 . 0 0 "[ . 1 . 2]" 1
1167 1 35 TRP HZ2 1 76 VAL MG1 . . 2.930 2.036 1.875 2.191 . 0 0 "[ . 1 . 2]" 1
1168 1 35 TRP HZ2 1 76 VAL MG2 . . 3.420 2.427 2.261 2.659 . 0 0 "[ . 1 . 2]" 1
1169 1 35 TRP HZ2 1 77 ILE HG13 . . 5.180 4.908 4.626 5.123 . 0 0 "[ . 1 . 2]" 1
1170 1 35 TRP HZ3 1 36 ALA HA . . 4.090 2.692 2.545 3.352 . 0 0 "[ . 1 . 2]" 1
1171 1 35 TRP HZ3 1 36 ALA MB . . 4.450 3.130 3.005 3.579 . 0 0 "[ . 1 . 2]" 1
1172 1 35 TRP HZ3 1 39 TYR QD . . 4.250 3.597 3.318 3.985 . 0 0 "[ . 1 . 2]" 1
1173 1 35 TRP HZ3 1 39 TYR QE . . 4.430 4.270 3.996 4.433 0.003 6 0 "[ . 1 . 2]" 1
1174 1 35 TRP HZ3 1 73 HIS HA . . 5.040 4.658 4.115 5.019 . 0 0 "[ . 1 . 2]" 1
1175 1 35 TRP HZ3 1 73 HIS QB . . 5.340 4.774 3.379 5.165 . 0 0 "[ . 1 . 2]" 1
1176 1 35 TRP HZ3 1 76 VAL HB . . 5.500 4.903 4.496 5.127 . 0 0 "[ . 1 . 2]" 1
1177 1 35 TRP HZ3 1 76 VAL MG1 . . 4.870 4.545 4.336 4.795 . 0 0 "[ . 1 . 2]" 1
1178 1 35 TRP HZ3 1 76 VAL MG2 . . 5.500 5.433 5.244 5.504 0.004 6 0 "[ . 1 . 2]" 1
1179 1 35 TRP HZ3 1 77 ILE MD . . 4.050 3.340 2.482 3.672 . 0 0 "[ . 1 . 2]" 1
1180 1 35 TRP HZ3 1 77 ILE HG12 . . 4.960 4.189 3.672 4.487 . 0 0 "[ . 1 . 2]" 1
1181 1 35 TRP HZ3 1 77 ILE HG13 . . 4.530 3.716 2.997 4.000 . 0 0 "[ . 1 . 2]" 1
1182 1 36 ALA H 1 36 ALA MB . . 2.710 2.190 2.127 2.231 . 0 0 "[ . 1 . 2]" 1
1183 1 36 ALA H 1 37 SER H . . 3.150 2.722 2.653 2.795 . 0 0 "[ . 1 . 2]" 1
1184 1 36 ALA H 1 37 SER HA . . 5.500 5.306 5.236 5.369 . 0 0 "[ . 1 . 2]" 1
1185 1 36 ALA H 1 37 SER HB2 . . 5.500 5.014 4.675 5.496 . 0 0 "[ . 1 . 2]" 1
1186 1 36 ALA H 1 37 SER HB3 . . 5.500 5.096 4.703 5.393 . 0 0 "[ . 1 . 2]" 1
1187 1 36 ALA H 1 38 LEU H . . 4.430 4.079 4.010 4.175 . 0 0 "[ . 1 . 2]" 1
1188 1 36 ALA H 1 38 LEU MD1 . . 5.350 4.720 4.480 5.072 . 0 0 "[ . 1 . 2]" 1
1189 1 36 ALA HA 1 38 LEU H . . 4.050 3.542 3.476 3.606 . 0 0 "[ . 1 . 2]" 1
1190 1 36 ALA HA 1 39 TYR HB2 . . 4.630 3.533 3.381 3.870 . 0 0 "[ . 1 . 2]" 1
1191 1 36 ALA HA 1 39 TYR QD . . 3.310 2.588 2.406 2.743 . 0 0 "[ . 1 . 2]" 1
1192 1 36 ALA HA 1 39 TYR QE . . 4.470 4.189 3.917 4.326 . 0 0 "[ . 1 . 2]" 1
1193 1 36 ALA HA 1 40 ARG H . . 4.940 4.157 4.013 4.330 . 0 0 "[ . 1 . 2]" 1
1194 1 36 ALA MB 1 37 SER H . . 3.440 2.751 2.602 3.002 . 0 0 "[ . 1 . 2]" 1
1195 1 36 ALA MB 1 37 SER HA . . 4.120 3.853 3.791 3.916 . 0 0 "[ . 1 . 2]" 1
1196 1 36 ALA MB 1 37 SER HB2 . . 5.500 4.237 4.048 4.477 . 0 0 "[ . 1 . 2]" 1
1197 1 36 ALA MB 1 37 SER HB3 . . 5.500 4.884 4.462 5.187 . 0 0 "[ . 1 . 2]" 1
1198 1 36 ALA MB 1 38 LEU H . . 4.750 4.184 4.108 4.295 . 0 0 "[ . 1 . 2]" 1
1199 1 36 ALA MB 1 39 TYR H . . 4.770 4.377 4.299 4.471 . 0 0 "[ . 1 . 2]" 1
1200 1 36 ALA MB 1 39 TYR HB2 . . 4.940 4.421 4.299 4.587 . 0 0 "[ . 1 . 2]" 1
1201 1 36 ALA MB 1 39 TYR QD . . 4.270 4.176 4.044 4.271 0.001 16 0 "[ . 1 . 2]" 1
1202 1 36 ALA MB 1 39 TYR QE . . 5.500 5.376 5.140 5.502 0.002 7 0 "[ . 1 . 2]" 1
1203 1 36 ALA MB 1 40 ARG H . . 4.970 4.172 4.016 4.356 . 0 0 "[ . 1 . 2]" 1
1204 1 36 ALA MB 1 40 ARG HB3 . . 5.040 3.857 3.546 4.171 . 0 0 "[ . 1 . 2]" 1
1205 1 37 SER H 1 37 SER HB2 . . 3.270 2.497 2.223 2.846 . 0 0 "[ . 1 . 2]" 1
1206 1 37 SER H 1 37 SER HB3 . . 3.270 2.616 2.265 2.905 . 0 0 "[ . 1 . 2]" 1
1207 1 37 SER H 1 38 LEU HA . . 5.420 5.162 5.038 5.229 . 0 0 "[ . 1 . 2]" 1
1208 1 37 SER H 1 38 LEU HB2 . . 5.320 4.907 4.807 5.038 . 0 0 "[ . 1 . 2]" 1
1209 1 37 SER H 1 38 LEU HG . . 4.810 3.945 3.666 4.119 . 0 0 "[ . 1 . 2]" 1
1210 1 37 SER H 1 39 TYR H . . 4.510 4.214 4.127 4.308 . 0 0 "[ . 1 . 2]" 1
1211 1 37 SER H 1 40 ARG HD3 . . 5.260 4.976 4.673 5.265 0.005 9 0 "[ . 1 . 2]" 1
1212 1 37 SER HA 1 39 TYR H . . 4.160 3.691 3.604 3.831 . 0 0 "[ . 1 . 2]" 1
1213 1 37 SER HA 1 40 ARG H . . 4.160 3.197 3.117 3.332 . 0 0 "[ . 1 . 2]" 1
1214 1 37 SER HA 1 40 ARG HB2 . . 4.500 3.898 3.821 3.972 . 0 0 "[ . 1 . 2]" 1
1215 1 37 SER HA 1 40 ARG HB3 . . 3.860 2.454 2.299 2.556 . 0 0 "[ . 1 . 2]" 1
1216 1 37 SER HA 1 40 ARG HD2 . . 3.960 2.447 1.996 3.077 . 0 0 "[ . 1 . 2]" 1
1217 1 37 SER HA 1 40 ARG HD3 . . 4.100 2.330 1.998 2.647 . 0 0 "[ . 1 . 2]" 1
1218 1 37 SER HA 1 40 ARG HG3 . . 4.460 4.002 3.643 4.279 . 0 0 "[ . 1 . 2]" 1
1219 1 37 SER QB 1 38 LEU H . . 3.930 3.215 3.140 3.297 . 0 0 "[ . 1 . 2]" 1
1220 1 37 SER QB 1 40 ARG HD2 . . 4.710 3.716 3.019 4.475 . 0 0 "[ . 1 . 2]" 1
1221 1 37 SER HB2 1 38 LEU H . . 4.670 4.178 3.960 4.387 . 0 0 "[ . 1 . 2]" 1
1222 1 37 SER HB2 1 38 LEU MD2 . . 5.500 5.398 5.180 5.501 0.001 8 0 "[ . 1 . 2]" 1
1223 1 37 SER HB2 1 38 LEU HG . . 5.500 5.048 4.725 5.410 . 0 0 "[ . 1 . 2]" 1
1224 1 37 SER HB2 1 40 ARG HB3 . . 5.500 4.770 4.472 4.984 . 0 0 "[ . 1 . 2]" 1
1225 1 37 SER HB2 1 40 ARG HD2 . . 5.500 3.885 3.070 4.823 . 0 0 "[ . 1 . 2]" 1
1226 1 37 SER HB3 1 38 LEU H . . 4.670 3.346 3.285 3.424 . 0 0 "[ . 1 . 2]" 1
1227 1 37 SER HB3 1 38 LEU MD2 . . 5.500 3.969 3.646 4.205 . 0 0 "[ . 1 . 2]" 1
1228 1 37 SER HB3 1 38 LEU HG . . 5.500 3.601 3.403 3.797 . 0 0 "[ . 1 . 2]" 1
1229 1 37 SER HB3 1 40 ARG HB3 . . 5.500 5.437 5.270 5.506 0.006 18 0 "[ . 1 . 2]" 1
1230 1 37 SER HB3 1 40 ARG HD2 . . 5.500 4.850 4.415 5.447 . 0 0 "[ . 1 . 2]" 1
1231 1 38 LEU H 1 38 LEU HB2 . . 2.900 2.502 2.465 2.553 . 0 0 "[ . 1 . 2]" 1
1232 1 38 LEU H 1 38 LEU HB3 . . 3.700 3.625 3.613 3.644 . 0 0 "[ . 1 . 2]" 1
1233 1 38 LEU H 1 38 LEU MD1 . . 3.810 3.461 3.235 3.658 . 0 0 "[ . 1 . 2]" 1
1234 1 38 LEU H 1 38 LEU MD2 . . 3.830 3.651 3.501 3.822 . 0 0 "[ . 1 . 2]" 1
1235 1 38 LEU H 1 38 LEU HG . . 2.940 2.398 2.261 2.479 . 0 0 "[ . 1 . 2]" 1
1236 1 38 LEU H 1 39 TYR H . . 3.010 2.348 2.274 2.406 . 0 0 "[ . 1 . 2]" 1
1237 1 38 LEU H 1 39 TYR HA . . 5.150 5.023 4.965 5.077 . 0 0 "[ . 1 . 2]" 1
1238 1 38 LEU H 1 39 TYR HB2 . . 5.200 4.629 4.544 4.761 . 0 0 "[ . 1 . 2]" 1
1239 1 38 LEU H 1 39 TYR QD . . 4.830 3.205 2.903 3.482 . 0 0 "[ . 1 . 2]" 1
1240 1 38 LEU H 1 39 TYR QE . . 5.010 4.478 4.141 4.715 . 0 0 "[ . 1 . 2]" 1
1241 1 38 LEU HA 1 38 LEU MD1 . . 3.990 3.933 3.906 3.958 . 0 0 "[ . 1 . 2]" 1
1242 1 38 LEU HA 1 38 LEU MD2 . . 2.750 2.429 2.298 2.604 . 0 0 "[ . 1 . 2]" 1
1243 1 38 LEU HA 1 38 LEU HG . . 3.810 3.016 2.895 3.122 . 0 0 "[ . 1 . 2]" 1
1244 1 38 LEU HA 1 40 ARG H . . 4.920 4.629 4.383 4.878 . 0 0 "[ . 1 . 2]" 1
1245 1 38 LEU HB2 1 38 LEU MD1 . . 3.400 2.189 2.051 2.326 . 0 0 "[ . 1 . 2]" 1
1246 1 38 LEU HB2 1 39 TYR H . . 3.800 3.228 3.004 3.310 . 0 0 "[ . 1 . 2]" 1
1247 1 38 LEU HB2 1 39 TYR QD . . 4.930 2.853 2.682 3.089 . 0 0 "[ . 1 . 2]" 1
1248 1 38 LEU HB2 1 39 TYR QE . . 4.470 2.935 2.671 3.164 . 0 0 "[ . 1 . 2]" 1
1249 1 38 LEU HB2 1 40 ARG H . . 5.500 5.114 4.990 5.187 . 0 0 "[ . 1 . 2]" 1
1250 1 38 LEU HB3 1 38 LEU MD1 . . 3.320 2.522 2.382 2.660 . 0 0 "[ . 1 . 2]" 1
1251 1 38 LEU HB3 1 39 TYR H . . 4.160 4.142 4.006 4.164 0.004 11 0 "[ . 1 . 2]" 1
1252 1 38 LEU HB3 1 39 TYR QD . . 5.130 4.268 4.090 4.433 . 0 0 "[ . 1 . 2]" 1
1253 1 38 LEU HB3 1 39 TYR QE . . 4.490 4.223 4.015 4.401 . 0 0 "[ . 1 . 2]" 1
1254 1 38 LEU MD1 1 39 TYR QE . . 3.960 3.112 2.717 3.328 . 0 0 "[ . 1 . 2]" 1
1255 1 38 LEU MD2 1 39 TYR H . . 5.160 4.883 4.775 5.006 . 0 0 "[ . 1 . 2]" 1
1256 1 38 LEU MD2 1 39 TYR QE . . 5.300 5.197 5.041 5.300 . 7 0 "[ . 1 . 2]" 1
1257 1 38 LEU HG 1 39 TYR H . . 4.860 4.459 4.354 4.538 . 0 0 "[ . 1 . 2]" 1
1258 1 39 TYR H 1 39 TYR HB2 . . 3.480 2.652 2.592 2.744 . 0 0 "[ . 1 . 2]" 1
1259 1 39 TYR H 1 39 TYR HB3 . . 3.920 3.767 3.736 3.802 . 0 0 "[ . 1 . 2]" 1
1260 1 39 TYR H 1 40 ARG H . . 2.670 1.903 1.850 1.999 . 0 0 "[ . 1 . 2]" 1
1261 1 39 TYR H 1 40 ARG HA . . 4.680 4.510 4.448 4.607 . 0 0 "[ . 1 . 2]" 1
1262 1 39 TYR H 1 40 ARG HB2 . . 5.500 5.373 5.309 5.454 . 0 0 "[ . 1 . 2]" 1
1263 1 39 TYR H 1 42 ARG HG3 . . 5.500 5.230 4.924 5.508 0.008 20 0 "[ . 1 . 2]" 1
1264 1 39 TYR HA 1 39 TYR QD . . 3.290 3.058 2.941 3.178 . 0 0 "[ . 1 . 2]" 1
1265 1 39 TYR HA 1 39 TYR QE . . 4.990 4.752 4.691 4.842 . 0 0 "[ . 1 . 2]" 1
1266 1 39 TYR HA 1 42 ARG H . . 4.100 3.322 3.179 3.414 . 0 0 "[ . 1 . 2]" 1
1267 1 39 TYR HA 1 42 ARG QD . . 3.920 3.523 3.210 3.926 0.006 18 0 "[ . 1 . 2]" 1
1268 1 39 TYR HA 1 42 ARG HG2 . . 4.810 4.115 3.738 4.445 . 0 0 "[ . 1 . 2]" 1
1269 1 39 TYR HA 1 42 ARG HG3 . . 4.860 2.438 2.072 2.779 . 0 0 "[ . 1 . 2]" 1
1270 1 39 TYR HB2 1 40 ARG H . . 3.750 2.899 2.715 3.133 . 0 0 "[ . 1 . 2]" 1
1271 1 39 TYR HB2 1 43 PHE QD . . 4.960 3.833 3.314 4.845 . 0 0 "[ . 1 . 2]" 1
1272 1 39 TYR HB2 1 43 PHE QE . . 4.460 2.889 2.141 4.291 . 0 0 "[ . 1 . 2]" 1
1273 1 39 TYR HB3 1 40 ARG H . . 4.120 3.952 3.845 4.078 . 0 0 "[ . 1 . 2]" 1
1274 1 39 TYR HB3 1 42 ARG H . . 4.940 4.468 4.343 4.566 . 0 0 "[ . 1 . 2]" 1
1275 1 39 TYR HB3 1 42 ARG HB2 . . 4.670 3.606 3.243 3.895 . 0 0 "[ . 1 . 2]" 1
1276 1 39 TYR HB3 1 42 ARG HG3 . . 4.380 3.685 3.350 3.991 . 0 0 "[ . 1 . 2]" 1
1277 1 39 TYR HB3 1 43 PHE QD . . 4.680 3.349 3.089 4.182 . 0 0 "[ . 1 . 2]" 1
1278 1 39 TYR HB3 1 43 PHE QE . . 4.160 2.365 1.999 3.566 . 0 0 "[ . 1 . 2]" 1
1279 1 39 TYR QD 1 40 ARG H . . 5.500 3.908 3.693 4.177 . 0 0 "[ . 1 . 2]" 1
1280 1 39 TYR QD 1 42 ARG H . . 5.500 5.496 5.378 5.605 0.105 18 0 "[ . 1 . 2]" 1
1281 1 39 TYR QD 1 42 ARG QD . . 3.740 3.175 2.682 3.762 0.022 18 0 "[ . 1 . 2]" 1
1282 1 39 TYR QD 1 66 TYR HA . . 5.270 4.291 3.272 5.282 0.012 20 0 "[ . 1 . 2]" 1
1283 1 39 TYR QD 1 68 ILE HA . . 5.500 4.450 4.056 4.936 . 0 0 "[ . 1 . 2]" 1
1284 1 39 TYR QD 1 68 ILE MD . . 4.630 3.752 3.310 4.049 . 0 0 "[ . 1 . 2]" 1
1285 1 39 TYR QD 1 68 ILE QG . . 4.540 2.999 2.596 3.314 . 0 0 "[ . 1 . 2]" 1
1286 1 39 TYR QD 1 68 ILE MG . . 4.920 4.332 3.621 4.916 . 0 0 "[ . 1 . 2]" 1
1287 1 39 TYR QE 1 68 ILE HA . . 3.730 2.940 2.213 3.565 . 0 0 "[ . 1 . 2]" 1
1288 1 39 TYR QE 1 68 ILE MD . . 4.220 3.981 3.470 4.232 0.012 18 0 "[ . 1 . 2]" 1
1289 1 39 TYR QE 1 68 ILE QG . . 3.900 2.719 2.183 3.780 . 0 0 "[ . 1 . 2]" 1
1290 1 39 TYR QE 1 68 ILE MG . . 3.740 3.080 2.418 3.668 . 0 0 "[ . 1 . 2]" 1
1291 1 39 TYR QE 1 69 GLU H . . 4.700 4.281 3.624 4.700 0.000 2 0 "[ . 1 . 2]" 1
1292 1 39 TYR QE 1 70 ASN H . . 5.040 4.931 4.496 5.049 0.009 9 0 "[ . 1 . 2]" 1
1293 1 39 TYR QE 1 73 HIS HB2 . . 4.660 3.977 3.535 4.653 . 0 0 "[ . 1 . 2]" 1
1294 1 39 TYR QE 1 73 HIS QB . . 3.900 3.660 3.374 3.903 0.003 15 0 "[ . 1 . 2]" 1
1295 1 39 TYR QE 1 73 HIS HB3 . . 4.660 4.357 3.897 4.659 . 0 0 "[ . 1 . 2]" 1
1296 1 40 ARG H 1 40 ARG HB2 . . 3.700 3.555 3.528 3.576 . 0 0 "[ . 1 . 2]" 1
1297 1 40 ARG H 1 40 ARG HB3 . . 2.960 2.288 2.238 2.327 . 0 0 "[ . 1 . 2]" 1
1298 1 40 ARG H 1 40 ARG HD2 . . 4.550 4.308 4.099 4.556 0.006 6 0 "[ . 1 . 2]" 1
1299 1 40 ARG H 1 40 ARG HD3 . . 5.210 4.426 3.982 4.934 . 0 0 "[ . 1 . 2]" 1
1300 1 40 ARG H 1 40 ARG HG2 . . 3.580 2.736 2.628 2.935 . 0 0 "[ . 1 . 2]" 1
1301 1 40 ARG H 1 40 ARG HG3 . . 4.010 3.913 3.811 4.010 . 0 0 "[ . 1 . 2]" 1
1302 1 40 ARG H 1 41 ASP H . . 3.460 3.016 2.909 3.105 . 0 0 "[ . 1 . 2]" 1
1303 1 40 ARG H 1 42 ARG H . . 4.560 4.468 4.322 4.588 0.028 18 0 "[ . 1 . 2]" 1
1304 1 40 ARG HA 1 40 ARG HG2 . . 3.910 3.767 3.739 3.833 . 0 0 "[ . 1 . 2]" 1
1305 1 40 ARG HA 1 40 ARG HG3 . . 4.110 3.696 3.610 3.739 . 0 0 "[ . 1 . 2]" 1
1306 1 40 ARG HA 1 42 ARG H . . 4.530 4.313 4.215 4.432 . 0 0 "[ . 1 . 2]" 1
1307 1 40 ARG HA 1 43 PHE H . . 4.160 3.248 3.153 3.359 . 0 0 "[ . 1 . 2]" 1
1308 1 40 ARG HA 1 43 PHE HB2 . . 3.780 2.485 2.282 2.763 . 0 0 "[ . 1 . 2]" 1
1309 1 40 ARG HA 1 43 PHE HB3 . . 4.620 4.070 3.867 4.306 . 0 0 "[ . 1 . 2]" 1
1310 1 40 ARG HA 1 43 PHE QD . . 4.280 2.821 2.038 3.578 . 0 0 "[ . 1 . 2]" 1
1311 1 40 ARG HA 1 44 LEU H . . 4.480 4.138 4.011 4.290 . 0 0 "[ . 1 . 2]" 1
1312 1 40 ARG HB2 1 40 ARG HD2 . . 4.090 2.627 2.423 2.778 . 0 0 "[ . 1 . 2]" 1
1313 1 40 ARG HB2 1 40 ARG HD3 . . 4.210 3.656 3.473 3.784 . 0 0 "[ . 1 . 2]" 1
1314 1 40 ARG HB2 1 41 ASP H . . 4.370 3.787 3.646 4.022 . 0 0 "[ . 1 . 2]" 1
1315 1 40 ARG HB2 1 44 LEU QD . . 3.410 2.605 2.373 2.864 . 0 0 "[ . 1 . 2]" 1
1316 1 40 ARG HB3 1 40 ARG HD3 . . 4.140 3.205 2.764 3.539 . 0 0 "[ . 1 . 2]" 1
1317 1 40 ARG HB3 1 41 ASP H . . 3.930 3.691 3.615 3.813 . 0 0 "[ . 1 . 2]" 1
1318 1 40 ARG HD2 1 41 ASP H . . 4.830 4.597 4.384 4.837 0.007 9 0 "[ . 1 . 2]" 1
1319 1 40 ARG HD2 1 44 LEU QD . . 4.500 4.174 3.594 4.464 . 0 0 "[ . 1 . 2]" 1
1320 1 40 ARG HD3 1 44 LEU QD . . 5.410 4.736 4.337 5.215 . 0 0 "[ . 1 . 2]" 1
1321 1 40 ARG HG2 1 41 ASP H . . 4.340 2.031 1.899 2.308 . 0 0 "[ . 1 . 2]" 1
1322 1 40 ARG HG2 1 41 ASP HA . . 4.940 4.054 3.849 4.211 . 0 0 "[ . 1 . 2]" 1
1323 1 40 ARG HG2 1 44 LEU QD . . 5.100 4.091 3.856 4.371 . 0 0 "[ . 1 . 2]" 1
1324 1 40 ARG HG3 1 41 ASP H . . 4.340 2.372 2.104 2.801 . 0 0 "[ . 1 . 2]" 1
1325 1 40 ARG HG3 1 41 ASP HA . . 3.520 3.003 2.871 3.099 . 0 0 "[ . 1 . 2]" 1
1326 1 40 ARG HG3 1 42 ARG H . . 5.210 4.891 4.741 5.144 . 0 0 "[ . 1 . 2]" 1
1327 1 40 ARG HG3 1 43 PHE H . . 5.500 5.244 5.051 5.505 0.005 8 0 "[ . 1 . 2]" 1
1328 1 40 ARG HG3 1 44 LEU QD . . 3.530 2.773 2.511 3.136 . 0 0 "[ . 1 . 2]" 1
1329 1 41 ASP H 1 41 ASP HB2 . . 3.630 2.439 2.172 2.929 . 0 0 "[ . 1 . 2]" 1
1330 1 41 ASP H 1 41 ASP HB3 . . 3.630 3.396 2.949 3.599 . 0 0 "[ . 1 . 2]" 1
1331 1 41 ASP H 1 42 ARG H . . 3.200 2.869 2.790 2.940 . 0 0 "[ . 1 . 2]" 1
1332 1 41 ASP H 1 42 ARG HG3 . . 5.250 4.399 4.098 4.580 . 0 0 "[ . 1 . 2]" 1
1333 1 41 ASP HA 1 43 PHE H . . 4.950 4.305 4.051 4.614 . 0 0 "[ . 1 . 2]" 1
1334 1 41 ASP HA 1 44 LEU H . . 3.800 3.673 3.518 3.804 0.004 17 0 "[ . 1 . 2]" 1
1335 1 41 ASP HA 1 44 LEU HB2 . . 3.240 3.093 2.906 3.204 . 0 0 "[ . 1 . 2]" 1
1336 1 41 ASP HA 1 44 LEU HB3 . . 4.860 4.759 4.547 4.871 0.011 20 0 "[ . 1 . 2]" 1
1337 1 41 ASP HA 1 44 LEU QD . . 3.200 2.781 2.381 3.118 . 0 0 "[ . 1 . 2]" 1
1338 1 41 ASP HA 1 44 LEU HG . . 4.740 4.587 4.383 4.747 0.007 18 0 "[ . 1 . 2]" 1
1339 1 41 ASP HA 1 45 SER H . . 4.150 3.808 3.554 4.083 . 0 0 "[ . 1 . 2]" 1
1340 1 41 ASP QB 1 42 ARG H . . 3.230 2.519 2.422 2.645 . 0 0 "[ . 1 . 2]" 1
1341 1 41 ASP QB 1 42 ARG HA . . 4.910 3.854 3.791 3.887 . 0 0 "[ . 1 . 2]" 1
1342 1 41 ASP QB 1 42 ARG HG3 . . 4.590 3.520 3.181 3.729 . 0 0 "[ . 1 . 2]" 1
1343 1 41 ASP QB 1 44 LEU HB2 . . 5.340 4.903 4.641 5.171 . 0 0 "[ . 1 . 2]" 1
1344 1 41 ASP QB 1 44 LEU QD . . 4.710 4.428 4.151 4.686 . 0 0 "[ . 1 . 2]" 1
1345 1 41 ASP QB 1 45 SER H . . 4.980 4.728 4.448 5.017 0.037 18 0 "[ . 1 . 2]" 1
1346 1 41 ASP HB2 1 42 ARG H . . 3.900 2.875 2.491 3.587 . 0 0 "[ . 1 . 2]" 1
1347 1 41 ASP HB3 1 42 ARG H . . 3.900 3.264 2.469 3.889 . 0 0 "[ . 1 . 2]" 1
1348 1 42 ARG H 1 42 ARG HB2 . . 3.060 2.677 2.609 2.836 . 0 0 "[ . 1 . 2]" 1
1349 1 42 ARG H 1 42 ARG HB3 . . 3.650 3.583 3.553 3.599 . 0 0 "[ . 1 . 2]" 1
1350 1 42 ARG H 1 42 ARG HD2 . . 4.770 4.432 4.232 4.734 . 0 0 "[ . 1 . 2]" 1
1351 1 42 ARG H 1 42 ARG QD . . 4.060 4.000 3.852 4.090 0.030 18 0 "[ . 1 . 2]" 1
1352 1 42 ARG H 1 42 ARG HD3 . . 4.770 4.573 4.369 4.758 . 0 0 "[ . 1 . 2]" 1
1353 1 42 ARG H 1 42 ARG HG2 . . 3.350 2.756 2.358 2.986 . 0 0 "[ . 1 . 2]" 1
1354 1 42 ARG H 1 42 ARG HG3 . . 3.130 2.150 1.905 2.282 . 0 0 "[ . 1 . 2]" 1
1355 1 42 ARG H 1 43 PHE H . . 2.940 2.606 2.493 2.736 . 0 0 "[ . 1 . 2]" 1
1356 1 42 ARG H 1 43 PHE HA . . 5.380 5.215 5.111 5.323 . 0 0 "[ . 1 . 2]" 1
1357 1 42 ARG H 1 43 PHE HB2 . . 4.820 4.638 4.529 4.760 . 0 0 "[ . 1 . 2]" 1
1358 1 42 ARG H 1 43 PHE QD . . 4.340 3.648 3.406 3.971 . 0 0 "[ . 1 . 2]" 1
1359 1 42 ARG H 1 44 LEU QD . . 5.110 4.537 4.303 4.727 . 0 0 "[ . 1 . 2]" 1
1360 1 42 ARG HA 1 42 ARG QD . . 4.150 3.911 3.711 4.175 0.025 14 0 "[ . 1 . 2]" 1
1361 1 42 ARG HA 1 42 ARG HG2 . . 3.590 2.586 2.504 2.727 . 0 0 "[ . 1 . 2]" 1
1362 1 42 ARG HA 1 42 ARG HG3 . . 3.650 3.483 3.310 3.656 0.006 16 0 "[ . 1 . 2]" 1
1363 1 42 ARG HA 1 43 PHE HA . . 4.860 4.783 4.709 4.831 . 0 0 "[ . 1 . 2]" 1
1364 1 42 ARG HA 1 44 LEU H . . 4.890 4.639 4.331 4.897 0.007 15 0 "[ . 1 . 2]" 1
1365 1 42 ARG HA 1 45 SER H . . 4.220 3.860 3.618 4.074 . 0 0 "[ . 1 . 2]" 1
1366 1 42 ARG HA 1 45 SER HB2 . . 4.000 3.538 3.378 3.777 . 0 0 "[ . 1 . 2]" 1
1367 1 42 ARG HA 1 45 SER HB3 . . 3.920 3.075 2.899 3.253 . 0 0 "[ . 1 . 2]" 1
1368 1 42 ARG HA 1 46 GLU H . . 4.500 3.623 3.365 3.847 . 0 0 "[ . 1 . 2]" 1
1369 1 42 ARG HB2 1 42 ARG HD2 . . 3.950 3.106 2.630 3.720 . 0 0 "[ . 1 . 2]" 1
1370 1 42 ARG HB2 1 42 ARG QD . . 3.440 2.698 2.537 3.142 . 0 0 "[ . 1 . 2]" 1
1371 1 42 ARG HB2 1 42 ARG HD3 . . 3.950 3.163 2.635 3.802 . 0 0 "[ . 1 . 2]" 1
1372 1 42 ARG HB2 1 43 PHE H . . 3.950 2.753 2.455 3.003 . 0 0 "[ . 1 . 2]" 1
1373 1 42 ARG HB2 1 43 PHE HB2 . . 5.120 4.837 4.664 4.934 . 0 0 "[ . 1 . 2]" 1
1374 1 42 ARG HB2 1 43 PHE QD . . 4.530 2.910 2.404 3.482 . 0 0 "[ . 1 . 2]" 1
1375 1 42 ARG HB2 1 66 TYR HA . . 4.640 4.353 3.945 4.646 0.006 8 0 "[ . 1 . 2]" 1
1376 1 42 ARG HB2 1 66 TYR QD . . 4.980 3.129 2.663 3.860 . 0 0 "[ . 1 . 2]" 1
1377 1 42 ARG HB3 1 42 ARG QD . . 3.610 2.258 2.067 2.592 . 0 0 "[ . 1 . 2]" 1
1378 1 42 ARG HB3 1 43 PHE H . . 4.220 3.922 3.678 4.075 . 0 0 "[ . 1 . 2]" 1
1379 1 42 ARG HB3 1 43 PHE QD . . 5.100 4.459 3.773 5.107 0.007 16 0 "[ . 1 . 2]" 1
1380 1 42 ARG HB3 1 66 TYR H . . 5.500 4.667 4.211 5.243 . 0 0 "[ . 1 . 2]" 1
1381 1 42 ARG HB3 1 66 TYR HA . . 4.470 3.824 3.302 4.253 . 0 0 "[ . 1 . 2]" 1
1382 1 42 ARG HB3 1 66 TYR QD . . 4.800 2.639 2.053 3.464 . 0 0 "[ . 1 . 2]" 1
1383 1 42 ARG QD 1 43 PHE H . . 5.340 5.073 4.820 5.310 . 0 0 "[ . 1 . 2]" 1
1384 1 42 ARG QD 1 66 TYR QD . . 4.840 2.748 2.049 3.408 . 0 0 "[ . 1 . 2]" 1
1385 1 42 ARG HD2 1 66 TYR HA . . 3.930 2.502 1.995 3.638 . 0 0 "[ . 1 . 2]" 1
1386 1 42 ARG HD3 1 66 TYR HA . . 3.930 2.528 2.000 3.550 . 0 0 "[ . 1 . 2]" 1
1387 1 42 ARG HG2 1 43 PHE H . . 4.890 4.694 4.443 4.862 . 0 0 "[ . 1 . 2]" 1
1388 1 42 ARG HG3 1 43 PHE H . . 4.230 4.058 3.728 4.231 0.001 1 0 "[ . 1 . 2]" 1
1389 1 42 ARG HG3 1 43 PHE QD . . 4.830 4.334 4.080 4.709 . 0 0 "[ . 1 . 2]" 1
1390 1 42 ARG HG3 1 66 TYR HA . . 4.960 4.662 4.329 4.973 0.013 14 0 "[ . 1 . 2]" 1
1391 1 42 ARG HG3 1 66 TYR QD . . 5.290 4.627 4.066 5.310 0.020 20 0 "[ . 1 . 2]" 1
1392 1 43 PHE H 1 43 PHE HB2 . . 3.140 2.322 2.272 2.403 . 0 0 "[ . 1 . 2]" 1
1393 1 43 PHE H 1 43 PHE HB3 . . 3.760 3.561 3.547 3.579 . 0 0 "[ . 1 . 2]" 1
1394 1 43 PHE H 1 43 PHE QD . . 3.560 2.058 1.906 2.405 . 0 0 "[ . 1 . 2]" 1
1395 1 43 PHE H 1 44 LEU H . . 3.150 2.703 2.492 2.907 . 0 0 "[ . 1 . 2]" 1
1396 1 43 PHE H 1 44 LEU QD . . 4.760 3.494 3.278 3.663 . 0 0 "[ . 1 . 2]" 1
1397 1 43 PHE H 1 45 SER H . . 4.780 4.338 4.176 4.476 . 0 0 "[ . 1 . 2]" 1
1398 1 43 PHE H 1 46 GLU HB2 . . 5.270 5.010 4.807 5.171 . 0 0 "[ . 1 . 2]" 1
1399 1 43 PHE HA 1 43 PHE QD . . 4.000 2.986 2.662 3.113 . 0 0 "[ . 1 . 2]" 1
1400 1 43 PHE HA 1 46 GLU HB2 . . 3.730 3.290 3.020 3.557 . 0 0 "[ . 1 . 2]" 1
1401 1 43 PHE HA 1 48 VAL H . . 4.100 3.191 2.758 3.415 . 0 0 "[ . 1 . 2]" 1
1402 1 43 PHE HA 1 48 VAL HB . . 3.960 2.451 2.075 2.712 . 0 0 "[ . 1 . 2]" 1
1403 1 43 PHE HA 1 48 VAL MG1 . . 4.390 3.732 3.415 3.913 . 0 0 "[ . 1 . 2]" 1
1404 1 43 PHE HA 1 48 VAL MG2 . . 3.130 2.185 1.916 2.416 . 0 0 "[ . 1 . 2]" 1
1405 1 43 PHE HA 1 66 TYR QE . . 4.500 4.026 3.064 4.520 0.020 18 0 "[ . 1 . 2]" 1
1406 1 43 PHE HB2 1 44 LEU H . . 3.480 2.538 2.319 2.702 . 0 0 "[ . 1 . 2]" 1
1407 1 43 PHE HB2 1 44 LEU HA . . 4.690 4.507 4.386 4.619 . 0 0 "[ . 1 . 2]" 1
1408 1 43 PHE HB2 1 44 LEU MD1 . . 5.020 3.969 3.345 4.323 . 0 0 "[ . 1 . 2]" 1
1409 1 43 PHE HB2 1 44 LEU QD . . 4.370 2.426 2.343 2.660 . 0 0 "[ . 1 . 2]" 1
1410 1 43 PHE HB2 1 44 LEU MD2 . . 5.020 2.453 2.361 2.772 . 0 0 "[ . 1 . 2]" 1
1411 1 43 PHE HB2 1 44 LEU HG . . 5.500 5.486 5.428 5.523 0.023 18 0 "[ . 1 . 2]" 1
1412 1 43 PHE HB2 1 48 VAL H . . 5.500 5.325 5.050 5.493 . 0 0 "[ . 1 . 2]" 1
1413 1 43 PHE HB2 1 48 VAL HB . . 4.670 4.450 4.279 4.613 . 0 0 "[ . 1 . 2]" 1
1414 1 43 PHE HB2 1 48 VAL MG2 . . 5.000 4.722 4.354 5.001 0.001 5 0 "[ . 1 . 2]" 1
1415 1 43 PHE HB3 1 44 LEU H . . 3.830 3.308 3.065 3.470 . 0 0 "[ . 1 . 2]" 1
1416 1 43 PHE HB3 1 44 LEU HA . . 5.000 4.167 4.062 4.254 . 0 0 "[ . 1 . 2]" 1
1417 1 43 PHE HB3 1 44 LEU MD1 . . 5.200 3.731 3.176 4.041 . 0 0 "[ . 1 . 2]" 1
1418 1 43 PHE HB3 1 44 LEU QD . . 4.360 2.987 2.870 3.139 . 0 0 "[ . 1 . 2]" 1
1419 1 43 PHE HB3 1 44 LEU MD2 . . 5.200 3.176 2.984 3.646 . 0 0 "[ . 1 . 2]" 1
1420 1 43 PHE HB3 1 48 VAL H . . 4.840 4.160 3.843 4.372 . 0 0 "[ . 1 . 2]" 1
1421 1 43 PHE HB3 1 48 VAL HB . . 4.080 3.023 2.718 3.243 . 0 0 "[ . 1 . 2]" 1
1422 1 43 PHE HB3 1 48 VAL MG1 . . 4.430 4.128 3.754 4.435 0.005 4 0 "[ . 1 . 2]" 1
1423 1 43 PHE HB3 1 48 VAL MG2 . . 4.380 3.994 3.567 4.273 . 0 0 "[ . 1 . 2]" 1
1424 1 43 PHE QD 1 44 LEU H . . 4.820 4.202 4.056 4.319 . 0 0 "[ . 1 . 2]" 1
1425 1 43 PHE QD 1 44 LEU MD1 . . 5.500 5.128 4.543 5.365 . 0 0 "[ . 1 . 2]" 1
1426 1 43 PHE QD 1 44 LEU QD . . 4.570 3.990 3.894 4.060 . 0 0 "[ . 1 . 2]" 1
1427 1 43 PHE QD 1 44 LEU MD2 . . 5.500 4.170 4.021 4.463 . 0 0 "[ . 1 . 2]" 1
1428 1 43 PHE QD 1 48 VAL HB . . 3.910 2.892 2.282 3.449 . 0 0 "[ . 1 . 2]" 1
1429 1 43 PHE QD 1 48 VAL MG1 . . 3.570 2.903 2.267 3.531 . 0 0 "[ . 1 . 2]" 1
1430 1 43 PHE QD 1 48 VAL MG2 . . 3.820 3.712 3.347 3.820 0.000 8 0 "[ . 1 . 2]" 1
1431 1 43 PHE QD 1 53 LEU QD . . 4.630 3.448 3.023 3.881 . 0 0 "[ . 1 . 2]" 1
1432 1 43 PHE QE 1 48 VAL HB . . 5.090 4.502 4.064 4.982 . 0 0 "[ . 1 . 2]" 1
1433 1 43 PHE QE 1 48 VAL MG1 . . 3.870 3.363 2.858 3.772 . 0 0 "[ . 1 . 2]" 1
1434 1 43 PHE QE 1 48 VAL MG2 . . 4.750 4.512 4.369 4.675 . 0 0 "[ . 1 . 2]" 1
1435 1 43 PHE QE 1 53 LEU MD1 . . 4.730 2.319 1.904 3.009 . 0 0 "[ . 1 . 2]" 1
1436 1 43 PHE QE 1 53 LEU QD . . 3.310 2.279 1.898 2.918 . 0 0 "[ . 1 . 2]" 1
1437 1 43 PHE QE 1 53 LEU MD2 . . 4.730 3.499 2.934 3.931 . 0 0 "[ . 1 . 2]" 1
1438 1 43 PHE QE 1 56 LEU QD . . 4.540 4.146 3.773 4.482 . 0 0 "[ . 1 . 2]" 1
1439 1 43 PHE QE 1 66 TYR QD . . 5.310 4.826 4.139 5.317 0.007 9 0 "[ . 1 . 2]" 1
1440 1 43 PHE QE 1 68 ILE MD . . 4.670 4.173 3.636 4.673 0.003 8 0 "[ . 1 . 2]" 1
1441 1 43 PHE QE 1 77 ILE MD . . 4.780 3.437 3.241 3.956 . 0 0 "[ . 1 . 2]" 1
1442 1 43 PHE HZ 1 48 VAL MG1 . . 5.500 4.836 4.460 5.295 . 0 0 "[ . 1 . 2]" 1
1443 1 43 PHE HZ 1 68 ILE MD . . 5.020 4.237 3.746 4.839 . 0 0 "[ . 1 . 2]" 1
1444 1 43 PHE HZ 1 77 ILE MD . . 4.310 2.561 2.207 3.160 . 0 0 "[ . 1 . 2]" 1
1445 1 43 PHE HZ 1 77 ILE HG12 . . 5.450 4.054 3.784 4.612 . 0 0 "[ . 1 . 2]" 1
1446 1 43 PHE HZ 1 77 ILE MG . . 4.810 3.615 3.390 4.027 . 0 0 "[ . 1 . 2]" 1
1447 1 44 LEU H 1 44 LEU HB2 . . 3.070 2.360 2.320 2.448 . 0 0 "[ . 1 . 2]" 1
1448 1 44 LEU H 1 44 LEU HB3 . . 3.660 3.568 3.556 3.580 . 0 0 "[ . 1 . 2]" 1
1449 1 44 LEU H 1 44 LEU MD1 . . 3.750 3.214 2.640 3.460 . 0 0 "[ . 1 . 2]" 1
1450 1 44 LEU H 1 44 LEU QD . . 3.220 1.867 1.817 1.994 . 0 0 "[ . 1 . 2]" 1
1451 1 44 LEU H 1 44 LEU MD2 . . 3.750 1.882 1.827 2.063 . 0 0 "[ . 1 . 2]" 1
1452 1 44 LEU H 1 44 LEU HG . . 4.000 3.938 3.880 4.000 . 0 0 "[ . 1 . 2]" 1
1453 1 44 LEU H 1 45 SER H . . 3.170 2.774 2.661 2.949 . 0 0 "[ . 1 . 2]" 1
1454 1 44 LEU H 1 45 SER HB2 . . 5.500 4.778 4.633 4.976 . 0 0 "[ . 1 . 2]" 1
1455 1 44 LEU H 1 46 GLU H . . 4.560 4.168 4.031 4.398 . 0 0 "[ . 1 . 2]" 1
1456 1 44 LEU HA 1 44 LEU MD1 . . 3.610 1.970 1.909 2.024 . 0 0 "[ . 1 . 2]" 1
1457 1 44 LEU HA 1 44 LEU QD . . 2.720 1.945 1.899 1.995 . 0 0 "[ . 1 . 2]" 1
1458 1 44 LEU HA 1 44 LEU MD2 . . 3.610 3.021 2.807 3.391 . 0 0 "[ . 1 . 2]" 1
1459 1 44 LEU HA 1 44 LEU HG . . 3.750 3.665 3.567 3.703 . 0 0 "[ . 1 . 2]" 1
1460 1 44 LEU HA 1 46 GLU H . . 5.090 4.550 4.384 4.738 . 0 0 "[ . 1 . 2]" 1
1461 1 44 LEU HA 1 47 ARG H . . 3.780 3.542 3.381 3.720 . 0 0 "[ . 1 . 2]" 1
1462 1 44 LEU HA 1 47 ARG HA . . 4.160 3.265 3.104 3.420 . 0 0 "[ . 1 . 2]" 1
1463 1 44 LEU HA 1 47 ARG QD . . 5.210 3.895 3.229 4.785 . 0 0 "[ . 1 . 2]" 1
1464 1 44 LEU HB2 1 44 LEU MD1 . . 3.350 3.179 3.132 3.192 . 0 0 "[ . 1 . 2]" 1
1465 1 44 LEU HB2 1 44 LEU QD . . 2.930 2.182 1.959 2.271 . 0 0 "[ . 1 . 2]" 1
1466 1 44 LEU HB2 1 44 LEU MD2 . . 3.350 2.224 1.979 2.325 . 0 0 "[ . 1 . 2]" 1
1467 1 44 LEU HB2 1 45 SER H . . 3.280 2.335 2.240 2.385 . 0 0 "[ . 1 . 2]" 1
1468 1 44 LEU HB2 1 45 SER HB2 . . 5.060 4.104 4.038 4.160 . 0 0 "[ . 1 . 2]" 1
1469 1 44 LEU HB3 1 44 LEU QD . . 2.920 2.379 2.306 2.507 . 0 0 "[ . 1 . 2]" 1
1470 1 44 LEU HB3 1 45 SER H . . 3.530 3.203 3.144 3.294 . 0 0 "[ . 1 . 2]" 1
1471 1 44 LEU HB3 1 45 SER HA . . 4.570 4.141 4.085 4.213 . 0 0 "[ . 1 . 2]" 1
1472 1 44 LEU HB3 1 45 SER HB2 . . 5.080 4.912 4.821 5.035 . 0 0 "[ . 1 . 2]" 1
1473 1 44 LEU QD 1 45 SER H . . 4.260 3.592 3.419 3.661 . 0 0 "[ . 1 . 2]" 1
1474 1 44 LEU QD 1 45 SER HB2 . . 5.340 5.052 4.845 5.157 . 0 0 "[ . 1 . 2]" 1
1475 1 44 LEU MD1 1 45 SER H . . 5.200 4.499 4.359 4.562 . 0 0 "[ . 1 . 2]" 1
1476 1 44 LEU MD2 1 45 SER H . . 5.200 3.777 3.571 3.869 . 0 0 "[ . 1 . 2]" 1
1477 1 44 LEU HG 1 45 SER H . . 4.810 4.819 4.809 4.845 0.035 20 0 "[ . 1 . 2]" 1
1478 1 45 SER H 1 45 SER HB2 . . 3.240 2.206 2.190 2.216 . 0 0 "[ . 1 . 2]" 1
1479 1 45 SER H 1 45 SER HB3 . . 3.180 2.939 2.921 2.964 . 0 0 "[ . 1 . 2]" 1
1480 1 45 SER H 1 46 GLU H . . 3.240 2.870 2.792 2.956 . 0 0 "[ . 1 . 2]" 1
1481 1 45 SER H 1 46 GLU HG2 . . 5.080 5.029 4.947 5.090 0.010 18 0 "[ . 1 . 2]" 1
1482 1 45 SER H 1 47 ARG H . . 4.050 3.910 3.801 4.040 . 0 0 "[ . 1 . 2]" 1
1483 1 45 SER HA 1 45 SER HB2 . . 2.960 2.637 2.625 2.651 . 0 0 "[ . 1 . 2]" 1
1484 1 45 SER HA 1 47 ARG QG . . 4.680 4.237 4.029 4.687 0.007 4 0 "[ . 1 . 2]" 1
1485 1 45 SER HB2 1 46 GLU H . . 4.130 3.535 3.465 3.620 . 0 0 "[ . 1 . 2]" 1
1486 1 45 SER HB2 1 46 GLU HG2 . . 4.940 4.675 4.546 4.799 . 0 0 "[ . 1 . 2]" 1
1487 1 45 SER HB2 1 47 ARG H . . 5.220 5.139 5.068 5.204 . 0 0 "[ . 1 . 2]" 1
1488 1 45 SER HB3 1 46 GLU H . . 4.110 2.484 2.320 2.641 . 0 0 "[ . 1 . 2]" 1
1489 1 45 SER HB3 1 46 GLU HG2 . . 4.960 2.991 2.823 3.144 . 0 0 "[ . 1 . 2]" 1
1490 1 46 GLU H 1 46 GLU HB2 . . 3.310 2.362 2.318 2.398 . 0 0 "[ . 1 . 2]" 1
1491 1 46 GLU H 1 46 GLU HB3 . . 3.890 3.592 3.577 3.608 . 0 0 "[ . 1 . 2]" 1
1492 1 46 GLU H 1 46 GLU HG2 . . 3.400 2.639 2.505 2.782 . 0 0 "[ . 1 . 2]" 1
1493 1 46 GLU H 1 46 GLU HG3 . . 4.060 3.883 3.674 4.038 . 0 0 "[ . 1 . 2]" 1
1494 1 46 GLU H 1 47 ARG H . . 2.900 2.635 2.513 2.762 . 0 0 "[ . 1 . 2]" 1
1495 1 46 GLU H 1 47 ARG HA . . 5.020 4.714 4.641 4.803 . 0 0 "[ . 1 . 2]" 1
1496 1 46 GLU H 1 48 VAL MG2 . . 4.480 3.610 3.330 3.896 . 0 0 "[ . 1 . 2]" 1
1497 1 46 GLU HA 1 46 GLU HG2 . . 3.830 2.968 2.847 3.078 . 0 0 "[ . 1 . 2]" 1
1498 1 46 GLU HA 1 46 GLU HG3 . . 4.060 3.702 3.650 3.753 . 0 0 "[ . 1 . 2]" 1
1499 1 46 GLU HA 1 47 ARG H . . 3.520 3.157 3.076 3.231 . 0 0 "[ . 1 . 2]" 1
1500 1 46 GLU HA 1 47 ARG QG . . 4.990 4.089 3.723 5.001 0.011 4 0 "[ . 1 . 2]" 1
1501 1 46 GLU HB2 1 47 ARG H . . 4.720 3.766 3.628 3.907 . 0 0 "[ . 1 . 2]" 1
1502 1 46 GLU HB2 1 48 VAL H . . 4.290 3.278 3.140 3.434 . 0 0 "[ . 1 . 2]" 1
1503 1 46 GLU HB2 1 48 VAL MG2 . . 3.220 2.000 1.920 2.253 . 0 0 "[ . 1 . 2]" 1
1504 1 46 GLU HB2 1 66 TYR QE . . 4.110 3.083 2.695 3.494 . 0 0 "[ . 1 . 2]" 1
1505 1 46 GLU HB3 1 47 ARG H . . 4.330 4.298 4.241 4.347 0.017 9 0 "[ . 1 . 2]" 1
1506 1 46 GLU HB3 1 48 VAL H . . 5.270 3.885 3.765 4.058 . 0 0 "[ . 1 . 2]" 1
1507 1 46 GLU HB3 1 48 VAL MG2 . . 3.820 2.398 2.229 2.534 . 0 0 "[ . 1 . 2]" 1
1508 1 46 GLU HB3 1 66 TYR QE . . 4.360 3.637 2.906 4.312 . 0 0 "[ . 1 . 2]" 1
1509 1 46 GLU HG2 1 47 ARG H . . 5.040 4.842 4.711 4.980 . 0 0 "[ . 1 . 2]" 1
1510 1 46 GLU HG2 1 48 VAL MG2 . . 4.410 4.056 3.951 4.248 . 0 0 "[ . 1 . 2]" 1
1511 1 46 GLU HG2 1 65 PRO QB . . 4.780 4.544 4.176 4.782 0.002 13 0 "[ . 1 . 2]" 1
1512 1 46 GLU HG2 1 65 PRO HG2 . . 4.690 3.965 3.299 4.682 . 0 0 "[ . 1 . 2]" 1
1513 1 46 GLU HG2 1 65 PRO QG . . 4.130 3.382 2.848 4.134 0.004 14 0 "[ . 1 . 2]" 1
1514 1 46 GLU HG2 1 65 PRO HG3 . . 4.690 3.683 3.114 4.602 . 0 0 "[ . 1 . 2]" 1
1515 1 46 GLU HG2 1 66 TYR QE . . 4.840 3.855 2.840 4.802 . 0 0 "[ . 1 . 2]" 1
1516 1 46 GLU HG3 1 48 VAL MG2 . . 4.470 3.539 3.451 3.645 . 0 0 "[ . 1 . 2]" 1
1517 1 46 GLU HG3 1 65 PRO HG2 . . 4.220 2.894 2.422 3.245 . 0 0 "[ . 1 . 2]" 1
1518 1 46 GLU HG3 1 65 PRO QG . . 3.690 2.573 2.127 2.922 . 0 0 "[ . 1 . 2]" 1
1519 1 46 GLU HG3 1 65 PRO HG3 . . 4.220 2.926 2.206 3.319 . 0 0 "[ . 1 . 2]" 1
1520 1 46 GLU HG3 1 66 TYR QE . . 4.620 2.648 1.994 3.724 . 0 0 "[ . 1 . 2]" 1
1521 1 47 ARG H 1 47 ARG HA . . 2.510 2.296 2.284 2.315 . 0 0 "[ . 1 . 2]" 1
1522 1 47 ARG H 1 47 ARG QB . . 3.520 3.225 3.155 3.311 . 0 0 "[ . 1 . 2]" 1
1523 1 47 ARG H 1 47 ARG HD2 . . 4.400 3.847 3.200 4.388 . 0 0 "[ . 1 . 2]" 1
1524 1 47 ARG H 1 47 ARG QD . . 3.790 3.103 2.211 3.668 . 0 0 "[ . 1 . 2]" 1
1525 1 47 ARG H 1 47 ARG HD3 . . 4.400 3.516 2.241 4.394 . 0 0 "[ . 1 . 2]" 1
1526 1 47 ARG H 1 47 ARG QG . . 3.030 2.571 2.324 2.947 . 0 0 "[ . 1 . 2]" 1
1527 1 47 ARG H 1 48 VAL MG2 . . 4.080 3.937 3.813 4.052 . 0 0 "[ . 1 . 2]" 1
1528 1 47 ARG HA 1 47 ARG HD2 . . 4.380 2.611 2.002 4.221 . 0 0 "[ . 1 . 2]" 1
1529 1 47 ARG HA 1 47 ARG QD . . 3.750 2.309 1.992 3.368 . 0 0 "[ . 1 . 2]" 1
1530 1 47 ARG HA 1 47 ARG HD3 . . 4.380 3.056 2.193 4.017 . 0 0 "[ . 1 . 2]" 1
1531 1 47 ARG HA 1 47 ARG QG . . 3.170 2.788 2.313 2.965 . 0 0 "[ . 1 . 2]" 1
1532 1 47 ARG HA 1 48 VAL H . . 3.160 2.818 2.723 2.892 . 0 0 "[ . 1 . 2]" 1
1533 1 47 ARG HA 1 48 VAL MG2 . . 4.670 4.474 4.328 4.587 . 0 0 "[ . 1 . 2]" 1
1534 1 47 ARG QB 1 48 VAL HA . . 4.590 4.387 4.360 4.418 . 0 0 "[ . 1 . 2]" 1
1535 1 47 ARG HB2 1 48 VAL H . . 5.240 4.209 4.143 4.307 . 0 0 "[ . 1 . 2]" 1
1536 1 47 ARG HB3 1 48 VAL H . . 5.240 4.441 4.390 4.493 . 0 0 "[ . 1 . 2]" 1
1537 1 47 ARG QD 1 48 VAL H . . 5.340 4.722 4.416 5.079 . 0 0 "[ . 1 . 2]" 1
1538 1 48 VAL H 1 48 VAL HB . . 3.160 2.554 2.487 2.636 . 0 0 "[ . 1 . 2]" 1
1539 1 48 VAL H 1 48 VAL MG1 . . 3.860 3.764 3.759 3.770 . 0 0 "[ . 1 . 2]" 1
1540 1 48 VAL H 1 48 VAL MG2 . . 3.000 2.052 1.906 2.305 . 0 0 "[ . 1 . 2]" 1
1541 1 48 VAL H 1 49 ASN H . . 4.550 4.265 4.099 4.355 . 0 0 "[ . 1 . 2]" 1
1542 1 48 VAL H 1 52 LEU QD . . 4.820 4.215 3.987 4.821 0.001 19 0 "[ . 1 . 2]" 1
1543 1 48 VAL HA 1 48 VAL MG1 . . 3.040 2.330 2.248 2.398 . 0 0 "[ . 1 . 2]" 1
1544 1 48 VAL HA 1 48 VAL MG2 . . 3.140 2.421 2.329 2.485 . 0 0 "[ . 1 . 2]" 1
1545 1 48 VAL HA 1 49 ASN H . . 2.700 2.200 2.161 2.279 . 0 0 "[ . 1 . 2]" 1
1546 1 48 VAL HA 1 49 ASN HA . . 4.650 4.443 4.418 4.500 . 0 0 "[ . 1 . 2]" 1
1547 1 48 VAL HA 1 49 ASN HB3 . . 5.100 4.661 4.573 4.768 . 0 0 "[ . 1 . 2]" 1
1548 1 48 VAL HA 1 52 LEU HB2 . . 4.250 3.960 3.422 4.236 . 0 0 "[ . 1 . 2]" 1
1549 1 48 VAL HA 1 52 LEU QB . . 3.570 2.953 2.634 3.133 . 0 0 "[ . 1 . 2]" 1
1550 1 48 VAL HA 1 52 LEU HB3 . . 4.250 3.049 2.738 3.247 . 0 0 "[ . 1 . 2]" 1
1551 1 48 VAL HA 1 52 LEU MD1 . . 4.570 4.238 2.796 4.587 0.017 3 0 "[ . 1 . 2]" 1
1552 1 48 VAL HA 1 52 LEU QD . . 3.160 2.154 1.918 3.000 . 0 0 "[ . 1 . 2]" 1
1553 1 48 VAL HA 1 52 LEU MD2 . . 4.570 2.444 1.920 4.506 . 0 0 "[ . 1 . 2]" 1
1554 1 48 VAL HA 1 52 LEU HG . . 4.940 3.672 2.492 4.310 . 0 0 "[ . 1 . 2]" 1
1555 1 48 VAL HB 1 49 ASN H . . 4.550 4.426 4.354 4.486 . 0 0 "[ . 1 . 2]" 1
1556 1 48 VAL HB 1 53 LEU QD . . 5.440 4.604 3.966 5.202 . 0 0 "[ . 1 . 2]" 1
1557 1 48 VAL MG1 1 49 ASN H . . 3.710 3.126 2.940 3.402 . 0 0 "[ . 1 . 2]" 1
1558 1 48 VAL MG1 1 49 ASN HA . . 4.660 4.119 3.980 4.251 . 0 0 "[ . 1 . 2]" 1
1559 1 48 VAL MG1 1 50 GLY HA2 . . 5.090 4.704 4.591 4.844 . 0 0 "[ . 1 . 2]" 1
1560 1 48 VAL MG1 1 52 LEU H . . 4.440 4.283 4.109 4.439 . 0 0 "[ . 1 . 2]" 1
1561 1 48 VAL MG1 1 52 LEU HB2 . . 4.140 3.853 3.573 4.112 . 0 0 "[ . 1 . 2]" 1
1562 1 48 VAL MG1 1 52 LEU QB . . 3.270 2.354 2.038 2.636 . 0 0 "[ . 1 . 2]" 1
1563 1 48 VAL MG1 1 52 LEU HB3 . . 4.140 2.376 2.050 2.668 . 0 0 "[ . 1 . 2]" 1
1564 1 48 VAL MG1 1 53 LEU H . . 3.600 3.091 2.776 3.334 . 0 0 "[ . 1 . 2]" 1
1565 1 48 VAL MG1 1 53 LEU HA . . 3.500 2.945 2.779 3.207 . 0 0 "[ . 1 . 2]" 1
1566 1 48 VAL MG1 1 53 LEU HB2 . . 3.790 2.847 2.660 2.939 . 0 0 "[ . 1 . 2]" 1
1567 1 48 VAL MG1 1 53 LEU HB3 . . 4.280 4.221 4.054 4.294 0.014 3 0 "[ . 1 . 2]" 1
1568 1 48 VAL MG1 1 53 LEU QD . . 4.050 2.867 2.057 3.547 . 0 0 "[ . 1 . 2]" 1
1569 1 48 VAL MG1 1 56 LEU H . . 5.500 5.346 5.168 5.504 0.004 16 0 "[ . 1 . 2]" 1
1570 1 48 VAL MG1 1 56 LEU MD1 . . 4.220 2.155 1.893 2.401 . 0 0 "[ . 1 . 2]" 1
1571 1 48 VAL MG1 1 56 LEU QD . . 3.300 2.146 1.889 2.385 . 0 0 "[ . 1 . 2]" 1
1572 1 48 VAL MG1 1 56 LEU MD2 . . 4.220 3.947 3.660 4.086 . 0 0 "[ . 1 . 2]" 1
1573 1 48 VAL MG1 1 61 PHE HZ . . 5.500 5.106 4.499 5.507 0.007 8 0 "[ . 1 . 2]" 1
1574 1 48 VAL MG1 1 66 TYR QE . . 4.530 4.122 3.352 4.543 0.013 3 0 "[ . 1 . 2]" 1
1575 1 48 VAL MG2 1 49 ASN H . . 5.020 4.238 4.174 4.288 . 0 0 "[ . 1 . 2]" 1
1576 1 48 VAL MG2 1 56 LEU MD1 . . 4.610 3.238 2.971 3.488 . 0 0 "[ . 1 . 2]" 1
1577 1 48 VAL MG2 1 56 LEU QD . . 3.700 3.138 2.897 3.371 . 0 0 "[ . 1 . 2]" 1
1578 1 48 VAL MG2 1 56 LEU MD2 . . 4.610 4.225 3.774 4.469 . 0 0 "[ . 1 . 2]" 1
1579 1 48 VAL MG2 1 66 TYR QD . . 4.670 4.229 3.880 4.522 . 0 0 "[ . 1 . 2]" 1
1580 1 48 VAL MG2 1 66 TYR QE . . 3.270 2.580 1.995 3.055 . 0 0 "[ . 1 . 2]" 1
1581 1 49 ASN H 1 49 ASN HB2 . . 4.130 3.644 3.601 3.684 . 0 0 "[ . 1 . 2]" 1
1582 1 49 ASN H 1 49 ASN HB3 . . 3.730 2.639 2.472 2.724 . 0 0 "[ . 1 . 2]" 1
1583 1 49 ASN H 1 49 ASN HD21 . . 5.190 3.424 1.801 4.653 . 0 0 "[ . 1 . 2]" 1
1584 1 49 ASN H 1 49 ASN QD . . 4.490 3.142 1.791 4.158 . 0 0 "[ . 1 . 2]" 1
1585 1 49 ASN H 1 49 ASN HD22 . . 5.190 3.930 3.155 4.690 . 0 0 "[ . 1 . 2]" 1
1586 1 49 ASN H 1 50 GLY H . . 5.080 4.574 4.513 4.624 . 0 0 "[ . 1 . 2]" 1
1587 1 49 ASN H 1 51 ARG H . . 5.500 5.477 5.150 5.533 0.033 18 0 "[ . 1 . 2]" 1
1588 1 49 ASN H 1 52 LEU H . . 4.220 3.809 3.614 3.988 . 0 0 "[ . 1 . 2]" 1
1589 1 49 ASN H 1 52 LEU HB2 . . 3.750 3.325 2.634 3.686 . 0 0 "[ . 1 . 2]" 1
1590 1 49 ASN H 1 52 LEU QB . . 3.130 2.547 2.286 2.780 . 0 0 "[ . 1 . 2]" 1
1591 1 49 ASN H 1 52 LEU HB3 . . 3.750 2.657 2.456 2.889 . 0 0 "[ . 1 . 2]" 1
1592 1 49 ASN H 1 52 LEU MD1 . . 5.220 4.725 3.766 5.155 . 0 0 "[ . 1 . 2]" 1
1593 1 49 ASN H 1 52 LEU QD . . 3.810 3.014 2.552 3.748 . 0 0 "[ . 1 . 2]" 1
1594 1 49 ASN H 1 52 LEU MD2 . . 5.220 3.197 2.562 4.720 . 0 0 "[ . 1 . 2]" 1
1595 1 49 ASN H 1 52 LEU HG . . 4.930 4.460 3.424 4.934 0.004 18 0 "[ . 1 . 2]" 1
1596 1 49 ASN H 1 53 LEU H . . 4.750 4.467 4.137 4.751 0.001 13 0 "[ . 1 . 2]" 1
1597 1 49 ASN HA 1 50 GLY H . . 3.360 2.442 2.344 2.587 . 0 0 "[ . 1 . 2]" 1
1598 1 49 ASN HA 1 51 ARG H . . 5.130 4.878 4.578 5.094 . 0 0 "[ . 1 . 2]" 1
1599 1 49 ASN HB2 1 50 GLY H . . 3.060 2.419 2.121 2.659 . 0 0 "[ . 1 . 2]" 1
1600 1 49 ASN HB2 1 50 GLY HA2 . . 5.500 4.898 4.714 5.076 . 0 0 "[ . 1 . 2]" 1
1601 1 49 ASN HB2 1 52 LEU H . . 4.840 4.347 4.152 4.598 . 0 0 "[ . 1 . 2]" 1
1602 1 49 ASN HB3 1 50 GLY H . . 4.040 3.817 3.620 3.991 . 0 0 "[ . 1 . 2]" 1
1603 1 49 ASN HB3 1 51 ARG H . . 5.430 5.030 4.692 5.230 . 0 0 "[ . 1 . 2]" 1
1604 1 49 ASN QD 1 51 ARG H . . 4.760 3.631 2.021 4.692 . 0 0 "[ . 1 . 2]" 1
1605 1 50 GLY H 1 51 ARG H . . 3.600 3.120 2.949 3.334 . 0 0 "[ . 1 . 2]" 1
1606 1 50 GLY H 1 51 ARG HB2 . . 5.500 5.087 4.909 5.292 . 0 0 "[ . 1 . 2]" 1
1607 1 50 GLY H 1 52 LEU H . . 4.740 4.416 4.141 4.763 0.023 17 0 "[ . 1 . 2]" 1
1608 1 50 GLY H 1 53 LEU HB2 . . 5.500 4.777 4.414 5.027 . 0 0 "[ . 1 . 2]" 1
1609 1 50 GLY H 1 53 LEU HB3 . . 5.500 5.226 4.858 5.486 . 0 0 "[ . 1 . 2]" 1
1610 1 50 GLY H 1 53 LEU QD . . 4.950 4.864 4.545 4.968 0.018 17 0 "[ . 1 . 2]" 1
1611 1 50 GLY HA2 1 51 ARG HA . . 5.500 4.856 4.826 4.894 . 0 0 "[ . 1 . 2]" 1
1612 1 50 GLY HA2 1 53 LEU H . . 4.050 3.324 3.100 3.616 . 0 0 "[ . 1 . 2]" 1
1613 1 50 GLY HA2 1 53 LEU HA . . 5.500 5.108 4.905 5.368 . 0 0 "[ . 1 . 2]" 1
1614 1 50 GLY HA2 1 53 LEU HB2 . . 3.980 2.889 2.510 3.142 . 0 0 "[ . 1 . 2]" 1
1615 1 50 GLY HA2 1 53 LEU HB3 . . 3.710 2.703 2.347 3.005 . 0 0 "[ . 1 . 2]" 1
1616 1 50 GLY HA2 1 53 LEU MD1 . . 5.030 3.905 2.758 4.793 . 0 0 "[ . 1 . 2]" 1
1617 1 50 GLY HA2 1 53 LEU QD . . 3.870 3.012 2.736 3.218 . 0 0 "[ . 1 . 2]" 1
1618 1 50 GLY HA2 1 53 LEU MD2 . . 5.030 3.798 2.924 4.865 . 0 0 "[ . 1 . 2]" 1
1619 1 50 GLY HA2 1 54 LEU H . . 4.890 4.194 3.890 4.644 . 0 0 "[ . 1 . 2]" 1
1620 1 50 GLY HA2 1 54 LEU HG . . 5.380 4.545 4.279 4.818 . 0 0 "[ . 1 . 2]" 1
1621 1 50 GLY HA3 1 51 ARG H . . 3.390 2.580 2.489 2.733 . 0 0 "[ . 1 . 2]" 1
1622 1 50 GLY HA3 1 51 ARG HA . . 4.810 4.302 4.290 4.321 . 0 0 "[ . 1 . 2]" 1
1623 1 50 GLY HA3 1 51 ARG HB2 . . 5.260 4.684 4.604 4.796 . 0 0 "[ . 1 . 2]" 1
1624 1 50 GLY HA3 1 53 LEU H . . 4.610 4.435 4.253 4.624 0.014 15 0 "[ . 1 . 2]" 1
1625 1 50 GLY HA3 1 53 LEU HB2 . . 4.810 4.586 4.214 4.822 0.012 19 0 "[ . 1 . 2]" 1
1626 1 50 GLY HA3 1 53 LEU HB3 . . 4.520 4.216 3.879 4.518 . 0 0 "[ . 1 . 2]" 1
1627 1 50 GLY HA3 1 53 LEU QD . . 4.630 4.327 4.088 4.592 . 0 0 "[ . 1 . 2]" 1
1628 1 50 GLY HA3 1 54 LEU QD . . 5.110 4.502 4.142 4.748 . 0 0 "[ . 1 . 2]" 1
1629 1 51 ARG H 1 51 ARG HB2 . . 2.900 2.183 2.139 2.316 . 0 0 "[ . 1 . 2]" 1
1630 1 51 ARG H 1 51 ARG HB3 . . 3.110 2.985 2.800 3.132 0.022 16 0 "[ . 1 . 2]" 1
1631 1 51 ARG H 1 51 ARG HD2 . . 5.500 4.903 3.730 5.368 . 0 0 "[ . 1 . 2]" 1
1632 1 51 ARG H 1 51 ARG HD3 . . 5.500 4.994 4.330 5.558 0.058 16 0 "[ . 1 . 2]" 1
1633 1 51 ARG H 1 51 ARG HG2 . . 4.580 4.100 3.882 4.616 0.036 17 0 "[ . 1 . 2]" 1
1634 1 51 ARG H 1 51 ARG QG . . 3.860 3.783 3.658 4.001 0.141 17 0 "[ . 1 . 2]" 1
1635 1 51 ARG H 1 51 ARG HG3 . . 4.580 4.453 4.374 4.561 . 0 0 "[ . 1 . 2]" 1
1636 1 51 ARG H 1 53 LEU H . . 4.500 4.228 4.056 4.484 . 0 0 "[ . 1 . 2]" 1
1637 1 51 ARG H 1 54 LEU QD . . 4.780 4.563 4.223 4.768 . 0 0 "[ . 1 . 2]" 1
1638 1 51 ARG HA 1 51 ARG QD . . 3.630 2.759 2.345 3.093 . 0 0 "[ . 1 . 2]" 1
1639 1 51 ARG HA 1 51 ARG HG2 . . 3.790 2.391 2.208 3.627 . 0 0 "[ . 1 . 2]" 1
1640 1 51 ARG HA 1 51 ARG QG . . 3.020 2.302 2.186 2.466 . 0 0 "[ . 1 . 2]" 1
1641 1 51 ARG HA 1 51 ARG HG3 . . 3.790 3.524 2.430 3.653 . 0 0 "[ . 1 . 2]" 1
1642 1 51 ARG HA 1 53 LEU H . . 4.740 4.498 4.229 4.744 0.004 6 0 "[ . 1 . 2]" 1
1643 1 51 ARG HA 1 54 LEU H . . 4.280 3.755 3.489 3.962 . 0 0 "[ . 1 . 2]" 1
1644 1 51 ARG HA 1 54 LEU HB2 . . 4.370 3.183 2.854 3.533 . 0 0 "[ . 1 . 2]" 1
1645 1 51 ARG HA 1 54 LEU HB3 . . 5.500 4.792 4.481 5.156 . 0 0 "[ . 1 . 2]" 1
1646 1 51 ARG HA 1 54 LEU QD . . 3.320 2.895 2.270 3.154 . 0 0 "[ . 1 . 2]" 1
1647 1 51 ARG HA 1 54 LEU HG . . 4.480 4.127 3.594 4.467 . 0 0 "[ . 1 . 2]" 1
1648 1 51 ARG HA 1 55 THR H . . 5.400 4.474 4.000 4.699 . 0 0 "[ . 1 . 2]" 1
1649 1 51 ARG HA 1 55 THR MG . . 4.440 4.118 3.600 4.430 . 0 0 "[ . 1 . 2]" 1
1650 1 51 ARG HB2 1 52 LEU H . . 3.750 3.531 3.270 3.695 . 0 0 "[ . 1 . 2]" 1
1651 1 51 ARG HB2 1 54 LEU QD . . 5.440 4.927 4.334 5.131 . 0 0 "[ . 1 . 2]" 1
1652 1 51 ARG HB3 1 51 ARG QD . . 3.650 2.312 2.096 3.232 . 0 0 "[ . 1 . 2]" 1
1653 1 51 ARG HB3 1 52 LEU H . . 3.020 2.500 2.049 2.806 . 0 0 "[ . 1 . 2]" 1
1654 1 51 ARG QD 1 51 ARG QG . . 2.360 2.075 2.025 2.090 . 0 0 "[ . 1 . 2]" 1
1655 1 51 ARG QD 1 52 LEU H . . 4.720 3.704 2.982 4.754 0.034 17 0 "[ . 1 . 2]" 1
1656 1 51 ARG QD 1 54 LEU QD . . 4.850 4.131 3.565 4.655 . 0 0 "[ . 1 . 2]" 1
1657 1 51 ARG QD 1 55 THR MG . . 4.530 2.483 1.893 4.321 . 0 0 "[ . 1 . 2]" 1
1658 1 51 ARG HD2 1 52 LEU H . . 5.490 4.014 3.074 5.203 . 0 0 "[ . 1 . 2]" 1
1659 1 51 ARG HD2 1 55 THR MG . . 5.170 3.106 2.238 4.626 . 0 0 "[ . 1 . 2]" 1
1660 1 51 ARG HD3 1 52 LEU H . . 5.490 4.465 3.819 5.498 0.008 17 0 "[ . 1 . 2]" 1
1661 1 51 ARG HD3 1 55 THR MG . . 5.170 2.697 1.966 5.184 0.014 17 0 "[ . 1 . 2]" 1
1662 1 51 ARG QG 1 52 LEU H . . 5.100 4.338 3.690 4.556 . 0 0 "[ . 1 . 2]" 1
1663 1 52 LEU H 1 52 LEU HB2 . . 3.240 2.547 2.321 2.764 . 0 0 "[ . 1 . 2]" 1
1664 1 52 LEU H 1 52 LEU QB . . 2.810 2.232 2.195 2.261 . 0 0 "[ . 1 . 2]" 1
1665 1 52 LEU H 1 52 LEU HB3 . . 3.240 2.497 2.354 2.707 . 0 0 "[ . 1 . 2]" 1
1666 1 52 LEU H 1 52 LEU MD1 . . 4.580 4.130 4.002 4.224 . 0 0 "[ . 1 . 2]" 1
1667 1 52 LEU H 1 52 LEU QD . . 4.020 3.678 3.550 3.741 . 0 0 "[ . 1 . 2]" 1
1668 1 52 LEU H 1 52 LEU MD2 . . 4.580 4.140 3.816 4.267 . 0 0 "[ . 1 . 2]" 1
1669 1 52 LEU H 1 52 LEU HG . . 4.500 4.476 4.360 4.576 0.076 6 0 "[ . 1 . 2]" 1
1670 1 52 LEU H 1 53 LEU H . . 3.110 2.598 2.384 2.856 . 0 0 "[ . 1 . 2]" 1
1671 1 52 LEU H 1 54 LEU H . . 4.840 4.188 3.955 4.534 . 0 0 "[ . 1 . 2]" 1
1672 1 52 LEU H 1 55 THR MG . . 4.820 4.473 3.917 4.792 . 0 0 "[ . 1 . 2]" 1
1673 1 52 LEU H 1 56 LEU QD . . 5.440 5.347 5.108 5.455 0.015 6 0 "[ . 1 . 2]" 1
1674 1 52 LEU HA 1 52 LEU MD1 . . 4.220 2.228 1.937 3.065 . 0 0 "[ . 1 . 2]" 1
1675 1 52 LEU HA 1 52 LEU QD . . 2.900 2.021 1.919 2.203 . 0 0 "[ . 1 . 2]" 1
1676 1 52 LEU HA 1 52 LEU MD2 . . 4.220 3.502 1.940 3.938 . 0 0 "[ . 1 . 2]" 1
1677 1 52 LEU HA 1 52 LEU HG . . 3.710 3.306 2.974 3.714 0.004 19 0 "[ . 1 . 2]" 1
1678 1 52 LEU HA 1 54 LEU H . . 5.220 4.246 3.609 4.713 . 0 0 "[ . 1 . 2]" 1
1679 1 52 LEU HA 1 55 THR H . . 4.460 3.466 3.273 3.727 . 0 0 "[ . 1 . 2]" 1
1680 1 52 LEU HA 1 55 THR HG1 . . 4.320 2.430 2.011 4.325 0.005 3 0 "[ . 1 . 2]" 1
1681 1 52 LEU HA 1 55 THR MG . . 3.380 2.684 1.869 2.987 . 0 0 "[ . 1 . 2]" 1
1682 1 52 LEU QB 1 52 LEU QD . . 2.790 1.948 1.889 2.011 . 0 0 "[ . 1 . 2]" 1
1683 1 52 LEU QB 1 53 LEU H . . 3.330 2.599 2.332 2.788 . 0 0 "[ . 1 . 2]" 1
1684 1 52 LEU QB 1 56 LEU QD . . 4.750 3.715 3.292 3.907 . 0 0 "[ . 1 . 2]" 1
1685 1 52 LEU HB2 1 53 LEU H . . 4.200 3.894 3.608 4.062 . 0 0 "[ . 1 . 2]" 1
1686 1 52 LEU HB3 1 53 LEU H . . 4.200 2.640 2.362 2.840 . 0 0 "[ . 1 . 2]" 1
1687 1 52 LEU QD 1 53 LEU HA . . 4.690 3.953 2.665 4.426 . 0 0 "[ . 1 . 2]" 1
1688 1 52 LEU QD 1 55 THR H . . 4.500 4.245 3.937 4.502 0.002 14 0 "[ . 1 . 2]" 1
1689 1 52 LEU QD 1 55 THR HB . . 4.180 4.012 3.756 4.237 0.057 3 0 "[ . 1 . 2]" 1
1690 1 52 LEU QD 1 55 THR HG1 . . 4.310 2.397 2.102 3.047 . 0 0 "[ . 1 . 2]" 1
1691 1 52 LEU QD 1 56 LEU H . . 4.770 3.722 3.323 4.224 . 0 0 "[ . 1 . 2]" 1
1692 1 52 LEU QD 1 56 LEU QD . . 3.140 2.440 1.742 3.022 . 0 0 "[ . 1 . 2]" 1
1693 1 52 LEU QD 1 66 TYR QE . . 5.080 4.035 3.512 4.511 . 0 0 "[ . 1 . 2]" 1
1694 1 52 LEU MD1 1 56 LEU MD1 . . 4.520 3.169 1.830 4.177 . 0 0 "[ . 1 . 2]" 1
1695 1 52 LEU MD1 1 56 LEU MD2 . . 4.520 2.841 2.136 3.910 . 0 0 "[ . 1 . 2]" 1
1696 1 52 LEU MD2 1 56 LEU MD1 . . 4.520 3.421 3.034 4.201 . 0 0 "[ . 1 . 2]" 1
1697 1 52 LEU MD2 1 56 LEU MD2 . . 4.520 3.687 3.089 4.217 . 0 0 "[ . 1 . 2]" 1
1698 1 52 LEU HG 1 53 LEU H . . 5.250 4.044 3.636 4.748 . 0 0 "[ . 1 . 2]" 1
1699 1 52 LEU HG 1 53 LEU HA . . 5.500 4.123 3.564 5.542 0.042 6 0 "[ . 1 . 2]" 1
1700 1 52 LEU HG 1 56 LEU MD1 . . 4.720 2.809 2.118 4.367 . 0 0 "[ . 1 . 2]" 1
1701 1 52 LEU HG 1 56 LEU MD2 . . 4.720 3.669 3.078 4.599 . 0 0 "[ . 1 . 2]" 1
1702 1 53 LEU H 1 53 LEU HB2 . . 3.100 2.327 2.182 2.526 . 0 0 "[ . 1 . 2]" 1
1703 1 53 LEU H 1 53 LEU HB3 . . 3.150 2.706 2.479 2.887 . 0 0 "[ . 1 . 2]" 1
1704 1 53 LEU H 1 53 LEU MD1 . . 4.500 4.037 3.773 4.204 . 0 0 "[ . 1 . 2]" 1
1705 1 53 LEU H 1 53 LEU QD . . 3.860 3.668 3.520 3.740 . 0 0 "[ . 1 . 2]" 1
1706 1 53 LEU H 1 53 LEU MD2 . . 4.500 4.220 4.172 4.274 . 0 0 "[ . 1 . 2]" 1
1707 1 53 LEU H 1 53 LEU HG . . 4.500 4.387 4.166 4.554 0.054 2 0 "[ . 1 . 2]" 1
1708 1 53 LEU H 1 54 LEU H . . 3.540 2.737 2.613 2.896 . 0 0 "[ . 1 . 2]" 1
1709 1 53 LEU H 1 54 LEU QD . . 5.440 5.002 4.803 5.193 . 0 0 "[ . 1 . 2]" 1
1710 1 53 LEU H 1 56 LEU QD . . 4.850 3.880 3.758 4.132 . 0 0 "[ . 1 . 2]" 1
1711 1 53 LEU HA 1 53 LEU MD1 . . 3.990 2.960 2.167 3.842 . 0 0 "[ . 1 . 2]" 1
1712 1 53 LEU HA 1 53 LEU QD . . 2.750 2.349 2.156 2.689 . 0 0 "[ . 1 . 2]" 1
1713 1 53 LEU HA 1 53 LEU MD2 . . 3.990 3.271 2.219 3.933 . 0 0 "[ . 1 . 2]" 1
1714 1 53 LEU HA 1 53 LEU HG . . 4.180 2.812 2.463 3.130 . 0 0 "[ . 1 . 2]" 1
1715 1 53 LEU HA 1 55 THR H . . 4.880 4.759 4.524 4.889 0.009 3 0 "[ . 1 . 2]" 1
1716 1 53 LEU HA 1 56 LEU H . . 4.340 3.722 3.586 3.840 . 0 0 "[ . 1 . 2]" 1
1717 1 53 LEU HA 1 56 LEU HB2 . . 4.640 3.059 2.825 3.283 . 0 0 "[ . 1 . 2]" 1
1718 1 53 LEU HA 1 56 LEU MD1 . . 4.530 2.013 1.883 2.196 . 0 0 "[ . 1 . 2]" 1
1719 1 53 LEU HA 1 56 LEU QD . . 3.160 2.010 1.881 2.191 . 0 0 "[ . 1 . 2]" 1
1720 1 53 LEU HA 1 56 LEU MD2 . . 4.530 4.451 4.203 4.533 0.003 3 0 "[ . 1 . 2]" 1
1721 1 53 LEU HA 1 56 LEU HG . . 3.560 3.353 3.070 3.568 0.008 17 0 "[ . 1 . 2]" 1
1722 1 53 LEU HA 1 61 PHE HZ . . 4.810 3.748 2.976 4.212 . 0 0 "[ . 1 . 2]" 1
1723 1 53 LEU HA 1 81 LEU MD1 . . 5.040 4.624 4.025 5.043 0.003 17 0 "[ . 1 . 2]" 1
1724 1 53 LEU HA 1 81 LEU MD2 . . 5.040 4.606 3.921 5.038 . 0 0 "[ . 1 . 2]" 1
1725 1 53 LEU HB2 1 53 LEU QD . . 3.090 2.147 2.003 2.327 . 0 0 "[ . 1 . 2]" 1
1726 1 53 LEU HB2 1 54 LEU H . . 3.960 3.756 3.527 4.017 0.057 3 0 "[ . 1 . 2]" 1
1727 1 53 LEU HB2 1 81 LEU QD . . 5.440 4.104 3.865 4.289 . 0 0 "[ . 1 . 2]" 1
1728 1 53 LEU HB3 1 53 LEU MD1 . . 3.300 2.790 2.222 3.188 . 0 0 "[ . 1 . 2]" 1
1729 1 53 LEU HB3 1 53 LEU QD . . 2.830 2.145 2.029 2.279 . 0 0 "[ . 1 . 2]" 1
1730 1 53 LEU HB3 1 53 LEU MD2 . . 3.300 2.295 2.122 2.462 . 0 0 "[ . 1 . 2]" 1
1731 1 53 LEU HB3 1 54 LEU H . . 3.560 2.632 2.267 3.188 . 0 0 "[ . 1 . 2]" 1
1732 1 53 LEU HB3 1 54 LEU HA . . 4.790 4.114 3.910 4.331 . 0 0 "[ . 1 . 2]" 1
1733 1 53 LEU HB3 1 54 LEU MD1 . . 5.500 4.839 4.478 5.032 . 0 0 "[ . 1 . 2]" 1
1734 1 53 LEU HB3 1 54 LEU QD . . 4.150 4.045 3.830 4.150 . 0 0 "[ . 1 . 2]" 1
1735 1 53 LEU HB3 1 54 LEU MD2 . . 5.500 4.360 4.023 4.761 . 0 0 "[ . 1 . 2]" 1
1736 1 53 LEU HB3 1 81 LEU MD1 . . 4.890 3.601 3.002 4.192 . 0 0 "[ . 1 . 2]" 1
1737 1 53 LEU HB3 1 81 LEU QD . . 4.240 3.129 2.878 3.382 . 0 0 "[ . 1 . 2]" 1
1738 1 53 LEU HB3 1 81 LEU MD2 . . 4.890 3.624 3.119 4.040 . 0 0 "[ . 1 . 2]" 1
1739 1 53 LEU QD 1 54 LEU H . . 4.800 3.736 3.054 4.343 . 0 0 "[ . 1 . 2]" 1
1740 1 53 LEU QD 1 54 LEU HA . . 5.040 3.820 2.789 4.700 . 0 0 "[ . 1 . 2]" 1
1741 1 53 LEU QD 1 56 LEU HB2 . . 4.570 3.352 2.865 3.954 . 0 0 "[ . 1 . 2]" 1
1742 1 53 LEU QD 1 56 LEU QD . . 3.090 2.601 2.202 3.092 0.002 17 0 "[ . 1 . 2]" 1
1743 1 53 LEU QD 1 61 PHE QE . . 4.340 2.853 2.329 3.353 . 0 0 "[ . 1 . 2]" 1
1744 1 53 LEU QD 1 61 PHE HZ . . 3.020 2.221 1.945 3.017 . 0 0 "[ . 1 . 2]" 1
1745 1 53 LEU QD 1 77 ILE MG . . 3.660 2.660 2.356 2.974 . 0 0 "[ . 1 . 2]" 1
1746 1 53 LEU QD 1 81 LEU QD . . 3.100 1.778 1.581 2.100 . 0 0 "[ . 1 . 2]" 1
1747 1 53 LEU HG 1 54 LEU H . . 5.200 4.476 3.500 5.193 . 0 0 "[ . 1 . 2]" 1
1748 1 53 LEU HG 1 56 LEU QD . . 5.100 3.659 3.081 4.392 . 0 0 "[ . 1 . 2]" 1
1749 1 53 LEU HG 1 61 PHE HZ . . 4.770 3.653 3.081 4.606 . 0 0 "[ . 1 . 2]" 1
1750 1 54 LEU H 1 54 LEU HB2 . . 3.220 2.286 2.204 2.408 . 0 0 "[ . 1 . 2]" 1
1751 1 54 LEU H 1 54 LEU MD1 . . 4.000 3.647 3.388 3.839 . 0 0 "[ . 1 . 2]" 1
1752 1 54 LEU H 1 54 LEU QD . . 3.410 3.291 3.147 3.417 0.007 3 0 "[ . 1 . 2]" 1
1753 1 54 LEU H 1 54 LEU MD2 . . 4.000 3.762 3.478 3.953 . 0 0 "[ . 1 . 2]" 1
1754 1 54 LEU H 1 54 LEU HG . . 3.860 2.690 2.396 2.903 . 0 0 "[ . 1 . 2]" 1
1755 1 54 LEU H 1 55 THR H . . 3.700 2.696 2.412 2.981 . 0 0 "[ . 1 . 2]" 1
1756 1 54 LEU H 1 55 THR MG . . 4.470 4.025 3.220 4.298 . 0 0 "[ . 1 . 2]" 1
1757 1 54 LEU H 1 56 LEU H . . 5.030 4.047 3.514 4.316 . 0 0 "[ . 1 . 2]" 1
1758 1 54 LEU H 1 81 LEU QD . . 5.100 3.845 3.610 4.251 . 0 0 "[ . 1 . 2]" 1
1759 1 54 LEU HA 1 54 LEU QD . . 2.680 2.132 2.013 2.318 . 0 0 "[ . 1 . 2]" 1
1760 1 54 LEU HA 1 54 LEU HG . . 3.750 2.868 2.669 3.038 . 0 0 "[ . 1 . 2]" 1
1761 1 54 LEU HA 1 55 THR MG . . 4.960 4.908 4.747 4.961 0.001 4 0 "[ . 1 . 2]" 1
1762 1 54 LEU HA 1 56 LEU H . . 4.670 4.250 3.652 4.563 . 0 0 "[ . 1 . 2]" 1
1763 1 54 LEU HA 1 81 LEU HB3 . . 5.500 5.077 4.510 5.501 0.001 16 0 "[ . 1 . 2]" 1
1764 1 54 LEU HA 1 81 LEU MD1 . . 3.910 3.650 3.402 3.896 . 0 0 "[ . 1 . 2]" 1
1765 1 54 LEU HA 1 81 LEU QD . . 3.380 2.450 1.971 3.000 . 0 0 "[ . 1 . 2]" 1
1766 1 54 LEU HA 1 81 LEU MD2 . . 3.910 2.528 1.979 3.287 . 0 0 "[ . 1 . 2]" 1
1767 1 54 LEU HB2 1 54 LEU MD1 . . 3.640 2.256 2.147 2.363 . 0 0 "[ . 1 . 2]" 1
1768 1 54 LEU HB2 1 54 LEU QD . . 2.890 2.211 2.114 2.302 . 0 0 "[ . 1 . 2]" 1
1769 1 54 LEU HB2 1 54 LEU MD2 . . 3.640 3.178 3.161 3.193 . 0 0 "[ . 1 . 2]" 1
1770 1 54 LEU HB2 1 55 THR H . . 4.190 2.501 2.359 2.631 . 0 0 "[ . 1 . 2]" 1
1771 1 54 LEU HB2 1 55 THR HA . . 5.020 4.461 4.302 4.561 . 0 0 "[ . 1 . 2]" 1
1772 1 54 LEU HB2 1 55 THR MG . . 3.660 3.246 3.125 3.465 . 0 0 "[ . 1 . 2]" 1
1773 1 54 LEU HB3 1 54 LEU MD1 . . 3.180 2.429 2.316 2.573 . 0 0 "[ . 1 . 2]" 1
1774 1 54 LEU HB3 1 54 LEU QD . . 2.730 2.079 2.020 2.123 . 0 0 "[ . 1 . 2]" 1
1775 1 54 LEU HB3 1 54 LEU MD2 . . 3.180 2.262 2.149 2.330 . 0 0 "[ . 1 . 2]" 1
1776 1 54 LEU HB3 1 55 THR H . . 4.570 3.228 3.032 3.594 . 0 0 "[ . 1 . 2]" 1
1777 1 54 LEU HB3 1 81 LEU QD . . 5.440 4.206 3.608 4.739 . 0 0 "[ . 1 . 2]" 1
1778 1 54 LEU QD 1 55 THR H . . 4.740 3.982 3.890 4.079 . 0 0 "[ . 1 . 2]" 1
1779 1 54 LEU QD 1 55 THR MG . . 4.760 4.162 4.050 4.479 . 0 0 "[ . 1 . 2]" 1
1780 1 54 LEU QD 1 81 LEU HA . . 4.700 4.514 4.119 4.675 . 0 0 "[ . 1 . 2]" 1
1781 1 54 LEU QD 1 81 LEU HB3 . . 4.830 3.967 3.521 4.408 . 0 0 "[ . 1 . 2]" 1
1782 1 54 LEU QD 1 85 ARG HA . . 3.890 3.714 2.907 3.893 0.003 15 0 "[ . 1 . 2]" 1
1783 1 54 LEU QD 1 85 ARG HB2 . . 3.830 2.685 2.056 3.188 . 0 0 "[ . 1 . 2]" 1
1784 1 54 LEU QD 1 85 ARG HB3 . . 3.740 2.628 2.120 2.933 . 0 0 "[ . 1 . 2]" 1
1785 1 54 LEU QD 1 85 ARG QD . . 3.830 2.823 2.307 3.495 . 0 0 "[ . 1 . 2]" 1
1786 1 54 LEU MD1 1 85 ARG HA . . 5.100 4.580 4.096 4.885 . 0 0 "[ . 1 . 2]" 1
1787 1 54 LEU MD2 1 85 ARG HA . . 5.100 3.940 2.974 4.223 . 0 0 "[ . 1 . 2]" 1
1788 1 54 LEU HG 1 55 THR H . . 5.500 4.555 4.398 4.674 . 0 0 "[ . 1 . 2]" 1
1789 1 55 THR H 1 55 THR HB . . 3.850 3.579 2.940 3.616 . 0 0 "[ . 1 . 2]" 1
1790 1 55 THR H 1 55 THR HG1 . . 4.050 2.638 2.155 4.079 0.029 3 0 "[ . 1 . 2]" 1
1791 1 55 THR H 1 55 THR MG . . 3.190 1.940 1.801 2.105 . 0 0 "[ . 1 . 2]" 1
1792 1 55 THR H 1 56 LEU H . . 3.210 2.782 2.609 2.890 . 0 0 "[ . 1 . 2]" 1
1793 1 55 THR H 1 56 LEU HB2 . . 5.120 4.859 4.639 5.028 . 0 0 "[ . 1 . 2]" 1
1794 1 55 THR H 1 56 LEU QD . . 5.440 4.811 4.664 4.918 . 0 0 "[ . 1 . 2]" 1
1795 1 55 THR H 1 56 LEU HG . . 5.130 4.636 4.397 4.857 . 0 0 "[ . 1 . 2]" 1
1796 1 55 THR HA 1 55 THR MG . . 3.250 2.492 2.417 3.150 . 0 0 "[ . 1 . 2]" 1
1797 1 55 THR HB 1 56 LEU H . . 4.520 3.822 3.586 4.284 . 0 0 "[ . 1 . 2]" 1
1798 1 55 THR MG 1 56 LEU H . . 4.250 3.746 2.346 3.973 . 0 0 "[ . 1 . 2]" 1
1799 1 56 LEU H 1 56 LEU HB2 . . 3.360 2.424 2.286 2.528 . 0 0 "[ . 1 . 2]" 1
1800 1 56 LEU H 1 56 LEU HB3 . . 4.190 3.579 3.544 3.595 . 0 0 "[ . 1 . 2]" 1
1801 1 56 LEU H 1 56 LEU MD1 . . 4.020 3.477 3.351 3.593 . 0 0 "[ . 1 . 2]" 1
1802 1 56 LEU H 1 56 LEU MD2 . . 4.020 3.624 3.466 3.810 . 0 0 "[ . 1 . 2]" 1
1803 1 56 LEU H 1 56 LEU HG . . 3.720 2.373 2.190 2.659 . 0 0 "[ . 1 . 2]" 1
1804 1 56 LEU H 1 57 THR H . . 4.640 4.596 4.540 4.646 0.006 17 0 "[ . 1 . 2]" 1
1805 1 56 LEU HA 1 56 LEU QD . . 2.830 2.113 1.970 2.436 . 0 0 "[ . 1 . 2]" 1
1806 1 56 LEU HA 1 56 LEU HG . . 3.960 2.879 2.753 2.980 . 0 0 "[ . 1 . 2]" 1
1807 1 56 LEU HA 1 57 THR H . . 2.830 2.206 2.148 2.341 . 0 0 "[ . 1 . 2]" 1
1808 1 56 LEU HA 1 57 THR HA . . 4.840 4.406 4.385 4.436 . 0 0 "[ . 1 . 2]" 1
1809 1 56 LEU HA 1 57 THR MG . . 4.260 3.556 3.327 3.732 . 0 0 "[ . 1 . 2]" 1
1810 1 56 LEU HA 1 60 GLU HB2 . . 4.930 2.878 2.420 3.605 . 0 0 "[ . 1 . 2]" 1
1811 1 56 LEU HA 1 60 GLU QB . . 4.060 2.769 2.360 3.419 . 0 0 "[ . 1 . 2]" 1
1812 1 56 LEU HA 1 60 GLU HB3 . . 4.930 3.611 3.275 4.250 . 0 0 "[ . 1 . 2]" 1
1813 1 56 LEU HA 1 60 GLU HG2 . . 5.040 4.001 2.738 4.974 . 0 0 "[ . 1 . 2]" 1
1814 1 56 LEU HA 1 60 GLU HG3 . . 5.040 3.106 2.468 4.403 . 0 0 "[ . 1 . 2]" 1
1815 1 56 LEU HB2 1 56 LEU MD1 . . 3.500 2.131 2.033 2.324 . 0 0 "[ . 1 . 2]" 1
1816 1 56 LEU HB2 1 56 LEU MD2 . . 3.500 3.175 3.143 3.185 . 0 0 "[ . 1 . 2]" 1
1817 1 56 LEU HB2 1 57 THR H . . 4.230 4.109 3.838 4.243 0.013 3 0 "[ . 1 . 2]" 1
1818 1 56 LEU HB2 1 61 PHE QE . . 5.060 3.259 2.865 3.789 . 0 0 "[ . 1 . 2]" 1
1819 1 56 LEU HB2 1 61 PHE HZ . . 4.030 2.674 2.187 3.334 . 0 0 "[ . 1 . 2]" 1
1820 1 56 LEU HB3 1 56 LEU QD . . 2.950 2.114 1.997 2.161 . 0 0 "[ . 1 . 2]" 1
1821 1 56 LEU HB3 1 57 THR H . . 3.720 3.019 2.566 3.294 . 0 0 "[ . 1 . 2]" 1
1822 1 56 LEU HB3 1 60 GLU H . . 5.500 5.372 4.961 5.502 0.002 13 0 "[ . 1 . 2]" 1
1823 1 56 LEU HB3 1 60 GLU HB2 . . 4.810 3.114 2.721 3.459 . 0 0 "[ . 1 . 2]" 1
1824 1 56 LEU HB3 1 60 GLU QB . . 4.170 2.993 2.639 3.343 . 0 0 "[ . 1 . 2]" 1
1825 1 56 LEU HB3 1 60 GLU HB3 . . 4.810 3.921 3.478 4.425 . 0 0 "[ . 1 . 2]" 1
1826 1 56 LEU HB3 1 61 PHE H . . 4.810 4.067 3.815 4.510 . 0 0 "[ . 1 . 2]" 1
1827 1 56 LEU HB3 1 61 PHE HA . . 5.280 4.561 4.105 5.194 . 0 0 "[ . 1 . 2]" 1
1828 1 56 LEU HB3 1 61 PHE QD . . 5.200 3.663 3.357 4.109 . 0 0 "[ . 1 . 2]" 1
1829 1 56 LEU HB3 1 61 PHE QE . . 4.780 3.128 2.823 3.479 . 0 0 "[ . 1 . 2]" 1
1830 1 56 LEU HB3 1 61 PHE HZ . . 4.450 3.223 2.829 3.561 . 0 0 "[ . 1 . 2]" 1
1831 1 56 LEU QD 1 57 THR H . . 3.680 3.194 2.920 3.389 . 0 0 "[ . 1 . 2]" 1
1832 1 56 LEU QD 1 57 THR MG . . 4.730 4.674 4.517 4.737 0.007 14 0 "[ . 1 . 2]" 1
1833 1 56 LEU QD 1 60 GLU H . . 5.020 4.545 4.205 4.755 . 0 0 "[ . 1 . 2]" 1
1834 1 56 LEU QD 1 60 GLU HA . . 4.970 4.129 3.877 4.524 . 0 0 "[ . 1 . 2]" 1
1835 1 56 LEU QD 1 60 GLU QB . . 3.020 1.974 1.772 2.245 . 0 0 "[ . 1 . 2]" 1
1836 1 56 LEU QD 1 60 GLU QG . . 3.530 2.809 2.050 3.483 . 0 0 "[ . 1 . 2]" 1
1837 1 56 LEU QD 1 61 PHE H . . 4.660 3.876 3.571 4.114 . 0 0 "[ . 1 . 2]" 1
1838 1 56 LEU QD 1 61 PHE HA . . 4.730 3.626 3.276 4.070 . 0 0 "[ . 1 . 2]" 1
1839 1 56 LEU QD 1 61 PHE QD . . 4.340 3.230 2.925 3.626 . 0 0 "[ . 1 . 2]" 1
1840 1 56 LEU QD 1 61 PHE QE . . 3.670 2.213 1.797 2.730 . 0 0 "[ . 1 . 2]" 1
1841 1 56 LEU QD 1 61 PHE HZ . . 4.190 2.693 1.976 3.368 . 0 0 "[ . 1 . 2]" 1
1842 1 56 LEU QD 1 66 TYR QD . . 3.880 3.365 2.567 3.677 . 0 0 "[ . 1 . 2]" 1
1843 1 56 LEU QD 1 66 TYR QE . . 3.240 2.317 1.752 2.779 . 0 0 "[ . 1 . 2]" 1
1844 1 56 LEU MD1 1 61 PHE HA . . 5.500 4.449 4.152 4.933 . 0 0 "[ . 1 . 2]" 1
1845 1 56 LEU MD1 1 61 PHE QD . . 4.930 3.476 3.085 3.986 . 0 0 "[ . 1 . 2]" 1
1846 1 56 LEU MD1 1 61 PHE QE . . 4.600 2.230 1.805 2.781 . 0 0 "[ . 1 . 2]" 1
1847 1 56 LEU MD1 1 66 TYR QD . . 4.850 4.242 3.606 4.632 . 0 0 "[ . 1 . 2]" 1
1848 1 56 LEU MD1 1 66 TYR QE . . 4.030 3.347 2.213 3.816 . 0 0 "[ . 1 . 2]" 1
1849 1 56 LEU MD2 1 61 PHE HA . . 5.500 3.852 3.396 4.391 . 0 0 "[ . 1 . 2]" 1
1850 1 56 LEU MD2 1 61 PHE QD . . 4.930 3.860 3.333 4.340 . 0 0 "[ . 1 . 2]" 1
1851 1 56 LEU MD2 1 61 PHE QE . . 4.600 3.804 3.255 4.387 . 0 0 "[ . 1 . 2]" 1
1852 1 56 LEU MD2 1 66 TYR QD . . 4.850 3.536 2.628 3.858 . 0 0 "[ . 1 . 2]" 1
1853 1 56 LEU MD2 1 66 TYR QE . . 4.030 2.370 1.770 2.863 . 0 0 "[ . 1 . 2]" 1
1854 1 56 LEU HG 1 57 THR H . . 4.960 4.854 4.621 4.967 0.007 6 0 "[ . 1 . 2]" 1
1855 1 56 LEU HG 1 61 PHE HZ . . 5.370 4.868 4.377 5.374 0.004 20 0 "[ . 1 . 2]" 1
1856 1 57 THR H 1 57 THR MG . . 3.080 2.807 2.552 3.085 0.005 13 0 "[ . 1 . 2]" 1
1857 1 57 THR H 1 60 GLU H . . 4.090 3.157 2.914 3.480 . 0 0 "[ . 1 . 2]" 1
1858 1 57 THR H 1 60 GLU HB2 . . 3.890 2.017 1.895 2.284 . 0 0 "[ . 1 . 2]" 1
1859 1 57 THR H 1 60 GLU QB . . 3.160 2.006 1.888 2.268 . 0 0 "[ . 1 . 2]" 1
1860 1 57 THR H 1 60 GLU HB3 . . 3.890 3.594 3.479 3.843 . 0 0 "[ . 1 . 2]" 1
1861 1 57 THR H 1 60 GLU HG2 . . 4.580 3.239 2.045 4.000 . 0 0 "[ . 1 . 2]" 1
1862 1 57 THR H 1 60 GLU QG . . 3.930 2.620 1.895 3.272 . 0 0 "[ . 1 . 2]" 1
1863 1 57 THR H 1 60 GLU HG3 . . 4.580 2.906 1.903 4.045 . 0 0 "[ . 1 . 2]" 1
1864 1 57 THR HA 1 57 THR MG . . 3.180 2.396 2.228 2.486 . 0 0 "[ . 1 . 2]" 1
1865 1 57 THR HA 1 58 GLU H . . 3.460 2.466 2.387 2.651 . 0 0 "[ . 1 . 2]" 1
1866 1 57 THR HA 1 58 GLU HA . . 4.720 4.299 4.294 4.314 . 0 0 "[ . 1 . 2]" 1
1867 1 57 THR HA 1 58 GLU QB . . 4.600 4.355 4.248 4.423 . 0 0 "[ . 1 . 2]" 1
1868 1 57 THR HA 1 78 LEU MD1 . . 4.510 3.887 2.637 4.511 0.001 16 0 "[ . 1 . 2]" 1
1869 1 57 THR HA 1 78 LEU QD . . 3.570 2.936 2.553 3.518 . 0 0 "[ . 1 . 2]" 1
1870 1 57 THR HA 1 78 LEU MD2 . . 4.510 3.338 2.575 4.451 . 0 0 "[ . 1 . 2]" 1
1871 1 57 THR HB 1 58 GLU H . . 3.420 2.272 1.996 2.446 . 0 0 "[ . 1 . 2]" 1
1872 1 57 THR HB 1 58 GLU HB2 . . 4.910 4.496 4.084 4.836 . 0 0 "[ . 1 . 2]" 1
1873 1 57 THR HB 1 58 GLU QB . . 4.260 3.712 3.585 3.919 . 0 0 "[ . 1 . 2]" 1
1874 1 57 THR HB 1 58 GLU HB3 . . 4.910 3.991 3.735 4.389 . 0 0 "[ . 1 . 2]" 1
1875 1 57 THR HB 1 59 GLU H . . 3.940 2.996 2.556 3.372 . 0 0 "[ . 1 . 2]" 1
1876 1 57 THR HB 1 60 GLU H . . 4.600 4.387 3.825 4.620 0.020 12 0 "[ . 1 . 2]" 1
1877 1 57 THR MG 1 58 GLU H . . 3.910 3.633 3.484 3.778 . 0 0 "[ . 1 . 2]" 1
1878 1 57 THR MG 1 59 GLU H . . 4.750 4.283 4.098 4.767 0.017 5 0 "[ . 1 . 2]" 1
1879 1 57 THR MG 1 59 GLU QB . . 4.650 4.370 4.177 4.648 . 0 0 "[ . 1 . 2]" 1
1880 1 57 THR MG 1 60 GLU H . . 5.190 4.436 4.138 4.826 . 0 0 "[ . 1 . 2]" 1
1881 1 57 THR MG 1 60 GLU QG . . 4.280 3.696 3.218 4.228 . 0 0 "[ . 1 . 2]" 1
1882 1 58 GLU H 1 58 GLU HB2 . . 3.690 2.477 2.215 2.708 . 0 0 "[ . 1 . 2]" 1
1883 1 58 GLU H 1 58 GLU HB3 . . 3.690 2.626 2.367 3.013 . 0 0 "[ . 1 . 2]" 1
1884 1 58 GLU H 1 58 GLU HG2 . . 4.760 4.487 4.330 4.625 . 0 0 "[ . 1 . 2]" 1
1885 1 58 GLU H 1 58 GLU HG3 . . 4.760 4.413 4.084 4.649 . 0 0 "[ . 1 . 2]" 1
1886 1 58 GLU H 1 59 GLU H . . 4.030 2.866 2.635 3.188 . 0 0 "[ . 1 . 2]" 1
1887 1 58 GLU H 1 78 LEU MD1 . . 4.250 3.030 2.281 3.630 . 0 0 "[ . 1 . 2]" 1
1888 1 58 GLU H 1 78 LEU MD2 . . 4.250 2.903 1.975 3.905 . 0 0 "[ . 1 . 2]" 1
1889 1 58 GLU HA 1 58 GLU HG2 . . 3.710 3.083 2.608 3.365 . 0 0 "[ . 1 . 2]" 1
1890 1 58 GLU HA 1 58 GLU HG3 . . 3.710 2.659 2.296 3.646 . 0 0 "[ . 1 . 2]" 1
1891 1 58 GLU HA 1 61 PHE H . . 4.140 4.017 3.595 4.156 0.016 15 0 "[ . 1 . 2]" 1
1892 1 58 GLU HA 1 61 PHE HB2 . . 3.470 2.989 2.533 3.226 . 0 0 "[ . 1 . 2]" 1
1893 1 58 GLU HA 1 61 PHE QD . . 3.580 2.470 1.998 2.877 . 0 0 "[ . 1 . 2]" 1
1894 1 58 GLU HA 1 61 PHE QE . . 4.890 4.428 3.964 4.890 0.000 10 0 "[ . 1 . 2]" 1
1895 1 58 GLU HA 1 62 SER H . . 4.980 4.645 4.312 5.016 0.036 17 0 "[ . 1 . 2]" 1
1896 1 58 GLU HA 1 74 ARG HB3 . . 4.680 3.676 3.351 4.136 . 0 0 "[ . 1 . 2]" 1
1897 1 58 GLU HA 1 74 ARG QD . . 4.820 2.477 1.978 3.232 . 0 0 "[ . 1 . 2]" 1
1898 1 58 GLU HA 1 74 ARG HG2 . . 4.860 3.891 3.224 4.163 . 0 0 "[ . 1 . 2]" 1
1899 1 58 GLU HA 1 78 LEU MD1 . . 3.810 2.561 1.972 3.658 . 0 0 "[ . 1 . 2]" 1
1900 1 58 GLU HA 1 78 LEU QD . . 3.120 2.189 1.959 2.569 . 0 0 "[ . 1 . 2]" 1
1901 1 58 GLU HA 1 78 LEU MD2 . . 3.810 2.957 2.061 3.720 . 0 0 "[ . 1 . 2]" 1
1902 1 58 GLU QB 1 59 GLU H . . 3.660 2.841 2.258 3.138 . 0 0 "[ . 1 . 2]" 1
1903 1 58 GLU QB 1 78 LEU QD . . 2.920 2.183 1.829 2.919 . 0 0 "[ . 1 . 2]" 1
1904 1 58 GLU HB2 1 59 GLU H . . 4.270 4.021 3.691 4.287 0.017 6 0 "[ . 1 . 2]" 1
1905 1 58 GLU HB2 1 78 LEU MD1 . . 4.590 2.624 1.887 3.643 . 0 0 "[ . 1 . 2]" 1
1906 1 58 GLU HB2 1 78 LEU MD2 . . 4.590 3.015 1.852 3.600 . 0 0 "[ . 1 . 2]" 1
1907 1 58 GLU HB3 1 59 GLU H . . 4.270 2.911 2.277 3.255 . 0 0 "[ . 1 . 2]" 1
1908 1 58 GLU HB3 1 78 LEU MD1 . . 4.590 3.884 3.304 4.598 0.008 8 0 "[ . 1 . 2]" 1
1909 1 58 GLU HB3 1 78 LEU MD2 . . 4.590 4.208 3.035 4.594 0.004 14 0 "[ . 1 . 2]" 1
1910 1 58 GLU QG 1 59 GLU H . . 4.260 3.837 3.121 4.264 0.004 2 0 "[ . 1 . 2]" 1
1911 1 58 GLU QG 1 59 GLU HA . . 4.520 3.792 3.242 4.335 . 0 0 "[ . 1 . 2]" 1
1912 1 58 GLU QG 1 62 SER QB . . 5.180 3.938 3.126 4.646 . 0 0 "[ . 1 . 2]" 1
1913 1 58 GLU QG 1 74 ARG HB3 . . 4.280 2.959 2.329 3.752 . 0 0 "[ . 1 . 2]" 1
1914 1 58 GLU QG 1 74 ARG QD . . 3.500 2.137 1.871 2.757 . 0 0 "[ . 1 . 2]" 1
1915 1 58 GLU QG 1 74 ARG HG3 . . 5.060 4.599 4.352 4.841 . 0 0 "[ . 1 . 2]" 1
1916 1 58 GLU QG 1 78 LEU QD . . 3.650 2.815 2.004 3.638 . 0 0 "[ . 1 . 2]" 1
1917 1 58 GLU HG2 1 59 GLU H . . 5.050 4.037 3.190 4.654 . 0 0 "[ . 1 . 2]" 1
1918 1 58 GLU HG2 1 74 ARG HB3 . . 4.890 4.354 3.021 4.852 . 0 0 "[ . 1 . 2]" 1
1919 1 58 GLU HG2 1 74 ARG HD2 . . 4.940 2.837 2.007 3.494 . 0 0 "[ . 1 . 2]" 1
1920 1 58 GLU HG2 1 74 ARG HD3 . . 4.940 3.863 2.805 4.589 . 0 0 "[ . 1 . 2]" 1
1921 1 58 GLU HG3 1 59 GLU H . . 5.050 4.869 4.426 5.063 0.013 15 0 "[ . 1 . 2]" 1
1922 1 58 GLU HG3 1 74 ARG HB3 . . 4.890 3.051 2.402 4.652 . 0 0 "[ . 1 . 2]" 1
1923 1 58 GLU HG3 1 74 ARG HD2 . . 4.940 2.343 1.996 3.430 . 0 0 "[ . 1 . 2]" 1
1924 1 58 GLU HG3 1 74 ARG HD3 . . 4.940 3.842 3.235 4.493 . 0 0 "[ . 1 . 2]" 1
1925 1 59 GLU H 1 59 GLU HB2 . . 3.550 2.767 2.133 3.230 . 0 0 "[ . 1 . 2]" 1
1926 1 59 GLU H 1 59 GLU QB . . 3.040 2.147 2.096 2.186 . 0 0 "[ . 1 . 2]" 1
1927 1 59 GLU H 1 59 GLU HB3 . . 3.550 2.683 2.148 3.502 . 0 0 "[ . 1 . 2]" 1
1928 1 59 GLU H 1 59 GLU QG . . 3.540 3.527 2.916 3.703 0.163 17 0 "[ . 1 . 2]" 1
1929 1 59 GLU H 1 60 GLU H . . 3.530 2.776 2.460 3.162 . 0 0 "[ . 1 . 2]" 1
1930 1 59 GLU H 1 74 ARG HD2 . . 5.500 5.172 4.735 5.495 . 0 0 "[ . 1 . 2]" 1
1931 1 59 GLU H 1 74 ARG QD . . 4.810 4.718 4.428 4.817 0.007 3 0 "[ . 1 . 2]" 1
1932 1 59 GLU H 1 74 ARG HD3 . . 5.500 5.464 5.316 5.517 0.017 19 0 "[ . 1 . 2]" 1
1933 1 59 GLU HA 1 59 GLU HG2 . . 4.040 3.548 2.347 3.991 . 0 0 "[ . 1 . 2]" 1
1934 1 59 GLU HA 1 59 GLU QG . . 3.480 2.711 2.233 3.252 . 0 0 "[ . 1 . 2]" 1
1935 1 59 GLU HA 1 59 GLU HG3 . . 4.040 2.839 2.384 3.445 . 0 0 "[ . 1 . 2]" 1
1936 1 59 GLU HA 1 61 PHE H . . 4.860 4.293 4.010 4.683 . 0 0 "[ . 1 . 2]" 1
1937 1 59 GLU HA 1 62 SER H . . 3.950 3.358 3.126 3.460 . 0 0 "[ . 1 . 2]" 1
1938 1 59 GLU HA 1 62 SER HG . . 4.830 4.107 2.413 4.833 0.003 13 0 "[ . 1 . 2]" 1
1939 1 59 GLU QB 1 60 GLU H . . 3.370 2.368 2.051 2.593 . 0 0 "[ . 1 . 2]" 1
1940 1 59 GLU QB 1 60 GLU HA . . 4.970 4.129 3.617 4.471 . 0 0 "[ . 1 . 2]" 1
1941 1 59 GLU HB2 1 60 GLU H . . 4.010 3.280 2.317 3.905 . 0 0 "[ . 1 . 2]" 1
1942 1 59 GLU HB2 1 62 SER H . . 5.500 5.454 5.263 5.514 0.014 15 0 "[ . 1 . 2]" 1
1943 1 59 GLU HB3 1 60 GLU H . . 4.010 2.521 2.075 2.641 . 0 0 "[ . 1 . 2]" 1
1944 1 59 GLU HB3 1 62 SER H . . 5.500 5.290 4.991 5.507 0.007 8 0 "[ . 1 . 2]" 1
1945 1 59 GLU QG 1 60 GLU H . . 4.620 3.016 2.144 4.141 . 0 0 "[ . 1 . 2]" 1
1946 1 59 GLU QG 1 63 ARG QD . . 3.830 3.433 1.959 3.859 0.029 17 0 "[ . 1 . 2]" 1
1947 1 59 GLU QG 1 63 ARG QG . . 4.760 3.212 2.398 4.048 . 0 0 "[ . 1 . 2]" 1
1948 1 60 GLU H 1 60 GLU QB . . 3.100 2.518 2.353 2.756 . 0 0 "[ . 1 . 2]" 1
1949 1 60 GLU H 1 60 GLU HG2 . . 3.790 2.469 2.014 3.819 0.029 15 0 "[ . 1 . 2]" 1
1950 1 60 GLU H 1 60 GLU QG . . 3.150 2.210 1.877 2.959 . 0 0 "[ . 1 . 2]" 1
1951 1 60 GLU H 1 60 GLU HG3 . . 3.790 3.239 1.913 3.727 . 0 0 "[ . 1 . 2]" 1
1952 1 60 GLU H 1 61 PHE H . . 3.190 2.937 2.746 3.045 . 0 0 "[ . 1 . 2]" 1
1953 1 60 GLU H 1 61 PHE HB2 . . 5.020 4.965 4.824 5.057 0.037 3 0 "[ . 1 . 2]" 1
1954 1 60 GLU H 1 63 ARG QG . . 5.340 4.142 3.691 5.089 . 0 0 "[ . 1 . 2]" 1
1955 1 60 GLU HA 1 60 GLU HG2 . . 3.730 2.911 2.518 3.579 . 0 0 "[ . 1 . 2]" 1
1956 1 60 GLU HA 1 60 GLU QG . . 3.190 2.693 2.303 3.163 . 0 0 "[ . 1 . 2]" 1
1957 1 60 GLU HA 1 60 GLU HG3 . . 3.730 3.508 2.334 3.764 0.034 6 0 "[ . 1 . 2]" 1
1958 1 60 GLU HA 1 63 ARG H . . 4.410 3.482 3.167 3.825 . 0 0 "[ . 1 . 2]" 1
1959 1 60 GLU HA 1 63 ARG QB . . 3.970 2.665 2.214 3.856 . 0 0 "[ . 1 . 2]" 1
1960 1 60 GLU HA 1 63 ARG HD2 . . 5.500 4.884 2.710 5.502 0.002 5 0 "[ . 1 . 2]" 1
1961 1 60 GLU HA 1 63 ARG QD . . 4.830 4.185 2.134 4.832 0.002 3 0 "[ . 1 . 2]" 1
1962 1 60 GLU HA 1 63 ARG HD3 . . 5.500 4.689 2.149 5.381 . 0 0 "[ . 1 . 2]" 1
1963 1 60 GLU HA 1 63 ARG QG . . 3.670 2.688 2.102 3.685 0.015 13 0 "[ . 1 . 2]" 1
1964 1 60 GLU QB 1 61 PHE H . . 3.350 2.566 2.343 2.836 . 0 0 "[ . 1 . 2]" 1
1965 1 60 GLU QB 1 66 TYR QD . . 4.970 3.916 3.647 4.297 . 0 0 "[ . 1 . 2]" 1
1966 1 60 GLU HB2 1 61 PHE H . . 4.000 2.630 2.391 2.919 . 0 0 "[ . 1 . 2]" 1
1967 1 60 GLU HB3 1 61 PHE H . . 4.000 3.587 3.347 3.876 . 0 0 "[ . 1 . 2]" 1
1968 1 60 GLU QG 1 61 PHE H . . 4.290 4.104 3.698 4.329 0.039 15 0 "[ . 1 . 2]" 1
1969 1 60 GLU HG2 1 61 PHE H . . 5.150 4.535 3.994 4.978 . 0 0 "[ . 1 . 2]" 1
1970 1 60 GLU HG3 1 61 PHE H . . 5.150 4.794 3.875 5.144 . 0 0 "[ . 1 . 2]" 1
1971 1 61 PHE H 1 61 PHE HB2 . . 2.930 2.335 2.263 2.436 . 0 0 "[ . 1 . 2]" 1
1972 1 61 PHE H 1 61 PHE QD . . 3.920 3.147 2.862 3.351 . 0 0 "[ . 1 . 2]" 1
1973 1 61 PHE H 1 62 SER H . . 3.240 2.664 2.487 2.768 . 0 0 "[ . 1 . 2]" 1
1974 1 61 PHE H 1 62 SER QB . . 4.960 4.537 4.290 4.968 0.008 8 0 "[ . 1 . 2]" 1
1975 1 61 PHE H 1 63 ARG H . . 4.590 3.922 3.748 4.159 . 0 0 "[ . 1 . 2]" 1
1976 1 61 PHE H 1 66 TYR QB . . 5.340 5.257 5.054 5.349 0.009 8 0 "[ . 1 . 2]" 1
1977 1 61 PHE H 1 74 ARG HD2 . . 5.420 4.966 4.106 5.422 0.002 15 0 "[ . 1 . 2]" 1
1978 1 61 PHE H 1 74 ARG QD . . 4.700 4.007 3.462 4.414 . 0 0 "[ . 1 . 2]" 1
1979 1 61 PHE H 1 74 ARG HD3 . . 5.420 4.249 3.729 4.831 . 0 0 "[ . 1 . 2]" 1
1980 1 61 PHE H 1 78 LEU QD . . 5.440 4.759 4.271 5.120 . 0 0 "[ . 1 . 2]" 1
1981 1 61 PHE HA 1 61 PHE QD . . 3.330 2.174 1.997 2.453 . 0 0 "[ . 1 . 2]" 1
1982 1 61 PHE HA 1 61 PHE QE . . 4.640 4.275 4.184 4.390 . 0 0 "[ . 1 . 2]" 1
1983 1 61 PHE HA 1 63 ARG H . . 4.640 3.756 3.411 4.245 . 0 0 "[ . 1 . 2]" 1
1984 1 61 PHE HA 1 66 TYR HB2 . . 3.810 3.042 2.583 3.341 . 0 0 "[ . 1 . 2]" 1
1985 1 61 PHE HA 1 66 TYR QB . . 3.280 2.907 2.545 3.109 . 0 0 "[ . 1 . 2]" 1
1986 1 61 PHE HA 1 66 TYR HB3 . . 3.810 3.745 3.557 3.835 0.025 17 0 "[ . 1 . 2]" 1
1987 1 61 PHE HA 1 66 TYR QD . . 3.630 2.753 1.989 3.597 . 0 0 "[ . 1 . 2]" 1
1988 1 61 PHE HA 1 68 ILE H . . 4.910 4.323 3.826 4.790 . 0 0 "[ . 1 . 2]" 1
1989 1 61 PHE HA 1 68 ILE MD . . 5.330 2.817 2.323 3.509 . 0 0 "[ . 1 . 2]" 1
1990 1 61 PHE HB2 1 62 SER H . . 4.290 2.802 2.588 3.012 . 0 0 "[ . 1 . 2]" 1
1991 1 61 PHE HB2 1 62 SER HA . . 5.460 4.589 4.473 4.732 . 0 0 "[ . 1 . 2]" 1
1992 1 61 PHE HB2 1 62 SER HB2 . . 5.500 4.773 4.182 5.531 0.031 19 0 "[ . 1 . 2]" 1
1993 1 61 PHE HB2 1 62 SER HB3 . . 5.500 4.765 4.034 5.538 0.038 8 0 "[ . 1 . 2]" 1
1994 1 61 PHE HB2 1 74 ARG HB3 . . 5.120 4.502 4.207 5.040 . 0 0 "[ . 1 . 2]" 1
1995 1 61 PHE HB2 1 74 ARG HD2 . . 4.210 3.122 2.313 3.653 . 0 0 "[ . 1 . 2]" 1
1996 1 61 PHE HB2 1 74 ARG QD . . 3.610 2.333 1.885 2.883 . 0 0 "[ . 1 . 2]" 1
1997 1 61 PHE HB2 1 74 ARG HD3 . . 4.210 2.435 1.995 3.169 . 0 0 "[ . 1 . 2]" 1
1998 1 61 PHE HB2 1 74 ARG HG2 . . 4.940 2.786 2.555 3.115 . 0 0 "[ . 1 . 2]" 1
1999 1 61 PHE HB2 1 74 ARG HG3 . . 5.100 4.045 3.774 4.265 . 0 0 "[ . 1 . 2]" 1
2000 1 61 PHE HB2 1 78 LEU MD1 . . 5.280 4.345 3.416 5.278 . 0 0 "[ . 1 . 2]" 1
2001 1 61 PHE HB2 1 78 LEU QD . . 4.320 3.757 3.189 4.194 . 0 0 "[ . 1 . 2]" 1
2002 1 61 PHE HB2 1 78 LEU MD2 . . 5.280 4.617 3.222 5.274 . 0 0 "[ . 1 . 2]" 1
2003 1 61 PHE HB3 1 62 SER HA . . 5.500 4.286 4.168 4.430 . 0 0 "[ . 1 . 2]" 1
2004 1 61 PHE HB3 1 62 SER QB . . 5.340 4.639 4.412 5.350 0.010 8 0 "[ . 1 . 2]" 1
2005 1 61 PHE HB3 1 66 TYR QB . . 4.660 4.207 3.515 4.430 . 0 0 "[ . 1 . 2]" 1
2006 1 61 PHE HB3 1 68 ILE H . . 5.080 4.557 4.177 4.955 . 0 0 "[ . 1 . 2]" 1
2007 1 61 PHE HB3 1 68 ILE HB . . 3.830 3.026 2.400 3.417 . 0 0 "[ . 1 . 2]" 1
2008 1 61 PHE HB3 1 68 ILE MD . . 3.970 1.921 1.768 2.224 . 0 0 "[ . 1 . 2]" 1
2009 1 61 PHE HB3 1 68 ILE HG12 . . 4.900 4.421 3.980 4.660 . 0 0 "[ . 1 . 2]" 1
2010 1 61 PHE HB3 1 68 ILE QG . . 4.270 3.447 2.746 3.946 . 0 0 "[ . 1 . 2]" 1
2011 1 61 PHE HB3 1 68 ILE HG13 . . 4.900 3.610 2.798 4.260 . 0 0 "[ . 1 . 2]" 1
2012 1 61 PHE HB3 1 68 ILE MG . . 4.480 3.581 3.096 3.999 . 0 0 "[ . 1 . 2]" 1
2013 1 61 PHE HB3 1 74 ARG HB3 . . 5.500 4.792 4.370 5.192 . 0 0 "[ . 1 . 2]" 1
2014 1 61 PHE HB3 1 74 ARG QD . . 4.590 2.820 2.292 3.315 . 0 0 "[ . 1 . 2]" 1
2015 1 61 PHE HB3 1 74 ARG HG2 . . 5.100 2.386 1.999 2.807 . 0 0 "[ . 1 . 2]" 1
2016 1 61 PHE HB3 1 74 ARG HG3 . . 4.750 3.438 3.022 3.856 . 0 0 "[ . 1 . 2]" 1
2017 1 61 PHE HB3 1 78 LEU QD . . 5.230 4.439 3.845 5.064 . 0 0 "[ . 1 . 2]" 1
2018 1 61 PHE QD 1 66 TYR HB2 . . 4.940 4.035 3.228 4.663 . 0 0 "[ . 1 . 2]" 1
2019 1 61 PHE QD 1 66 TYR QB . . 4.210 3.453 2.981 3.876 . 0 0 "[ . 1 . 2]" 1
2020 1 61 PHE QD 1 66 TYR HB3 . . 4.940 3.776 3.379 4.144 . 0 0 "[ . 1 . 2]" 1
2021 1 61 PHE QD 1 68 ILE MD . . 4.260 2.230 1.960 2.931 . 0 0 "[ . 1 . 2]" 1
2022 1 61 PHE QD 1 68 ILE HG12 . . 5.500 4.876 4.534 5.359 . 0 0 "[ . 1 . 2]" 1
2023 1 61 PHE QD 1 68 ILE QG . . 4.770 3.820 3.292 4.274 . 0 0 "[ . 1 . 2]" 1
2024 1 61 PHE QD 1 68 ILE HG13 . . 5.500 4.000 3.380 4.539 . 0 0 "[ . 1 . 2]" 1
2025 1 61 PHE QD 1 68 ILE MG . . 5.460 4.883 4.558 5.398 . 0 0 "[ . 1 . 2]" 1
2026 1 61 PHE QD 1 74 ARG HB3 . . 5.420 4.499 3.989 5.072 . 0 0 "[ . 1 . 2]" 1
2027 1 61 PHE QD 1 74 ARG HG3 . . 5.500 4.975 4.470 5.323 . 0 0 "[ . 1 . 2]" 1
2028 1 61 PHE QD 1 78 LEU MD1 . . 4.070 2.988 1.977 3.495 . 0 0 "[ . 1 . 2]" 1
2029 1 61 PHE QD 1 78 LEU QD . . 3.350 2.486 1.922 2.965 . 0 0 "[ . 1 . 2]" 1
2030 1 61 PHE QD 1 78 LEU MD2 . . 4.070 2.997 1.934 3.552 . 0 0 "[ . 1 . 2]" 1
2031 1 61 PHE QE 1 68 ILE MD . . 5.500 3.897 3.492 4.407 . 0 0 "[ . 1 . 2]" 1
2032 1 61 PHE QE 1 77 ILE MG . . 4.070 2.862 2.517 3.318 . 0 0 "[ . 1 . 2]" 1
2033 1 61 PHE QE 1 78 LEU MD1 . . 4.360 3.322 2.167 4.353 . 0 0 "[ . 1 . 2]" 1
2034 1 61 PHE QE 1 78 LEU QD . . 3.330 2.423 1.889 2.884 . 0 0 "[ . 1 . 2]" 1
2035 1 61 PHE QE 1 78 LEU MD2 . . 4.360 2.788 1.965 3.941 . 0 0 "[ . 1 . 2]" 1
2036 1 61 PHE QE 1 78 LEU HG . . 5.080 3.415 2.517 5.080 0.000 17 0 "[ . 1 . 2]" 1
2037 1 61 PHE QE 1 81 LEU MD1 . . 5.170 4.298 3.066 5.157 . 0 0 "[ . 1 . 2]" 1
2038 1 61 PHE QE 1 81 LEU QD . . 4.320 3.435 3.045 3.976 . 0 0 "[ . 1 . 2]" 1
2039 1 61 PHE QE 1 81 LEU MD2 . . 5.170 4.293 3.338 5.178 0.008 19 0 "[ . 1 . 2]" 1
2040 1 61 PHE HZ 1 77 ILE MG . . 3.680 2.895 2.366 3.683 0.003 17 0 "[ . 1 . 2]" 1
2041 1 61 PHE HZ 1 78 LEU QD . . 4.770 4.107 3.336 4.772 0.002 12 0 "[ . 1 . 2]" 1
2042 1 61 PHE HZ 1 81 LEU MD1 . . 5.060 3.866 2.515 4.850 . 0 0 "[ . 1 . 2]" 1
2043 1 61 PHE HZ 1 81 LEU QD . . 4.060 3.214 2.504 4.015 . 0 0 "[ . 1 . 2]" 1
2044 1 61 PHE HZ 1 81 LEU MD2 . . 5.060 4.071 2.831 5.030 . 0 0 "[ . 1 . 2]" 1
2045 1 62 SER H 1 62 SER HB2 . . 3.760 2.954 2.312 3.579 . 0 0 "[ . 1 . 2]" 1
2046 1 62 SER H 1 62 SER QB . . 3.200 2.287 2.214 2.763 . 0 0 "[ . 1 . 2]" 1
2047 1 62 SER H 1 62 SER HB3 . . 3.760 2.479 2.289 3.620 . 0 0 "[ . 1 . 2]" 1
2048 1 62 SER H 1 62 SER HG . . 4.380 3.932 2.616 4.389 0.009 13 0 "[ . 1 . 2]" 1
2049 1 62 SER H 1 63 ARG H . . 3.260 2.512 2.409 2.694 . 0 0 "[ . 1 . 2]" 1
2050 1 62 SER H 1 63 ARG QB . . 5.340 4.498 4.247 4.621 . 0 0 "[ . 1 . 2]" 1
2051 1 62 SER H 1 63 ARG QD . . 5.340 5.014 4.667 5.360 0.020 13 0 "[ . 1 . 2]" 1
2052 1 62 SER H 1 63 ARG QG . . 4.660 3.724 3.352 4.428 . 0 0 "[ . 1 . 2]" 1
2053 1 62 SER H 1 74 ARG HD2 . . 4.960 4.266 3.798 4.800 . 0 0 "[ . 1 . 2]" 1
2054 1 62 SER H 1 74 ARG QD . . 4.290 2.900 2.529 3.403 . 0 0 "[ . 1 . 2]" 1
2055 1 62 SER H 1 74 ARG HD3 . . 4.960 2.953 2.560 3.502 . 0 0 "[ . 1 . 2]" 1
2056 1 62 SER HA 1 67 THR HA . . 4.050 3.538 3.020 3.938 . 0 0 "[ . 1 . 2]" 1
2057 1 62 SER HA 1 67 THR MG . . 5.500 5.373 4.764 5.532 0.032 13 0 "[ . 1 . 2]" 1
2058 1 62 SER HA 1 68 ILE H . . 3.660 3.006 2.559 3.668 0.008 12 0 "[ . 1 . 2]" 1
2059 1 62 SER HA 1 68 ILE HB . . 4.460 2.609 2.070 3.407 . 0 0 "[ . 1 . 2]" 1
2060 1 62 SER HA 1 74 ARG QD . . 3.950 3.510 3.277 3.874 . 0 0 "[ . 1 . 2]" 1
2061 1 62 SER QB 1 63 ARG H . . 4.170 3.430 2.819 3.923 . 0 0 "[ . 1 . 2]" 1
2062 1 62 SER QB 1 63 ARG QD . . 4.760 4.237 3.444 4.771 0.011 13 0 "[ . 1 . 2]" 1
2063 1 62 SER QB 1 63 ARG QG . . 5.120 3.684 2.971 4.841 . 0 0 "[ . 1 . 2]" 1
2064 1 62 SER QB 1 67 THR HA . . 5.340 4.847 4.590 5.167 . 0 0 "[ . 1 . 2]" 1
2065 1 62 SER QB 1 74 ARG QD . . 3.790 2.634 2.086 3.524 . 0 0 "[ . 1 . 2]" 1
2066 1 62 SER HB2 1 63 ARG H . . 4.830 4.315 3.816 4.558 . 0 0 "[ . 1 . 2]" 1
2067 1 62 SER HB2 1 74 ARG HD2 . . 5.500 4.282 3.408 5.500 . 0 0 "[ . 1 . 2]" 1
2068 1 62 SER HB2 1 74 ARG HD3 . . 5.500 3.099 2.160 4.289 . 0 0 "[ . 1 . 2]" 1
2069 1 62 SER HB3 1 63 ARG H . . 4.830 3.646 2.872 4.559 . 0 0 "[ . 1 . 2]" 1
2070 1 62 SER HB3 1 74 ARG HD2 . . 5.500 4.707 3.444 5.503 0.003 13 0 "[ . 1 . 2]" 1
2071 1 62 SER HB3 1 74 ARG HD3 . . 5.500 3.589 2.511 4.467 . 0 0 "[ . 1 . 2]" 1
2072 1 63 ARG H 1 63 ARG HB2 . . 4.070 2.656 2.277 3.701 . 0 0 "[ . 1 . 2]" 1
2073 1 63 ARG H 1 63 ARG QB . . 3.380 2.501 2.252 2.584 . 0 0 "[ . 1 . 2]" 1
2074 1 63 ARG H 1 63 ARG HB3 . . 4.070 3.577 2.499 3.751 . 0 0 "[ . 1 . 2]" 1
2075 1 63 ARG H 1 63 ARG HD2 . . 5.070 4.185 3.529 5.094 0.024 13 0 "[ . 1 . 2]" 1
2076 1 63 ARG H 1 63 ARG QD . . 4.420 3.807 3.365 4.257 . 0 0 "[ . 1 . 2]" 1
2077 1 63 ARG H 1 63 ARG HD3 . . 5.070 4.609 3.459 4.965 . 0 0 "[ . 1 . 2]" 1
2078 1 63 ARG H 1 63 ARG HG2 . . 4.050 2.734 2.401 3.990 . 0 0 "[ . 1 . 2]" 1
2079 1 63 ARG H 1 63 ARG HG3 . . 4.050 3.761 2.622 4.041 . 0 0 "[ . 1 . 2]" 1
2080 1 63 ARG H 1 64 ALA H . . 5.160 4.449 2.788 4.579 . 0 0 "[ . 1 . 2]" 1
2081 1 63 ARG H 1 66 TYR QB . . 4.990 4.006 3.201 4.957 . 0 0 "[ . 1 . 2]" 1
2082 1 63 ARG H 1 67 THR HA . . 4.500 3.789 2.968 4.271 . 0 0 "[ . 1 . 2]" 1
2083 1 63 ARG H 1 68 ILE H . . 5.070 4.286 3.837 4.940 . 0 0 "[ . 1 . 2]" 1
2084 1 63 ARG QB 1 64 ALA H . . 3.420 2.649 1.923 2.800 . 0 0 "[ . 1 . 2]" 1
2085 1 63 ARG QB 1 64 ALA HA . . 5.190 4.547 4.235 4.828 . 0 0 "[ . 1 . 2]" 1
2086 1 63 ARG QB 1 64 ALA MB . . 4.620 3.931 3.164 4.092 . 0 0 "[ . 1 . 2]" 1
2087 1 63 ARG HB2 1 64 ALA H . . 3.900 3.613 1.967 3.902 0.002 10 0 "[ . 1 . 2]" 1
2088 1 63 ARG HB3 1 64 ALA H . . 3.900 2.881 2.316 3.943 0.043 12 0 "[ . 1 . 2]" 1
2089 1 63 ARG HD2 1 64 ALA H . . 5.500 4.328 3.610 5.555 0.055 13 0 "[ . 1 . 2]" 1
2090 1 63 ARG HD3 1 64 ALA H . . 5.500 5.279 3.877 5.528 0.028 13 0 "[ . 1 . 2]" 1
2091 1 63 ARG QG 1 64 ALA H . . 4.560 4.221 2.963 4.537 . 0 0 "[ . 1 . 2]" 1
2092 1 63 ARG HG2 1 64 ALA H . . 5.200 4.703 3.602 5.065 . 0 0 "[ . 1 . 2]" 1
2093 1 63 ARG HG3 1 64 ALA H . . 5.200 4.849 3.078 5.204 0.004 8 0 "[ . 1 . 2]" 1
2094 1 64 ALA H 1 64 ALA MB . . 3.180 2.156 2.028 2.888 . 0 0 "[ . 1 . 2]" 1
2095 1 64 ALA HA 1 65 PRO HA . . 2.890 2.450 2.339 2.555 . 0 0 "[ . 1 . 2]" 1
2096 1 64 ALA HA 1 65 PRO HB2 . . 4.720 4.440 4.371 4.510 . 0 0 "[ . 1 . 2]" 1
2097 1 64 ALA HA 1 65 PRO HB3 . . 4.720 4.544 4.453 4.632 . 0 0 "[ . 1 . 2]" 1
2098 1 64 ALA HA 1 65 PRO HD2 . . 4.860 4.405 4.404 4.407 . 0 0 "[ . 1 . 2]" 1
2099 1 64 ALA HA 1 65 PRO HD3 . . 5.020 4.656 4.616 4.693 . 0 0 "[ . 1 . 2]" 1
2100 1 64 ALA HA 1 66 TYR H . . 3.500 3.137 2.688 3.455 . 0 0 "[ . 1 . 2]" 1
2101 1 64 ALA HA 1 67 THR H . . 3.410 2.022 1.870 2.299 . 0 0 "[ . 1 . 2]" 1
2102 1 64 ALA HA 1 67 THR MG . . 4.130 3.456 3.284 3.876 . 0 0 "[ . 1 . 2]" 1
2103 1 64 ALA MB 1 65 PRO HA . . 2.970 1.982 1.900 2.185 . 0 0 "[ . 1 . 2]" 1
2104 1 64 ALA MB 1 65 PRO HB2 . . 4.970 4.323 4.197 4.480 . 0 0 "[ . 1 . 2]" 1
2105 1 64 ALA MB 1 65 PRO QB . . 4.120 3.461 3.344 3.641 . 0 0 "[ . 1 . 2]" 1
2106 1 64 ALA MB 1 65 PRO HB3 . . 4.970 3.642 3.512 3.853 . 0 0 "[ . 1 . 2]" 1
2107 1 64 ALA MB 1 65 PRO HD2 . . 4.570 4.382 4.326 4.458 . 0 0 "[ . 1 . 2]" 1
2108 1 64 ALA MB 1 65 PRO HD3 . . 4.590 3.781 3.701 3.916 . 0 0 "[ . 1 . 2]" 1
2109 1 64 ALA MB 1 66 TYR H . . 4.510 4.266 3.925 4.511 0.001 16 0 "[ . 1 . 2]" 1
2110 1 64 ALA MB 1 67 THR H . . 4.680 3.679 3.541 3.966 . 0 0 "[ . 1 . 2]" 1
2111 1 65 PRO HA 1 67 THR H . . 4.740 4.144 3.899 4.364 . 0 0 "[ . 1 . 2]" 1
2112 1 65 PRO HA 1 67 THR HB . . 5.020 3.954 3.697 4.128 . 0 0 "[ . 1 . 2]" 1
2113 1 65 PRO HA 1 67 THR MG . . 4.920 4.163 3.937 4.474 . 0 0 "[ . 1 . 2]" 1
2114 1 65 PRO QB 1 66 TYR HA . . 5.340 3.977 3.861 4.101 . 0 0 "[ . 1 . 2]" 1
2115 1 65 PRO QB 1 66 TYR QD . . 5.300 4.244 3.702 4.607 . 0 0 "[ . 1 . 2]" 1
2116 1 65 PRO HD2 1 66 TYR H . . 3.600 2.680 2.647 2.731 . 0 0 "[ . 1 . 2]" 1
2117 1 65 PRO HD2 1 66 TYR QD . . 4.150 3.708 3.119 3.884 . 0 0 "[ . 1 . 2]" 1
2118 1 65 PRO HD2 1 66 TYR QE . . 3.900 3.416 3.013 3.651 . 0 0 "[ . 1 . 2]" 1
2119 1 65 PRO HD3 1 66 TYR H . . 4.340 3.851 3.837 3.887 . 0 0 "[ . 1 . 2]" 1
2120 1 65 PRO HD3 1 66 TYR QD . . 5.400 5.114 4.759 5.222 . 0 0 "[ . 1 . 2]" 1
2121 1 65 PRO HD3 1 66 TYR QE . . 4.890 4.804 4.557 4.906 0.016 18 0 "[ . 1 . 2]" 1
2122 1 65 PRO QG 1 66 TYR H . . 3.990 2.317 1.986 2.758 . 0 0 "[ . 1 . 2]" 1
2123 1 65 PRO QG 1 66 TYR QD . . 4.290 3.130 2.594 3.518 . 0 0 "[ . 1 . 2]" 1
2124 1 65 PRO HG2 1 66 TYR H . . 4.680 2.337 1.995 2.797 . 0 0 "[ . 1 . 2]" 1
2125 1 65 PRO HG2 1 66 TYR QD . . 4.930 3.179 2.617 3.601 . 0 0 "[ . 1 . 2]" 1
2126 1 65 PRO HG2 1 66 TYR QE . . 4.680 3.263 2.742 3.718 . 0 0 "[ . 1 . 2]" 1
2127 1 65 PRO HG3 1 66 TYR H . . 4.680 3.857 3.602 4.201 . 0 0 "[ . 1 . 2]" 1
2128 1 65 PRO HG3 1 66 TYR QD . . 4.930 4.735 4.269 4.960 0.030 17 0 "[ . 1 . 2]" 1
2129 1 65 PRO HG3 1 66 TYR QE . . 4.680 4.308 3.766 4.624 . 0 0 "[ . 1 . 2]" 1
2130 1 66 TYR H 1 66 TYR HB2 . . 4.190 2.980 2.897 3.105 . 0 0 "[ . 1 . 2]" 1
2131 1 66 TYR H 1 66 TYR QB . . 3.350 2.826 2.771 2.905 . 0 0 "[ . 1 . 2]" 1
2132 1 66 TYR H 1 66 TYR HB3 . . 4.190 3.515 3.495 3.555 . 0 0 "[ . 1 . 2]" 1
2133 1 66 TYR H 1 66 TYR QD . . 3.350 2.707 2.355 2.832 . 0 0 "[ . 1 . 2]" 1
2134 1 66 TYR H 1 66 TYR QE . . 4.740 3.817 3.638 3.883 . 0 0 "[ . 1 . 2]" 1
2135 1 66 TYR H 1 67 THR H . . 3.200 2.937 2.721 3.038 . 0 0 "[ . 1 . 2]" 1
2136 1 66 TYR H 1 67 THR HA . . 5.350 5.252 5.053 5.356 0.006 13 0 "[ . 1 . 2]" 1
2137 1 66 TYR H 1 67 THR MG . . 5.450 4.672 4.474 5.081 . 0 0 "[ . 1 . 2]" 1
2138 1 66 TYR HA 1 66 TYR QD . . 3.410 2.591 2.287 2.877 . 0 0 "[ . 1 . 2]" 1
2139 1 66 TYR HA 1 66 TYR QE . . 5.040 4.766 4.614 4.860 . 0 0 "[ . 1 . 2]" 1
2140 1 66 TYR HA 1 68 ILE MD . . 5.320 4.750 4.456 5.179 . 0 0 "[ . 1 . 2]" 1
2141 1 66 TYR QB 1 67 THR H . . 3.400 2.517 2.400 2.643 . 0 0 "[ . 1 . 2]" 1
2142 1 66 TYR QB 1 67 THR MG . . 5.230 4.278 4.191 4.411 . 0 0 "[ . 1 . 2]" 1
2143 1 66 TYR QB 1 68 ILE MD . . 4.090 2.798 2.474 3.117 . 0 0 "[ . 1 . 2]" 1
2144 1 66 TYR QB 1 68 ILE QG . . 3.700 2.175 2.021 2.396 . 0 0 "[ . 1 . 2]" 1
2145 1 66 TYR HB2 1 67 THR H . . 4.190 2.550 2.427 2.682 . 0 0 "[ . 1 . 2]" 1
2146 1 66 TYR HB2 1 68 ILE H . . 4.610 2.711 2.533 2.915 . 0 0 "[ . 1 . 2]" 1
2147 1 66 TYR HB2 1 68 ILE MD . . 4.910 3.480 2.990 3.939 . 0 0 "[ . 1 . 2]" 1
2148 1 66 TYR HB3 1 67 THR H . . 4.190 3.881 3.793 3.985 . 0 0 "[ . 1 . 2]" 1
2149 1 66 TYR HB3 1 68 ILE H . . 4.610 3.339 3.162 3.500 . 0 0 "[ . 1 . 2]" 1
2150 1 66 TYR HB3 1 68 ILE MD . . 4.910 2.954 2.637 3.337 . 0 0 "[ . 1 . 2]" 1
2151 1 66 TYR QD 1 67 THR H . . 4.360 3.725 3.430 4.098 . 0 0 "[ . 1 . 2]" 1
2152 1 67 THR H 1 67 THR HB . . 4.060 2.842 2.761 2.965 . 0 0 "[ . 1 . 2]" 1
2153 1 67 THR H 1 67 THR MG . . 3.770 3.294 3.184 3.495 . 0 0 "[ . 1 . 2]" 1
2154 1 67 THR H 1 68 ILE H . . 3.940 2.996 2.848 3.094 . 0 0 "[ . 1 . 2]" 1
2155 1 67 THR HA 1 67 THR MG . . 3.220 3.192 3.158 3.204 . 0 0 "[ . 1 . 2]" 1
2156 1 67 THR HA 1 68 ILE H . . 3.250 2.868 2.780 2.969 . 0 0 "[ . 1 . 2]" 1
2157 1 67 THR HA 1 68 ILE HA . . 5.020 4.817 4.753 4.899 . 0 0 "[ . 1 . 2]" 1
2158 1 67 THR HA 1 69 GLU HG2 . . 5.130 4.626 4.305 4.986 . 0 0 "[ . 1 . 2]" 1
2159 1 67 THR HA 1 69 GLU HG3 . . 5.130 5.050 4.892 5.135 0.005 19 0 "[ . 1 . 2]" 1
2160 1 67 THR HB 1 68 ILE H . . 4.760 4.581 4.535 4.625 . 0 0 "[ . 1 . 2]" 1
2161 1 67 THR HB 1 69 GLU QG . . 5.320 4.675 4.556 4.858 . 0 0 "[ . 1 . 2]" 1
2162 1 67 THR MG 1 68 ILE H . . 4.130 3.621 3.513 3.737 . 0 0 "[ . 1 . 2]" 1
2163 1 67 THR MG 1 68 ILE HA . . 4.680 3.736 3.523 3.872 . 0 0 "[ . 1 . 2]" 1
2164 1 67 THR MG 1 69 GLU H . . 4.270 3.554 3.357 3.841 . 0 0 "[ . 1 . 2]" 1
2165 1 67 THR MG 1 69 GLU HA . . 5.410 5.093 4.703 5.289 . 0 0 "[ . 1 . 2]" 1
2166 1 67 THR MG 1 69 GLU HB2 . . 4.740 4.614 4.261 4.750 0.010 19 0 "[ . 1 . 2]" 1
2167 1 67 THR MG 1 69 GLU HB3 . . 5.490 5.307 4.863 5.487 . 0 0 "[ . 1 . 2]" 1
2168 1 67 THR MG 1 69 GLU HG2 . . 3.670 3.539 3.023 3.678 0.008 19 0 "[ . 1 . 2]" 1
2169 1 67 THR MG 1 69 GLU QG . . 3.150 2.613 2.175 2.781 . 0 0 "[ . 1 . 2]" 1
2170 1 67 THR MG 1 69 GLU HG3 . . 3.670 2.692 2.230 2.879 . 0 0 "[ . 1 . 2]" 1
2171 1 68 ILE H 1 68 ILE HB . . 3.430 2.603 2.446 2.749 . 0 0 "[ . 1 . 2]" 1
2172 1 68 ILE H 1 68 ILE MD . . 4.360 3.517 3.190 3.710 . 0 0 "[ . 1 . 2]" 1
2173 1 68 ILE H 1 68 ILE HG12 . . 3.820 3.295 2.890 3.605 . 0 0 "[ . 1 . 2]" 1
2174 1 68 ILE H 1 68 ILE QG . . 3.270 2.018 1.889 2.270 . 0 0 "[ . 1 . 2]" 1
2175 1 68 ILE H 1 68 ILE HG13 . . 3.820 2.037 1.900 2.296 . 0 0 "[ . 1 . 2]" 1
2176 1 68 ILE H 1 68 ILE MG . . 4.380 3.770 3.752 3.791 . 0 0 "[ . 1 . 2]" 1
2177 1 68 ILE H 1 69 GLU H . . 4.870 4.216 4.119 4.360 . 0 0 "[ . 1 . 2]" 1
2178 1 68 ILE HA 1 68 ILE MD . . 3.940 3.816 3.740 3.884 . 0 0 "[ . 1 . 2]" 1
2179 1 68 ILE HA 1 68 ILE HG12 . . 3.860 2.531 2.406 2.747 . 0 0 "[ . 1 . 2]" 1
2180 1 68 ILE HA 1 68 ILE QG . . 3.300 2.383 2.303 2.466 . 0 0 "[ . 1 . 2]" 1
2181 1 68 ILE HA 1 68 ILE HG13 . . 3.860 2.943 2.723 3.193 . 0 0 "[ . 1 . 2]" 1
2182 1 68 ILE HA 1 68 ILE MG . . 3.110 2.428 2.317 2.470 . 0 0 "[ . 1 . 2]" 1
2183 1 68 ILE HA 1 69 GLU H . . 3.110 2.222 2.158 2.277 . 0 0 "[ . 1 . 2]" 1
2184 1 68 ILE HA 1 69 GLU HB2 . . 5.010 4.750 4.709 4.825 . 0 0 "[ . 1 . 2]" 1
2185 1 68 ILE HA 1 69 GLU HG2 . . 5.030 4.857 4.624 5.031 0.001 17 0 "[ . 1 . 2]" 1
2186 1 68 ILE HA 1 69 GLU QG . . 4.310 3.996 3.858 4.085 . 0 0 "[ . 1 . 2]" 1
2187 1 68 ILE HA 1 69 GLU HG3 . . 5.030 4.257 4.007 4.370 . 0 0 "[ . 1 . 2]" 1
2188 1 68 ILE HA 1 70 ASN H . . 4.490 3.539 3.229 3.750 . 0 0 "[ . 1 . 2]" 1
2189 1 68 ILE HB 1 68 ILE MD . . 3.640 2.377 2.222 2.532 . 0 0 "[ . 1 . 2]" 1
2190 1 68 ILE HB 1 74 ARG HD2 . . 5.000 4.946 4.591 5.016 0.016 19 0 "[ . 1 . 2]" 1
2191 1 68 ILE HB 1 74 ARG QD . . 4.150 3.384 3.011 3.557 . 0 0 "[ . 1 . 2]" 1
2192 1 68 ILE HB 1 74 ARG HD3 . . 5.000 3.446 3.052 3.642 . 0 0 "[ . 1 . 2]" 1
2193 1 68 ILE HB 1 74 ARG HG2 . . 4.200 3.661 3.349 3.933 . 0 0 "[ . 1 . 2]" 1
2194 1 68 ILE MD 1 68 ILE MG . . 3.240 2.025 1.890 2.400 . 0 0 "[ . 1 . 2]" 1
2195 1 68 ILE MD 1 74 ARG HA . . 4.450 3.444 3.051 3.697 . 0 0 "[ . 1 . 2]" 1
2196 1 68 ILE MD 1 74 ARG HG2 . . 4.940 2.565 2.174 2.892 . 0 0 "[ . 1 . 2]" 1
2197 1 68 ILE MG 1 69 GLU H . . 4.080 3.279 3.096 3.499 . 0 0 "[ . 1 . 2]" 1
2198 1 68 ILE MG 1 69 GLU HA . . 4.930 3.999 3.749 4.225 . 0 0 "[ . 1 . 2]" 1
2199 1 68 ILE MG 1 70 ASN H . . 3.350 2.178 1.880 2.916 . 0 0 "[ . 1 . 2]" 1
2200 1 68 ILE MG 1 70 ASN QB . . 4.120 2.881 2.607 3.373 . 0 0 "[ . 1 . 2]" 1
2201 1 68 ILE MG 1 73 HIS H . . 4.240 3.953 3.554 4.231 . 0 0 "[ . 1 . 2]" 1
2202 1 68 ILE MG 1 73 HIS HA . . 5.250 4.581 4.269 4.933 . 0 0 "[ . 1 . 2]" 1
2203 1 68 ILE MG 1 73 HIS HB2 . . 3.810 3.119 2.365 3.799 . 0 0 "[ . 1 . 2]" 1
2204 1 68 ILE MG 1 73 HIS QB . . 3.330 2.148 1.810 2.565 . 0 0 "[ . 1 . 2]" 1
2205 1 68 ILE MG 1 73 HIS HB3 . . 3.810 2.277 1.835 3.109 . 0 0 "[ . 1 . 2]" 1
2206 1 68 ILE MG 1 74 ARG H . . 3.720 2.920 2.533 3.190 . 0 0 "[ . 1 . 2]" 1
2207 1 68 ILE MG 1 74 ARG HA . . 3.920 3.693 3.283 3.912 . 0 0 "[ . 1 . 2]" 1
2208 1 68 ILE MG 1 74 ARG HB2 . . 3.950 3.738 3.457 3.960 0.010 18 0 "[ . 1 . 2]" 1
2209 1 68 ILE MG 1 74 ARG HB3 . . 4.780 4.532 4.271 4.726 . 0 0 "[ . 1 . 2]" 1
2210 1 68 ILE MG 1 74 ARG HD2 . . 4.840 4.535 4.026 4.762 . 0 0 "[ . 1 . 2]" 1
2211 1 68 ILE MG 1 74 ARG QD . . 4.120 3.561 3.114 3.797 . 0 0 "[ . 1 . 2]" 1
2212 1 68 ILE MG 1 74 ARG HD3 . . 4.840 3.726 3.241 4.043 . 0 0 "[ . 1 . 2]" 1
2213 1 68 ILE MG 1 74 ARG HG2 . . 3.740 3.033 2.609 3.293 . 0 0 "[ . 1 . 2]" 1
2214 1 68 ILE MG 1 74 ARG HG3 . . 3.950 2.031 1.804 2.163 . 0 0 "[ . 1 . 2]" 1
2215 1 68 ILE MG 1 75 ARG H . . 5.500 5.174 4.930 5.435 . 0 0 "[ . 1 . 2]" 1
2216 1 69 GLU H 1 69 GLU HB2 . . 3.620 2.561 2.514 2.619 . 0 0 "[ . 1 . 2]" 1
2217 1 69 GLU H 1 69 GLU HB3 . . 3.730 3.638 3.617 3.692 . 0 0 "[ . 1 . 2]" 1
2218 1 69 GLU H 1 69 GLU HG2 . . 3.920 3.142 2.891 3.339 . 0 0 "[ . 1 . 2]" 1
2219 1 69 GLU H 1 69 GLU HG3 . . 3.920 2.439 2.273 2.662 . 0 0 "[ . 1 . 2]" 1
2220 1 69 GLU H 1 70 ASN H . . 3.290 2.831 2.103 3.291 0.001 20 0 "[ . 1 . 2]" 1
2221 1 69 GLU H 1 70 ASN HB2 . . 5.500 4.370 3.981 4.895 . 0 0 "[ . 1 . 2]" 1
2222 1 69 GLU H 1 70 ASN QB . . 4.810 4.069 3.894 4.189 . 0 0 "[ . 1 . 2]" 1
2223 1 69 GLU H 1 70 ASN HB3 . . 5.500 4.976 4.516 5.532 0.032 19 0 "[ . 1 . 2]" 1
2224 1 69 GLU HA 1 69 GLU HG2 . . 3.590 2.498 2.450 2.585 . 0 0 "[ . 1 . 2]" 1
2225 1 69 GLU HA 1 69 GLU HG3 . . 3.590 3.423 3.270 3.518 . 0 0 "[ . 1 . 2]" 1
2226 1 69 GLU HB2 1 70 ASN H . . 4.330 3.787 2.936 4.260 . 0 0 "[ . 1 . 2]" 1
2227 1 69 GLU HB2 1 70 ASN QB . . 4.910 4.207 3.955 4.559 . 0 0 "[ . 1 . 2]" 1
2228 1 70 ASN H 1 70 ASN HB2 . . 3.450 2.918 2.172 3.400 . 0 0 "[ . 1 . 2]" 1
2229 1 70 ASN H 1 70 ASN QB . . 2.980 2.570 2.151 2.808 . 0 0 "[ . 1 . 2]" 1
2230 1 70 ASN H 1 70 ASN HB3 . . 3.450 3.011 2.395 3.478 0.028 10 0 "[ . 1 . 2]" 1
2231 1 70 ASN H 1 70 ASN QD . . 4.980 4.681 4.311 4.946 . 0 0 "[ . 1 . 2]" 1
2232 1 70 ASN H 1 71 SER H . . 4.790 3.948 3.788 4.178 . 0 0 "[ . 1 . 2]" 1
2233 1 70 ASN H 1 73 HIS H . . 5.290 5.071 4.923 5.294 0.004 12 0 "[ . 1 . 2]" 1
2234 1 70 ASN H 1 73 HIS QB . . 4.580 4.022 3.809 4.313 . 0 0 "[ . 1 . 2]" 1
2235 1 70 ASN HA 1 70 ASN HD21 . . 4.910 3.754 2.373 4.442 . 0 0 "[ . 1 . 2]" 1
2236 1 70 ASN HA 1 70 ASN HD22 . . 4.910 4.229 3.667 4.741 . 0 0 "[ . 1 . 2]" 1
2237 1 70 ASN HA 1 71 SER HA . . 5.020 4.463 4.401 4.557 . 0 0 "[ . 1 . 2]" 1
2238 1 70 ASN HA 1 72 SER H . . 5.300 4.076 3.731 4.309 . 0 0 "[ . 1 . 2]" 1
2239 1 70 ASN QB 1 73 HIS H . . 3.570 3.018 2.613 3.439 . 0 0 "[ . 1 . 2]" 1
2240 1 70 ASN QB 1 73 HIS QB . . 3.710 2.501 2.161 2.953 . 0 0 "[ . 1 . 2]" 1
2241 1 70 ASN QD 1 72 SER QB . . 4.730 2.650 1.817 4.270 . 0 0 "[ . 1 . 2]" 1
2242 1 70 ASN QD 1 73 HIS H . . 4.640 3.164 1.792 4.581 . 0 0 "[ . 1 . 2]" 1
2243 1 70 ASN QD 1 73 HIS QB . . 4.760 3.397 1.871 4.629 . 0 0 "[ . 1 . 2]" 1
2244 1 71 SER HA 1 74 ARG H . . 4.030 3.288 3.139 3.466 . 0 0 "[ . 1 . 2]" 1
2245 1 71 SER HA 1 74 ARG HB2 . . 3.770 2.657 2.322 2.822 . 0 0 "[ . 1 . 2]" 1
2246 1 71 SER HA 1 74 ARG HB3 . . 4.490 4.304 3.894 4.492 0.002 8 0 "[ . 1 . 2]" 1
2247 1 71 SER HA 1 74 ARG HG2 . . 5.200 5.052 4.863 5.159 . 0 0 "[ . 1 . 2]" 1
2248 1 71 SER HA 1 74 ARG HG3 . . 3.630 3.595 3.451 3.640 0.010 19 0 "[ . 1 . 2]" 1
2249 1 71 SER HA 1 75 ARG H . . 4.410 4.090 3.877 4.410 . 0 0 "[ . 1 . 2]" 1
2250 1 71 SER QB 1 73 HIS H . . 5.340 4.605 4.413 4.843 . 0 0 "[ . 1 . 2]" 1
2251 1 71 SER QB 1 74 ARG HB2 . . 5.340 4.147 3.869 4.532 . 0 0 "[ . 1 . 2]" 1
2252 1 71 SER HB2 1 72 SER H . . 5.340 2.601 2.105 3.791 . 0 0 "[ . 1 . 2]" 1
2253 1 71 SER HB3 1 72 SER H . . 5.340 3.073 2.207 3.478 . 0 0 "[ . 1 . 2]" 1
2254 1 72 SER H 1 72 SER QB . . 3.240 2.364 2.149 2.669 . 0 0 "[ . 1 . 2]" 1
2255 1 72 SER H 1 73 HIS H . . 3.380 3.048 2.991 3.127 . 0 0 "[ . 1 . 2]" 1
2256 1 72 SER H 1 74 ARG H . . 5.050 4.541 4.402 4.723 . 0 0 "[ . 1 . 2]" 1
2257 1 72 SER HA 1 75 ARG H . . 3.720 3.604 3.406 3.721 0.001 6 0 "[ . 1 . 2]" 1
2258 1 72 SER HA 1 75 ARG HB3 . . 3.450 2.834 2.521 3.110 . 0 0 "[ . 1 . 2]" 1
2259 1 72 SER HA 1 76 VAL H . . 4.550 4.215 3.776 4.537 . 0 0 "[ . 1 . 2]" 1
2260 1 72 SER HA 1 76 VAL MG2 . . 4.220 3.818 3.362 4.097 . 0 0 "[ . 1 . 2]" 1
2261 1 72 SER QB 1 73 HIS H . . 3.200 2.479 2.297 2.640 . 0 0 "[ . 1 . 2]" 1
2262 1 72 SER QB 1 75 ARG H . . 5.340 4.995 4.695 5.161 . 0 0 "[ . 1 . 2]" 1
2263 1 72 SER QB 1 76 VAL MG2 . . 4.270 3.745 3.053 4.273 0.003 12 0 "[ . 1 . 2]" 1
2264 1 72 SER HB2 1 73 HIS H . . 3.840 3.050 2.363 3.755 . 0 0 "[ . 1 . 2]" 1
2265 1 72 SER HB3 1 73 HIS H . . 3.840 3.014 2.325 3.763 . 0 0 "[ . 1 . 2]" 1
2266 1 72 SER HG 1 76 VAL MG2 . . 5.500 4.413 2.503 5.471 . 0 0 "[ . 1 . 2]" 1
2267 1 73 HIS H 1 73 HIS HB2 . . 3.600 2.440 2.212 2.618 . 0 0 "[ . 1 . 2]" 1
2268 1 73 HIS H 1 73 HIS QB . . 3.010 2.248 2.148 2.377 . 0 0 "[ . 1 . 2]" 1
2269 1 73 HIS H 1 73 HIS HB3 . . 3.600 2.771 2.445 3.582 . 0 0 "[ . 1 . 2]" 1
2270 1 73 HIS H 1 73 HIS HD2 . . 5.290 4.711 3.542 5.136 . 0 0 "[ . 1 . 2]" 1
2271 1 73 HIS H 1 74 ARG H . . 3.120 2.804 2.648 2.929 . 0 0 "[ . 1 . 2]" 1
2272 1 73 HIS H 1 74 ARG HB2 . . 5.120 4.722 4.551 4.920 . 0 0 "[ . 1 . 2]" 1
2273 1 73 HIS H 1 74 ARG HG3 . . 5.500 5.122 4.960 5.412 . 0 0 "[ . 1 . 2]" 1
2274 1 73 HIS H 1 75 ARG H . . 4.420 4.190 4.051 4.379 . 0 0 "[ . 1 . 2]" 1
2275 1 73 HIS H 1 75 ARG HB3 . . 5.500 5.218 4.852 5.455 . 0 0 "[ . 1 . 2]" 1
2276 1 73 HIS H 1 76 VAL H . . 4.930 4.851 4.722 4.969 0.039 7 0 "[ . 1 . 2]" 1
2277 1 73 HIS H 1 76 VAL MG2 . . 4.730 4.493 4.180 4.724 . 0 0 "[ . 1 . 2]" 1
2278 1 73 HIS HA 1 73 HIS HD2 . . 3.330 2.804 2.245 3.216 . 0 0 "[ . 1 . 2]" 1
2279 1 73 HIS HA 1 76 VAL H . . 3.770 3.633 3.379 3.765 . 0 0 "[ . 1 . 2]" 1
2280 1 73 HIS HA 1 76 VAL HB . . 3.750 3.136 2.853 3.289 . 0 0 "[ . 1 . 2]" 1
2281 1 73 HIS HA 1 76 VAL MG2 . . 3.640 3.026 2.684 3.387 . 0 0 "[ . 1 . 2]" 1
2282 1 73 HIS HA 1 77 ILE H . . 4.940 4.140 3.789 4.442 . 0 0 "[ . 1 . 2]" 1
2283 1 73 HIS HA 1 77 ILE MD . . 5.500 4.374 3.874 5.001 . 0 0 "[ . 1 . 2]" 1
2284 1 73 HIS HA 1 77 ILE HG13 . . 4.930 4.302 3.705 4.633 . 0 0 "[ . 1 . 2]" 1
2285 1 73 HIS QB 1 74 ARG H . . 3.380 2.389 2.183 2.529 . 0 0 "[ . 1 . 2]" 1
2286 1 73 HIS QB 1 74 ARG HA . . 5.340 4.010 3.786 4.196 . 0 0 "[ . 1 . 2]" 1
2287 1 73 HIS QB 1 75 ARG H . . 5.060 4.671 4.496 4.785 . 0 0 "[ . 1 . 2]" 1
2288 1 73 HIS QB 1 77 ILE MD . . 5.090 3.790 2.776 4.450 . 0 0 "[ . 1 . 2]" 1
2289 1 73 HIS HB2 1 74 ARG H . . 4.040 3.524 2.344 3.877 . 0 0 "[ . 1 . 2]" 1
2290 1 73 HIS HB3 1 74 ARG H . . 4.040 2.552 2.203 3.234 . 0 0 "[ . 1 . 2]" 1
2291 1 73 HIS HD2 1 76 VAL HB . . 5.300 4.520 2.948 5.169 . 0 0 "[ . 1 . 2]" 1
2292 1 73 HIS HD2 1 76 VAL MG1 . . 5.480 4.958 3.787 5.483 0.003 8 0 "[ . 1 . 2]" 1
2293 1 73 HIS HD2 1 76 VAL MG2 . . 5.500 4.520 3.489 5.084 . 0 0 "[ . 1 . 2]" 1
2294 1 74 ARG H 1 74 ARG HB2 . . 3.390 2.279 2.210 2.367 . 0 0 "[ . 1 . 2]" 1
2295 1 74 ARG H 1 74 ARG HB3 . . 3.910 3.541 3.509 3.571 . 0 0 "[ . 1 . 2]" 1
2296 1 74 ARG H 1 74 ARG HG2 . . 4.140 3.606 3.414 3.795 . 0 0 "[ . 1 . 2]" 1
2297 1 74 ARG H 1 74 ARG HG3 . . 3.300 2.704 2.458 2.940 . 0 0 "[ . 1 . 2]" 1
2298 1 74 ARG H 1 75 ARG H . . 3.220 2.738 2.601 2.887 . 0 0 "[ . 1 . 2]" 1
2299 1 74 ARG HA 1 74 ARG HG2 . . 3.590 2.300 2.172 2.412 . 0 0 "[ . 1 . 2]" 1
2300 1 74 ARG HA 1 76 VAL HB . . 5.500 5.278 5.053 5.541 0.041 7 0 "[ . 1 . 2]" 1
2301 1 74 ARG HA 1 77 ILE H . . 4.160 3.628 3.400 3.939 . 0 0 "[ . 1 . 2]" 1
2302 1 74 ARG HA 1 77 ILE HB . . 3.660 2.788 2.577 3.110 . 0 0 "[ . 1 . 2]" 1
2303 1 74 ARG HA 1 77 ILE MD . . 4.130 3.182 2.876 3.526 . 0 0 "[ . 1 . 2]" 1
2304 1 74 ARG HA 1 77 ILE MG . . 4.380 4.053 3.810 4.271 . 0 0 "[ . 1 . 2]" 1
2305 1 74 ARG HA 1 78 LEU H . . 4.660 3.533 3.241 3.712 . 0 0 "[ . 1 . 2]" 1
2306 1 74 ARG HA 1 78 LEU QD . . 4.750 3.211 2.424 3.964 . 0 0 "[ . 1 . 2]" 1
2307 1 74 ARG HA 1 78 LEU HG . . 5.500 4.632 3.483 5.520 0.020 18 0 "[ . 1 . 2]" 1
2308 1 74 ARG HB2 1 75 ARG H . . 3.480 2.689 2.472 2.915 . 0 0 "[ . 1 . 2]" 1
2309 1 74 ARG HB2 1 78 LEU QD . . 4.990 3.914 3.589 4.275 . 0 0 "[ . 1 . 2]" 1
2310 1 74 ARG HB3 1 74 ARG QD . . 3.470 2.271 2.137 2.477 . 0 0 "[ . 1 . 2]" 1
2311 1 74 ARG HB3 1 75 ARG H . . 3.700 3.343 3.203 3.560 . 0 0 "[ . 1 . 2]" 1
2312 1 74 ARG HB3 1 75 ARG HA . . 4.260 4.119 4.015 4.199 . 0 0 "[ . 1 . 2]" 1
2313 1 74 ARG HB3 1 78 LEU QD . . 3.140 2.506 2.079 2.905 . 0 0 "[ . 1 . 2]" 1
2314 1 74 ARG QD 1 78 LEU QD . . 4.610 3.084 2.649 3.662 . 0 0 "[ . 1 . 2]" 1
2315 1 74 ARG HG2 1 75 ARG H . . 5.100 4.969 4.882 5.079 . 0 0 "[ . 1 . 2]" 1
2316 1 74 ARG HG2 1 78 LEU QD . . 4.050 3.469 2.976 3.961 . 0 0 "[ . 1 . 2]" 1
2317 1 74 ARG HG3 1 75 ARG H . . 4.780 4.636 4.446 4.781 0.001 5 0 "[ . 1 . 2]" 1
2318 1 74 ARG HG3 1 78 LEU QD . . 4.870 4.530 4.130 4.866 . 0 0 "[ . 1 . 2]" 1
2319 1 75 ARG H 1 75 ARG HB2 . . 2.910 2.470 2.284 2.930 0.020 7 0 "[ . 1 . 2]" 1
2320 1 75 ARG H 1 75 ARG HB3 . . 3.060 2.586 2.184 2.791 . 0 0 "[ . 1 . 2]" 1
2321 1 75 ARG H 1 75 ARG HD2 . . 5.170 4.833 4.485 5.158 . 0 0 "[ . 1 . 2]" 1
2322 1 75 ARG H 1 75 ARG QD . . 4.530 4.281 4.166 4.436 . 0 0 "[ . 1 . 2]" 1
2323 1 75 ARG H 1 75 ARG HD3 . . 5.170 4.822 4.536 5.063 . 0 0 "[ . 1 . 2]" 1
2324 1 75 ARG H 1 75 ARG HG2 . . 5.300 4.389 4.272 4.541 . 0 0 "[ . 1 . 2]" 1
2325 1 75 ARG H 1 75 ARG QG . . 4.500 3.970 3.814 4.021 . 0 0 "[ . 1 . 2]" 1
2326 1 75 ARG H 1 75 ARG HG3 . . 5.300 4.539 4.100 4.605 . 0 0 "[ . 1 . 2]" 1
2327 1 75 ARG H 1 76 VAL HB . . 5.320 5.017 4.807 5.155 . 0 0 "[ . 1 . 2]" 1
2328 1 75 ARG H 1 76 VAL MG2 . . 4.200 4.146 4.013 4.235 0.035 7 0 "[ . 1 . 2]" 1
2329 1 75 ARG H 1 78 LEU QD . . 4.740 4.358 4.013 4.661 . 0 0 "[ . 1 . 2]" 1
2330 1 75 ARG HA 1 75 ARG HB2 . . 2.890 2.477 2.279 2.569 . 0 0 "[ . 1 . 2]" 1
2331 1 75 ARG HA 1 75 ARG HD2 . . 4.590 4.243 3.072 4.573 . 0 0 "[ . 1 . 2]" 1
2332 1 75 ARG HA 1 75 ARG QD . . 3.800 3.322 2.407 3.514 . 0 0 "[ . 1 . 2]" 1
2333 1 75 ARG HA 1 75 ARG HD3 . . 4.590 3.475 2.515 3.719 . 0 0 "[ . 1 . 2]" 1
2334 1 75 ARG HA 1 75 ARG QG . . 3.450 2.399 2.236 3.306 . 0 0 "[ . 1 . 2]" 1
2335 1 75 ARG HA 1 76 VAL HA . . 4.830 4.779 4.732 4.819 . 0 0 "[ . 1 . 2]" 1
2336 1 75 ARG HA 1 76 VAL MG2 . . 4.890 4.863 4.788 4.910 0.020 19 0 "[ . 1 . 2]" 1
2337 1 75 ARG HA 1 78 LEU H . . 4.430 4.157 3.808 4.439 0.009 7 0 "[ . 1 . 2]" 1
2338 1 75 ARG HA 1 78 LEU HB2 . . 3.890 3.075 2.889 3.356 . 0 0 "[ . 1 . 2]" 1
2339 1 75 ARG HA 1 78 LEU QD . . 4.210 3.589 2.993 4.197 . 0 0 "[ . 1 . 2]" 1
2340 1 75 ARG HA 1 79 THR H . . 4.300 3.434 3.205 3.616 . 0 0 "[ . 1 . 2]" 1
2341 1 75 ARG HA 1 79 THR MG . . 5.500 5.409 5.265 5.521 0.021 7 0 "[ . 1 . 2]" 1
2342 1 75 ARG HB2 1 75 ARG HD2 . . 4.050 3.501 3.413 3.618 . 0 0 "[ . 1 . 2]" 1
2343 1 75 ARG HB2 1 75 ARG QD . . 3.520 3.187 2.378 3.261 . 0 0 "[ . 1 . 2]" 1
2344 1 75 ARG HB2 1 75 ARG HD3 . . 4.050 3.736 2.420 3.953 . 0 0 "[ . 1 . 2]" 1
2345 1 75 ARG HB3 1 75 ARG HD2 . . 4.210 2.373 2.109 3.885 . 0 0 "[ . 1 . 2]" 1
2346 1 75 ARG HB3 1 75 ARG HD3 . . 4.210 2.865 2.435 3.567 . 0 0 "[ . 1 . 2]" 1
2347 1 75 ARG HB3 1 76 VAL H . . 3.120 2.563 2.399 2.727 . 0 0 "[ . 1 . 2]" 1
2348 1 75 ARG HB3 1 76 VAL HA . . 4.810 4.230 4.019 4.729 . 0 0 "[ . 1 . 2]" 1
2349 1 75 ARG HB3 1 76 VAL MG2 . . 3.660 3.022 2.812 3.357 . 0 0 "[ . 1 . 2]" 1
2350 1 75 ARG QD 1 76 VAL HB . . 5.340 4.807 4.410 5.414 0.074 7 0 "[ . 1 . 2]" 1
2351 1 75 ARG QD 1 76 VAL MG2 . . 4.880 2.916 2.432 3.994 . 0 0 "[ . 1 . 2]" 1
2352 1 75 ARG QD 1 79 THR MG . . 5.340 3.557 3.185 4.056 . 0 0 "[ . 1 . 2]" 1
2353 1 75 ARG QG 1 79 THR MG . . 4.750 4.306 4.057 4.692 . 0 0 "[ . 1 . 2]" 1
2354 1 76 VAL H 1 76 VAL HB . . 2.840 2.558 2.495 2.628 . 0 0 "[ . 1 . 2]" 1
2355 1 76 VAL H 1 76 VAL MG1 . . 3.960 3.765 3.762 3.771 . 0 0 "[ . 1 . 2]" 1
2356 1 76 VAL H 1 76 VAL MG2 . . 2.770 2.041 1.874 2.165 . 0 0 "[ . 1 . 2]" 1
2357 1 76 VAL H 1 77 ILE HB . . 4.850 4.777 4.641 4.864 0.014 7 0 "[ . 1 . 2]" 1
2358 1 76 VAL H 1 77 ILE MD . . 5.500 5.351 5.154 5.496 . 0 0 "[ . 1 . 2]" 1
2359 1 76 VAL HA 1 76 VAL MG1 . . 2.900 2.320 2.268 2.375 . 0 0 "[ . 1 . 2]" 1
2360 1 76 VAL HA 1 76 VAL MG2 . . 2.810 2.449 2.421 2.479 . 0 0 "[ . 1 . 2]" 1
2361 1 76 VAL HA 1 79 THR H . . 4.540 4.263 3.940 4.391 . 0 0 "[ . 1 . 2]" 1
2362 1 76 VAL HA 1 79 THR HB . . 3.380 2.986 2.802 3.087 . 0 0 "[ . 1 . 2]" 1
2363 1 76 VAL HA 1 79 THR HG1 . . 4.930 4.034 3.643 4.624 . 0 0 "[ . 1 . 2]" 1
2364 1 76 VAL HA 1 79 THR MG . . 4.430 4.139 3.853 4.325 . 0 0 "[ . 1 . 2]" 1
2365 1 76 VAL HA 1 80 GLU H . . 4.350 3.645 3.498 3.762 . 0 0 "[ . 1 . 2]" 1
2366 1 76 VAL HA 1 80 GLU HG2 . . 4.450 3.683 3.519 3.859 . 0 0 "[ . 1 . 2]" 1
2367 1 76 VAL HA 1 80 GLU HG3 . . 4.810 4.009 3.874 4.101 . 0 0 "[ . 1 . 2]" 1
2368 1 76 VAL HB 1 77 ILE H . . 3.310 2.338 1.998 2.577 . 0 0 "[ . 1 . 2]" 1
2369 1 76 VAL HB 1 77 ILE HB . . 4.810 4.621 4.508 4.763 . 0 0 "[ . 1 . 2]" 1
2370 1 76 VAL HB 1 77 ILE MD . . 5.500 4.577 4.476 4.746 . 0 0 "[ . 1 . 2]" 1
2371 1 76 VAL HB 1 77 ILE HG12 . . 5.000 4.757 4.371 4.943 . 0 0 "[ . 1 . 2]" 1
2372 1 76 VAL MG1 1 77 ILE H . . 3.730 3.306 2.996 3.486 . 0 0 "[ . 1 . 2]" 1
2373 1 76 VAL MG1 1 77 ILE HA . . 3.670 3.535 3.421 3.630 . 0 0 "[ . 1 . 2]" 1
2374 1 76 VAL MG1 1 77 ILE MD . . 5.070 4.811 4.624 4.934 . 0 0 "[ . 1 . 2]" 1
2375 1 76 VAL MG1 1 77 ILE HG12 . . 4.650 4.400 4.098 4.645 . 0 0 "[ . 1 . 2]" 1
2376 1 76 VAL MG1 1 77 ILE HG13 . . 3.870 3.703 3.465 3.855 . 0 0 "[ . 1 . 2]" 1
2377 1 76 VAL MG1 1 79 THR H . . 5.500 5.403 5.188 5.513 0.013 18 0 "[ . 1 . 2]" 1
2378 1 76 VAL MG1 1 79 THR HB . . 4.500 4.346 4.230 4.482 . 0 0 "[ . 1 . 2]" 1
2379 1 76 VAL MG1 1 80 GLU H . . 4.340 3.936 3.794 4.040 . 0 0 "[ . 1 . 2]" 1
2380 1 76 VAL MG1 1 80 GLU HA . . 5.500 5.195 4.971 5.363 . 0 0 "[ . 1 . 2]" 1
2381 1 76 VAL MG1 1 80 GLU HB3 . . 4.830 4.506 4.338 4.566 . 0 0 "[ . 1 . 2]" 1
2382 1 76 VAL MG1 1 80 GLU HG2 . . 3.450 3.027 2.781 3.234 . 0 0 "[ . 1 . 2]" 1
2383 1 76 VAL MG1 1 80 GLU HG3 . . 3.270 2.314 2.076 2.433 . 0 0 "[ . 1 . 2]" 1
2384 1 76 VAL MG2 1 77 ILE H . . 3.850 3.714 3.586 3.827 . 0 0 "[ . 1 . 2]" 1
2385 1 76 VAL MG2 1 79 THR HB . . 4.990 4.830 4.634 4.903 . 0 0 "[ . 1 . 2]" 1
2386 1 76 VAL MG2 1 80 GLU HG3 . . 4.830 4.816 4.669 4.844 0.014 18 0 "[ . 1 . 2]" 1
2387 1 77 ILE H 1 77 ILE HB . . 3.030 2.429 2.345 2.645 . 0 0 "[ . 1 . 2]" 1
2388 1 77 ILE H 1 77 ILE MD . . 3.740 3.546 3.442 3.669 . 0 0 "[ . 1 . 2]" 1
2389 1 77 ILE H 1 77 ILE HG12 . . 3.920 3.628 3.226 3.798 . 0 0 "[ . 1 . 2]" 1
2390 1 77 ILE H 1 77 ILE HG13 . . 3.030 2.320 1.949 2.522 . 0 0 "[ . 1 . 2]" 1
2391 1 77 ILE H 1 77 ILE MG . . 4.050 3.741 3.713 3.773 . 0 0 "[ . 1 . 2]" 1
2392 1 77 ILE H 1 78 LEU H . . 3.570 2.949 2.711 3.203 . 0 0 "[ . 1 . 2]" 1
2393 1 77 ILE H 1 79 THR H . . 5.220 4.569 4.203 4.928 . 0 0 "[ . 1 . 2]" 1
2394 1 77 ILE HA 1 77 ILE MD . . 3.970 3.806 3.775 3.834 . 0 0 "[ . 1 . 2]" 1
2395 1 77 ILE HA 1 77 ILE HG12 . . 3.400 2.512 2.423 2.581 . 0 0 "[ . 1 . 2]" 1
2396 1 77 ILE HA 1 77 ILE HG13 . . 3.440 2.797 2.682 2.982 . 0 0 "[ . 1 . 2]" 1
2397 1 77 ILE HA 1 77 ILE MG . . 3.140 2.451 2.360 2.488 . 0 0 "[ . 1 . 2]" 1
2398 1 77 ILE HA 1 80 GLU H . . 4.600 4.133 3.844 4.292 . 0 0 "[ . 1 . 2]" 1
2399 1 77 ILE HA 1 80 GLU HB2 . . 4.000 3.058 2.789 3.188 . 0 0 "[ . 1 . 2]" 1
2400 1 77 ILE HA 1 80 GLU HB3 . . 4.770 4.601 4.333 4.743 . 0 0 "[ . 1 . 2]" 1
2401 1 77 ILE HA 1 80 GLU HG3 . . 4.350 4.154 3.912 4.316 . 0 0 "[ . 1 . 2]" 1
2402 1 77 ILE HA 1 81 LEU H . . 4.470 3.981 3.852 4.129 . 0 0 "[ . 1 . 2]" 1
2403 1 77 ILE HB 1 77 ILE MD . . 3.380 2.398 2.278 2.493 . 0 0 "[ . 1 . 2]" 1
2404 1 77 ILE HB 1 78 LEU H . . 3.190 2.253 2.116 2.487 . 0 0 "[ . 1 . 2]" 1
2405 1 77 ILE HB 1 78 LEU QD . . 4.900 3.546 2.617 4.323 . 0 0 "[ . 1 . 2]" 1
2406 1 77 ILE MD 1 77 ILE MG . . 3.010 1.970 1.912 2.111 . 0 0 "[ . 1 . 2]" 1
2407 1 77 ILE MD 1 78 LEU H . . 5.000 4.272 4.084 4.439 . 0 0 "[ . 1 . 2]" 1
2408 1 77 ILE MG 1 78 LEU H . . 3.920 2.793 2.314 3.080 . 0 0 "[ . 1 . 2]" 1
2409 1 77 ILE MG 1 78 LEU HA . . 3.990 3.120 2.902 3.253 . 0 0 "[ . 1 . 2]" 1
2410 1 77 ILE MG 1 78 LEU HB2 . . 4.980 4.454 4.033 4.711 . 0 0 "[ . 1 . 2]" 1
2411 1 77 ILE MG 1 78 LEU HG . . 5.270 3.820 3.102 5.054 . 0 0 "[ . 1 . 2]" 1
2412 1 77 ILE MG 1 81 LEU H . . 4.450 3.980 3.876 4.218 . 0 0 "[ . 1 . 2]" 1
2413 1 77 ILE MG 1 81 LEU HB2 . . 4.080 3.147 2.804 3.724 . 0 0 "[ . 1 . 2]" 1
2414 1 78 LEU H 1 78 LEU HB2 . . 3.190 2.293 2.210 2.379 . 0 0 "[ . 1 . 2]" 1
2415 1 78 LEU H 1 78 LEU HB3 . . 3.740 3.546 3.510 3.570 . 0 0 "[ . 1 . 2]" 1
2416 1 78 LEU H 1 78 LEU MD1 . . 4.190 3.250 2.048 3.841 . 0 0 "[ . 1 . 2]" 1
2417 1 78 LEU H 1 78 LEU QD . . 3.660 2.666 1.899 3.326 . 0 0 "[ . 1 . 2]" 1
2418 1 78 LEU H 1 78 LEU MD2 . . 4.190 3.388 1.904 4.069 . 0 0 "[ . 1 . 2]" 1
2419 1 78 LEU H 1 78 LEU HG . . 4.110 3.148 2.453 3.991 . 0 0 "[ . 1 . 2]" 1
2420 1 78 LEU H 1 79 THR H . . 3.380 3.038 2.733 3.178 . 0 0 "[ . 1 . 2]" 1
2421 1 78 LEU H 1 80 GLU H . . 4.880 4.618 4.301 4.882 0.002 1 0 "[ . 1 . 2]" 1
2422 1 78 LEU H 1 81 LEU H . . 5.070 4.640 4.497 4.774 . 0 0 "[ . 1 . 2]" 1
2423 1 78 LEU HA 1 78 LEU MD1 . . 3.900 3.187 2.038 3.874 . 0 0 "[ . 1 . 2]" 1
2424 1 78 LEU HA 1 78 LEU QD . . 2.730 2.271 1.913 2.742 0.012 20 0 "[ . 1 . 2]" 1
2425 1 78 LEU HA 1 78 LEU MD2 . . 3.900 2.622 2.146 3.786 . 0 0 "[ . 1 . 2]" 1
2426 1 78 LEU HA 1 78 LEU HG . . 3.760 2.898 2.327 3.715 . 0 0 "[ . 1 . 2]" 1
2427 1 78 LEU HA 1 81 LEU H . . 3.850 3.613 3.357 3.852 0.002 4 0 "[ . 1 . 2]" 1
2428 1 78 LEU HA 1 81 LEU HB2 . . 3.930 2.785 2.316 3.331 . 0 0 "[ . 1 . 2]" 1
2429 1 78 LEU HA 1 81 LEU HB3 . . 4.150 3.229 2.704 3.909 . 0 0 "[ . 1 . 2]" 1
2430 1 78 LEU HA 1 81 LEU MD1 . . 5.060 3.743 2.313 4.847 . 0 0 "[ . 1 . 2]" 1
2431 1 78 LEU HA 1 81 LEU QD . . 3.980 2.852 2.307 3.210 . 0 0 "[ . 1 . 2]" 1
2432 1 78 LEU HA 1 81 LEU MD2 . . 5.060 3.787 2.946 4.971 . 0 0 "[ . 1 . 2]" 1
2433 1 78 LEU HA 1 82 GLU H . . 4.380 4.182 3.985 4.366 . 0 0 "[ . 1 . 2]" 1
2434 1 78 LEU HB2 1 78 LEU MD1 . . 3.260 2.431 2.029 3.185 . 0 0 "[ . 1 . 2]" 1
2435 1 78 LEU HB2 1 78 LEU QD . . 2.800 2.153 2.006 2.384 . 0 0 "[ . 1 . 2]" 1
2436 1 78 LEU HB2 1 78 LEU MD2 . . 3.260 2.817 2.197 3.176 . 0 0 "[ . 1 . 2]" 1
2437 1 78 LEU HB2 1 79 THR H . . 3.480 2.347 2.143 2.508 . 0 0 "[ . 1 . 2]" 1
2438 1 78 LEU HB2 1 79 THR HA . . 4.840 4.517 4.359 4.628 . 0 0 "[ . 1 . 2]" 1
2439 1 78 LEU HB2 1 79 THR HB . . 4.980 4.870 4.697 4.967 . 0 0 "[ . 1 . 2]" 1
2440 1 78 LEU HB2 1 80 GLU H . . 5.500 5.185 4.949 5.429 . 0 0 "[ . 1 . 2]" 1
2441 1 78 LEU HB3 1 78 LEU MD1 . . 3.300 2.596 2.213 3.193 . 0 0 "[ . 1 . 2]" 1
2442 1 78 LEU HB3 1 78 LEU QD . . 2.780 2.135 2.005 2.281 . 0 0 "[ . 1 . 2]" 1
2443 1 78 LEU HB3 1 78 LEU MD2 . . 3.300 2.454 2.119 3.192 . 0 0 "[ . 1 . 2]" 1
2444 1 78 LEU HB3 1 79 THR H . . 3.840 2.870 2.591 3.122 . 0 0 "[ . 1 . 2]" 1
2445 1 78 LEU HB3 1 79 THR HA . . 4.570 3.940 3.813 4.043 . 0 0 "[ . 1 . 2]" 1
2446 1 78 LEU HB3 1 79 THR HB . . 5.500 5.373 5.161 5.501 0.001 5 0 "[ . 1 . 2]" 1
2447 1 78 LEU QD 1 79 THR H . . 5.060 3.768 3.630 3.968 . 0 0 "[ . 1 . 2]" 1
2448 1 78 LEU QD 1 81 LEU H . . 5.200 4.976 4.569 5.207 0.007 15 0 "[ . 1 . 2]" 1
2449 1 78 LEU QD 1 81 LEU QD . . 3.500 3.178 2.750 3.519 0.019 8 0 "[ . 1 . 2]" 1
2450 1 78 LEU QD 1 82 GLU H . . 5.380 4.990 4.530 5.397 0.017 18 0 "[ . 1 . 2]" 1
2451 1 78 LEU HG 1 79 THR H . . 4.710 4.612 4.417 4.722 0.012 7 0 "[ . 1 . 2]" 1
2452 1 78 LEU HG 1 81 LEU QD . . 5.440 4.480 3.695 5.432 . 0 0 "[ . 1 . 2]" 1
2453 1 79 THR H 1 79 THR HB . . 3.100 2.604 2.482 2.709 . 0 0 "[ . 1 . 2]" 1
2454 1 79 THR H 1 79 THR HG1 . . 4.410 2.615 1.905 3.685 . 0 0 "[ . 1 . 2]" 1
2455 1 79 THR H 1 79 THR MG . . 3.840 3.774 3.765 3.790 . 0 0 "[ . 1 . 2]" 1
2456 1 79 THR H 1 80 GLU H . . 3.280 3.101 2.878 3.222 . 0 0 "[ . 1 . 2]" 1
2457 1 79 THR H 1 80 GLU HB2 . . 5.210 5.049 4.849 5.211 0.001 18 0 "[ . 1 . 2]" 1
2458 1 79 THR H 1 82 GLU H . . 5.500 4.718 4.636 4.811 . 0 0 "[ . 1 . 2]" 1
2459 1 79 THR HA 1 79 THR MG . . 2.790 2.404 2.300 2.478 . 0 0 "[ . 1 . 2]" 1
2460 1 79 THR HA 1 81 LEU H . . 4.800 4.457 4.241 4.690 . 0 0 "[ . 1 . 2]" 1
2461 1 79 THR HA 1 82 GLU H . . 3.710 3.529 3.421 3.719 0.009 8 0 "[ . 1 . 2]" 1
2462 1 79 THR HA 1 82 GLU HB2 . . 3.900 3.494 3.061 3.896 . 0 0 "[ . 1 . 2]" 1
2463 1 79 THR HA 1 82 GLU QB . . 3.320 2.843 2.677 3.081 . 0 0 "[ . 1 . 2]" 1
2464 1 79 THR HA 1 82 GLU HB3 . . 3.900 3.042 2.740 3.286 . 0 0 "[ . 1 . 2]" 1
2465 1 79 THR HA 1 82 GLU QG . . 4.610 4.368 4.109 4.581 . 0 0 "[ . 1 . 2]" 1
2466 1 79 THR HA 1 83 ARG H . . 5.070 4.954 4.799 5.068 . 0 0 "[ . 1 . 2]" 1
2467 1 79 THR HB 1 80 GLU H . . 3.210 2.213 2.069 2.404 . 0 0 "[ . 1 . 2]" 1
2468 1 79 THR HB 1 80 GLU HB2 . . 4.880 4.495 4.419 4.650 . 0 0 "[ . 1 . 2]" 1
2469 1 79 THR HB 1 80 GLU HG2 . . 4.500 3.448 3.285 3.586 . 0 0 "[ . 1 . 2]" 1
2470 1 79 THR HB 1 80 GLU HG3 . . 5.080 4.746 4.659 4.904 . 0 0 "[ . 1 . 2]" 1
2471 1 79 THR HB 1 83 ARG HG3 . . 5.500 5.422 5.240 5.505 0.005 18 0 "[ . 1 . 2]" 1
2472 1 79 THR MG 1 80 GLU H . . 3.840 3.000 2.716 3.257 . 0 0 "[ . 1 . 2]" 1
2473 1 79 THR MG 1 80 GLU HA . . 4.160 3.253 3.047 3.457 . 0 0 "[ . 1 . 2]" 1
2474 1 79 THR MG 1 80 GLU HB3 . . 5.500 5.159 4.901 5.329 . 0 0 "[ . 1 . 2]" 1
2475 1 79 THR MG 1 80 GLU HG2 . . 4.610 3.330 2.994 3.571 . 0 0 "[ . 1 . 2]" 1
2476 1 79 THR MG 1 80 GLU HG3 . . 5.500 4.834 4.554 5.063 . 0 0 "[ . 1 . 2]" 1
2477 1 79 THR MG 1 81 LEU H . . 5.180 4.798 4.574 5.035 . 0 0 "[ . 1 . 2]" 1
2478 1 79 THR MG 1 82 GLU H . . 4.780 4.513 4.348 4.750 . 0 0 "[ . 1 . 2]" 1
2479 1 79 THR MG 1 82 GLU QB . . 4.080 3.646 3.492 3.870 . 0 0 "[ . 1 . 2]" 1
2480 1 79 THR MG 1 82 GLU QG . . 5.040 4.643 4.318 4.909 . 0 0 "[ . 1 . 2]" 1
2481 1 79 THR MG 1 83 ARG H . . 4.720 4.623 4.416 4.730 0.010 18 0 "[ . 1 . 2]" 1
2482 1 79 THR MG 1 83 ARG QD . . 4.330 3.579 3.207 4.101 . 0 0 "[ . 1 . 2]" 1
2483 1 79 THR MG 1 83 ARG HG2 . . 4.430 4.038 3.826 4.226 . 0 0 "[ . 1 . 2]" 1
2484 1 79 THR MG 1 83 ARG HG3 . . 3.870 3.297 2.956 3.580 . 0 0 "[ . 1 . 2]" 1
2485 1 80 GLU H 1 80 GLU HB2 . . 3.270 2.405 2.331 2.470 . 0 0 "[ . 1 . 2]" 1
2486 1 80 GLU H 1 80 GLU HB3 . . 3.760 3.579 3.561 3.595 . 0 0 "[ . 1 . 2]" 1
2487 1 80 GLU H 1 80 GLU HG2 . . 3.410 2.434 2.307 2.598 . 0 0 "[ . 1 . 2]" 1
2488 1 80 GLU H 1 80 GLU HG3 . . 3.790 3.393 3.341 3.496 . 0 0 "[ . 1 . 2]" 1
2489 1 80 GLU H 1 81 LEU HB2 . . 5.500 4.742 4.505 5.026 . 0 0 "[ . 1 . 2]" 1
2490 1 80 GLU H 1 82 GLU H . . 4.570 4.207 3.968 4.424 . 0 0 "[ . 1 . 2]" 1
2491 1 80 GLU HA 1 80 GLU HG2 . . 3.520 2.591 2.511 2.666 . 0 0 "[ . 1 . 2]" 1
2492 1 80 GLU HA 1 80 GLU HG3 . . 3.840 3.711 3.674 3.752 . 0 0 "[ . 1 . 2]" 1
2493 1 80 GLU HA 1 82 GLU H . . 4.480 4.261 4.044 4.485 0.005 8 0 "[ . 1 . 2]" 1
2494 1 80 GLU HA 1 83 ARG H . . 3.630 3.532 3.333 3.634 0.004 13 0 "[ . 1 . 2]" 1
2495 1 80 GLU HA 1 83 ARG HB2 . . 3.510 3.342 2.948 3.530 0.020 9 0 "[ . 1 . 2]" 1
2496 1 80 GLU HA 1 83 ARG HD2 . . 5.500 3.817 2.849 4.776 . 0 0 "[ . 1 . 2]" 1
2497 1 80 GLU HA 1 83 ARG QD . . 4.730 3.412 2.818 4.198 . 0 0 "[ . 1 . 2]" 1
2498 1 80 GLU HA 1 83 ARG HD3 . . 5.500 4.169 3.383 5.107 . 0 0 "[ . 1 . 2]" 1
2499 1 80 GLU HA 1 83 ARG HG2 . . 4.470 4.319 4.132 4.474 0.004 9 0 "[ . 1 . 2]" 1
2500 1 80 GLU HA 1 83 ARG HG3 . . 4.590 2.573 2.368 2.805 . 0 0 "[ . 1 . 2]" 1
2501 1 80 GLU HA 1 84 VAL H . . 4.670 4.308 4.074 4.454 . 0 0 "[ . 1 . 2]" 1
2502 1 80 GLU HA 1 84 VAL MG1 . . 4.860 4.454 4.119 4.710 . 0 0 "[ . 1 . 2]" 1
2503 1 80 GLU HB2 1 81 LEU H . . 3.600 2.668 2.449 2.805 . 0 0 "[ . 1 . 2]" 1
2504 1 80 GLU HB2 1 81 LEU QD . . 5.200 4.590 4.428 4.760 . 0 0 "[ . 1 . 2]" 1
2505 1 80 GLU HB3 1 81 LEU H . . 3.680 3.505 3.324 3.687 0.007 8 0 "[ . 1 . 2]" 1
2506 1 80 GLU HB3 1 81 LEU HA . . 4.960 4.251 4.167 4.386 . 0 0 "[ . 1 . 2]" 1
2507 1 80 GLU HB3 1 84 VAL MG1 . . 4.640 3.689 3.356 3.905 . 0 0 "[ . 1 . 2]" 1
2508 1 80 GLU HG2 1 81 LEU H . . 4.710 4.545 4.463 4.635 . 0 0 "[ . 1 . 2]" 1
2509 1 81 LEU H 1 81 LEU HB2 . . 2.820 2.183 2.112 2.296 . 0 0 "[ . 1 . 2]" 1
2510 1 81 LEU H 1 81 LEU MD1 . . 4.780 3.646 3.357 3.856 . 0 0 "[ . 1 . 2]" 1
2511 1 81 LEU H 1 81 LEU QD . . 3.970 3.431 3.231 3.589 . 0 0 "[ . 1 . 2]" 1
2512 1 81 LEU H 1 81 LEU MD2 . . 4.780 4.191 4.044 4.276 . 0 0 "[ . 1 . 2]" 1
2513 1 81 LEU H 1 81 LEU HG . . 4.730 3.958 3.046 4.546 . 0 0 "[ . 1 . 2]" 1
2514 1 81 LEU H 1 82 GLU H . . 3.070 2.670 2.549 2.793 . 0 0 "[ . 1 . 2]" 1
2515 1 81 LEU H 1 83 ARG H . . 4.380 4.073 3.934 4.292 . 0 0 "[ . 1 . 2]" 1
2516 1 81 LEU H 1 84 VAL MG1 . . 5.220 5.068 4.811 5.233 0.013 1 0 "[ . 1 . 2]" 1
2517 1 81 LEU HA 1 81 LEU MD1 . . 3.870 2.861 2.071 3.799 . 0 0 "[ . 1 . 2]" 1
2518 1 81 LEU HA 1 81 LEU QD . . 2.830 2.264 2.062 2.449 . 0 0 "[ . 1 . 2]" 1
2519 1 81 LEU HA 1 81 LEU MD2 . . 3.870 3.238 2.187 3.859 . 0 0 "[ . 1 . 2]" 1
2520 1 81 LEU HA 1 81 LEU HG . . 3.940 2.625 2.412 2.810 . 0 0 "[ . 1 . 2]" 1
2521 1 81 LEU HA 1 83 ARG H . . 5.340 3.876 3.650 4.237 . 0 0 "[ . 1 . 2]" 1
2522 1 81 LEU HA 1 84 VAL H . . 4.310 3.585 3.409 3.728 . 0 0 "[ . 1 . 2]" 1
2523 1 81 LEU HA 1 84 VAL HB . . 4.790 4.582 4.475 4.775 . 0 0 "[ . 1 . 2]" 1
2524 1 81 LEU HA 1 84 VAL MG1 . . 3.730 3.587 3.351 3.727 . 0 0 "[ . 1 . 2]" 1
2525 1 81 LEU HA 1 84 VAL MG2 . . 2.850 1.850 1.792 1.911 . 0 0 "[ . 1 . 2]" 1
2526 1 81 LEU HA 1 85 ARG H . . 3.930 3.792 3.634 3.947 0.017 15 0 "[ . 1 . 2]" 1
2527 1 81 LEU HB2 1 81 LEU MD1 . . 3.570 2.150 1.971 2.288 . 0 0 "[ . 1 . 2]" 1
2528 1 81 LEU HB2 1 81 LEU MD2 . . 3.570 2.743 2.387 3.177 . 0 0 "[ . 1 . 2]" 1
2529 1 81 LEU HB2 1 82 GLU H . . 3.850 3.382 2.886 3.801 . 0 0 "[ . 1 . 2]" 1
2530 1 81 LEU HB3 1 81 LEU MD1 . . 3.630 2.931 2.484 3.189 . 0 0 "[ . 1 . 2]" 1
2531 1 81 LEU HB3 1 81 LEU MD2 . . 3.630 2.204 2.067 2.311 . 0 0 "[ . 1 . 2]" 1
2532 1 81 LEU HB3 1 82 GLU H . . 4.060 2.935 2.497 3.431 . 0 0 "[ . 1 . 2]" 1
2533 1 81 LEU QD 1 82 GLU HA . . 5.440 4.640 4.353 4.860 . 0 0 "[ . 1 . 2]" 1
2534 1 81 LEU QD 1 84 VAL H . . 5.210 4.905 4.696 5.087 . 0 0 "[ . 1 . 2]" 1
2535 1 81 LEU QD 1 84 VAL HB . . 4.610 4.514 4.339 4.618 0.008 4 0 "[ . 1 . 2]" 1
2536 1 81 LEU QD 1 84 VAL MG1 . . 4.130 4.049 3.872 4.135 0.005 12 0 "[ . 1 . 2]" 1
2537 1 81 LEU QD 1 84 VAL MG2 . . 3.980 2.385 2.202 2.478 . 0 0 "[ . 1 . 2]" 1
2538 1 81 LEU QD 1 85 ARG H . . 4.390 4.315 4.053 4.407 0.017 15 0 "[ . 1 . 2]" 1
2539 1 81 LEU QD 1 85 ARG HA . . 5.440 5.200 5.066 5.409 . 0 0 "[ . 1 . 2]" 1
2540 1 81 LEU QD 1 85 ARG QD . . 5.280 3.669 3.005 4.704 . 0 0 "[ . 1 . 2]" 1
2541 1 81 LEU MD1 1 82 GLU H . . 4.970 4.754 4.572 4.915 . 0 0 "[ . 1 . 2]" 1
2542 1 81 LEU MD2 1 82 GLU H . . 4.970 4.536 4.292 4.774 . 0 0 "[ . 1 . 2]" 1
2543 1 81 LEU HG 1 82 GLU H . . 5.140 4.639 4.333 4.964 . 0 0 "[ . 1 . 2]" 1
2544 1 81 LEU HG 1 84 VAL MG2 . . 4.140 3.222 2.824 3.674 . 0 0 "[ . 1 . 2]" 1
2545 1 82 GLU H 1 82 GLU HB2 . . 3.020 2.572 2.377 2.855 . 0 0 "[ . 1 . 2]" 1
2546 1 82 GLU H 1 82 GLU HB3 . . 3.020 2.489 2.238 2.693 . 0 0 "[ . 1 . 2]" 1
2547 1 82 GLU H 1 83 ARG H . . 2.980 2.633 2.485 2.768 . 0 0 "[ . 1 . 2]" 1
2548 1 82 GLU H 1 83 ARG HB2 . . 5.140 5.022 4.751 5.147 0.007 18 0 "[ . 1 . 2]" 1
2549 1 82 GLU H 1 83 ARG HG3 . . 5.270 4.172 3.871 4.441 . 0 0 "[ . 1 . 2]" 1
2550 1 82 GLU H 1 85 ARG HG2 . . 5.480 4.545 4.165 4.866 . 0 0 "[ . 1 . 2]" 1
2551 1 82 GLU HA 1 82 GLU QG . . 3.130 2.751 2.480 2.978 . 0 0 "[ . 1 . 2]" 1
2552 1 82 GLU HA 1 84 VAL H . . 5.500 5.177 4.940 5.367 . 0 0 "[ . 1 . 2]" 1
2553 1 82 GLU HA 1 85 ARG H . . 4.140 4.052 3.799 4.153 0.013 20 0 "[ . 1 . 2]" 1
2554 1 82 GLU HA 1 85 ARG HB3 . . 4.190 4.025 3.796 4.197 0.007 19 0 "[ . 1 . 2]" 1
2555 1 82 GLU HA 1 85 ARG HD2 . . 4.080 3.051 2.001 3.867 . 0 0 "[ . 1 . 2]" 1
2556 1 82 GLU HA 1 85 ARG QD . . 3.540 2.235 1.964 2.477 . 0 0 "[ . 1 . 2]" 1
2557 1 82 GLU HA 1 85 ARG HD3 . . 4.080 2.435 2.001 3.737 . 0 0 "[ . 1 . 2]" 1
2558 1 82 GLU HA 1 85 ARG HG2 . . 3.230 2.329 2.038 2.572 . 0 0 "[ . 1 . 2]" 1
2559 1 82 GLU QB 1 82 GLU QG . . 2.330 2.023 2.001 2.065 . 0 0 "[ . 1 . 2]" 1
2560 1 82 GLU QB 1 83 ARG H . . 3.600 2.927 2.576 3.147 . 0 0 "[ . 1 . 2]" 1
2561 1 82 GLU QB 1 83 ARG HA . . 5.340 4.292 4.100 4.535 . 0 0 "[ . 1 . 2]" 1
2562 1 82 GLU QB 1 85 ARG QD . . 4.990 3.833 3.510 4.149 . 0 0 "[ . 1 . 2]" 1
2563 1 82 GLU HB2 1 83 ARG H . . 4.370 4.099 3.855 4.314 . 0 0 "[ . 1 . 2]" 1
2564 1 82 GLU HB3 1 83 ARG H . . 4.370 2.999 2.616 3.234 . 0 0 "[ . 1 . 2]" 1
2565 1 82 GLU QG 1 83 ARG H . . 4.560 3.879 3.527 4.201 . 0 0 "[ . 1 . 2]" 1
2566 1 82 GLU QG 1 83 ARG HA . . 4.740 3.803 3.443 4.434 . 0 0 "[ . 1 . 2]" 1
2567 1 82 GLU QG 1 85 ARG HG2 . . 4.320 3.973 3.649 4.282 . 0 0 "[ . 1 . 2]" 1
2568 1 82 GLU HG2 1 83 ARG H . . 5.310 4.686 3.758 5.184 . 0 0 "[ . 1 . 2]" 1
2569 1 82 GLU HG2 1 83 ARG HA . . 5.460 4.907 3.733 5.457 . 0 0 "[ . 1 . 2]" 1
2570 1 82 GLU HG3 1 83 ARG H . . 5.310 4.229 3.671 4.874 . 0 0 "[ . 1 . 2]" 1
2571 1 82 GLU HG3 1 83 ARG HA . . 5.460 4.104 3.506 5.319 . 0 0 "[ . 1 . 2]" 1
2572 1 83 ARG H 1 83 ARG HB2 . . 2.840 2.591 2.492 2.676 . 0 0 "[ . 1 . 2]" 1
2573 1 83 ARG H 1 83 ARG HB3 . . 3.740 3.632 3.595 3.669 . 0 0 "[ . 1 . 2]" 1
2574 1 83 ARG H 1 83 ARG HD2 . . 5.350 4.636 4.148 4.951 . 0 0 "[ . 1 . 2]" 1
2575 1 83 ARG H 1 83 ARG HD3 . . 5.350 4.710 4.442 5.120 . 0 0 "[ . 1 . 2]" 1
2576 1 83 ARG H 1 83 ARG HG2 . . 3.260 3.032 2.882 3.260 0.000 10 0 "[ . 1 . 2]" 1
2577 1 83 ARG H 1 83 ARG HG3 . . 3.820 2.408 2.134 2.709 . 0 0 "[ . 1 . 2]" 1
2578 1 83 ARG H 1 84 VAL H . . 3.120 2.620 2.419 2.848 . 0 0 "[ . 1 . 2]" 1
2579 1 83 ARG H 1 84 VAL MG1 . . 4.710 4.346 4.104 4.612 . 0 0 "[ . 1 . 2]" 1
2580 1 83 ARG H 1 84 VAL MG2 . . 4.500 3.366 3.148 3.571 . 0 0 "[ . 1 . 2]" 1
2581 1 83 ARG H 1 85 ARG H . . 4.170 3.786 3.545 4.090 . 0 0 "[ . 1 . 2]" 1
2582 1 83 ARG HA 1 83 ARG HD2 . . 5.120 4.622 3.874 4.841 . 0 0 "[ . 1 . 2]" 1
2583 1 83 ARG HA 1 83 ARG HD3 . . 5.120 4.358 3.883 4.663 . 0 0 "[ . 1 . 2]" 1
2584 1 83 ARG HA 1 83 ARG HG2 . . 3.430 2.528 2.422 2.679 . 0 0 "[ . 1 . 2]" 1
2585 1 83 ARG HA 1 83 ARG HG3 . . 3.580 3.476 3.337 3.554 . 0 0 "[ . 1 . 2]" 1
2586 1 83 ARG HA 1 84 VAL MG2 . . 5.150 4.775 4.686 4.971 . 0 0 "[ . 1 . 2]" 1
2587 1 83 ARG HA 1 85 ARG H . . 4.660 4.323 4.059 4.506 . 0 0 "[ . 1 . 2]" 1
2588 1 83 ARG HB2 1 84 VAL H . . 3.700 2.141 2.014 2.283 . 0 0 "[ . 1 . 2]" 1
2589 1 83 ARG HB2 1 84 VAL MG1 . . 4.440 3.227 3.040 3.385 . 0 0 "[ . 1 . 2]" 1
2590 1 83 ARG HB2 1 84 VAL MG2 . . 4.210 3.815 3.593 3.988 . 0 0 "[ . 1 . 2]" 1
2591 1 83 ARG HB2 1 85 ARG H . . 5.030 4.705 4.466 4.851 . 0 0 "[ . 1 . 2]" 1
2592 1 83 ARG HB3 1 83 ARG QD . . 3.540 2.352 2.070 2.709 . 0 0 "[ . 1 . 2]" 1
2593 1 83 ARG HB3 1 84 VAL H . . 3.550 3.381 3.200 3.529 . 0 0 "[ . 1 . 2]" 1
2594 1 83 ARG HB3 1 84 VAL HA . . 4.930 4.437 4.333 4.557 . 0 0 "[ . 1 . 2]" 1
2595 1 83 ARG HB3 1 84 VAL MG1 . . 4.730 4.283 3.983 4.477 . 0 0 "[ . 1 . 2]" 1
2596 1 83 ARG HB3 1 84 VAL MG2 . . 5.220 5.001 4.839 5.170 . 0 0 "[ . 1 . 2]" 1
2597 1 83 ARG HB3 1 85 ARG H . . 5.500 5.441 5.146 5.510 0.010 8 0 "[ . 1 . 2]" 1
2598 1 83 ARG HG2 1 84 VAL H . . 4.800 4.573 4.485 4.653 . 0 0 "[ . 1 . 2]" 1
2599 1 83 ARG HG3 1 84 VAL H . . 4.570 3.909 3.736 4.117 . 0 0 "[ . 1 . 2]" 1
2600 1 83 ARG HG3 1 84 VAL MG1 . . 5.120 4.967 4.700 5.118 . 0 0 "[ . 1 . 2]" 1
2601 1 84 VAL H 1 84 VAL HB . . 3.660 3.618 3.606 3.629 . 0 0 "[ . 1 . 2]" 1
2602 1 84 VAL H 1 84 VAL MG1 . . 2.930 2.263 2.005 2.510 . 0 0 "[ . 1 . 2]" 1
2603 1 84 VAL H 1 84 VAL MG2 . . 3.250 2.031 1.885 2.309 . 0 0 "[ . 1 . 2]" 1
2604 1 84 VAL H 1 85 ARG H . . 2.970 2.850 2.657 2.960 . 0 0 "[ . 1 . 2]" 1
2605 1 84 VAL H 1 85 ARG HA . . 5.500 5.425 5.273 5.506 0.006 2 0 "[ . 1 . 2]" 1
2606 1 84 VAL HA 1 84 VAL MG1 . . 2.810 2.274 2.154 2.384 . 0 0 "[ . 1 . 2]" 1
2607 1 84 VAL HA 1 84 VAL MG2 . . 3.330 3.190 3.175 3.200 . 0 0 "[ . 1 . 2]" 1
2608 1 84 VAL HB 1 85 ARG H . . 3.920 3.602 3.419 3.809 . 0 0 "[ . 1 . 2]" 1
2609 1 84 VAL MG1 1 85 ARG H . . 4.100 3.982 3.914 4.077 . 0 0 "[ . 1 . 2]" 1
2610 1 84 VAL MG2 1 85 ARG H . . 3.810 1.950 1.836 2.102 . 0 0 "[ . 1 . 2]" 1
2611 1 84 VAL MG2 1 85 ARG HA . . 4.020 3.481 3.337 3.666 . 0 0 "[ . 1 . 2]" 1
2612 1 84 VAL MG2 1 85 ARG HB3 . . 4.250 2.897 2.736 3.085 . 0 0 "[ . 1 . 2]" 1
2613 1 84 VAL MG2 1 85 ARG QD . . 4.760 4.321 3.842 4.827 0.067 15 0 "[ . 1 . 2]" 1
2614 1 84 VAL MG2 1 85 ARG HG2 . . 4.550 3.817 3.471 4.088 . 0 0 "[ . 1 . 2]" 1
2615 1 85 ARG H 1 85 ARG HB2 . . 3.610 3.578 3.540 3.609 . 0 0 "[ . 1 . 2]" 1
2616 1 85 ARG H 1 85 ARG HB3 . . 3.020 2.370 2.265 2.540 . 0 0 "[ . 1 . 2]" 1
2617 1 85 ARG H 1 85 ARG HD2 . . 4.750 4.268 3.676 4.738 . 0 0 "[ . 1 . 2]" 1
2618 1 85 ARG H 1 85 ARG HD3 . . 4.750 4.611 3.713 4.750 . 0 0 "[ . 1 . 2]" 1
2619 1 85 ARG H 1 85 ARG HG2 . . 3.140 2.527 2.171 2.706 . 0 0 "[ . 1 . 2]" 1
2620 1 85 ARG H 1 85 ARG HG3 . . 4.690 3.653 3.328 3.967 . 0 0 "[ . 1 . 2]" 1
2621 1 85 ARG HA 1 85 ARG HG2 . . 3.890 3.807 3.680 3.890 . 0 0 "[ . 1 . 2]" 1
2622 1 85 ARG HB2 1 85 ARG QD . . 3.530 2.646 2.303 3.032 . 0 0 "[ . 1 . 2]" 1
2623 1 85 ARG HB2 1 86 SER H . . 3.960 3.719 2.308 3.957 . 0 0 "[ . 1 . 2]" 1
2624 1 85 ARG HB3 1 85 ARG HD2 . . 4.130 2.570 2.246 3.770 . 0 0 "[ . 1 . 2]" 1
2625 1 85 ARG HB3 1 85 ARG QD . . 3.590 2.416 2.220 2.925 . 0 0 "[ . 1 . 2]" 1
2626 1 85 ARG HB3 1 85 ARG HD3 . . 4.130 3.424 2.505 3.693 . 0 0 "[ . 1 . 2]" 1
2627 1 85 ARG HB3 1 85 ARG HG2 . . 2.940 2.437 2.347 2.575 . 0 0 "[ . 1 . 2]" 1
2628 1 85 ARG HB3 1 86 SER H . . 3.920 3.677 3.540 3.844 . 0 0 "[ . 1 . 2]" 1
2629 1 85 ARG HG2 1 86 SER H . . 3.950 2.323 1.920 3.438 . 0 0 "[ . 1 . 2]" 1
2630 1 85 ARG HG2 1 86 SER HA . . 4.760 4.289 3.808 4.760 0.000 11 0 "[ . 1 . 2]" 1
2631 1 85 ARG HG2 1 86 SER HB2 . . 5.500 3.856 2.828 5.468 . 0 0 "[ . 1 . 2]" 1
2632 1 85 ARG HG2 1 86 SER QB . . 4.700 3.577 2.745 4.712 0.012 19 0 "[ . 1 . 2]" 1
2633 1 85 ARG HG2 1 86 SER HB3 . . 5.500 4.405 3.401 5.345 . 0 0 "[ . 1 . 2]" 1
2634 1 86 SER H 1 86 SER HB2 . . 3.410 2.594 2.165 3.105 . 0 0 "[ . 1 . 2]" 1
2635 1 86 SER H 1 86 SER QB . . 2.890 2.301 2.144 2.889 . 0 0 "[ . 1 . 2]" 1
2636 1 86 SER H 1 86 SER HB3 . . 3.410 2.733 2.301 3.483 0.073 10 0 "[ . 1 . 2]" 1
2637 1 86 SER QB 1 87 GLY H . . 4.370 3.192 1.890 3.959 . 0 0 "[ . 1 . 2]" 1
2638 1 86 SER HB2 1 87 GLY H . . 5.000 3.959 1.899 4.596 . 0 0 "[ . 1 . 2]" 1
2639 1 86 SER HB3 1 87 GLY H . . 5.000 3.530 2.243 4.419 . 0 0 "[ . 1 . 2]" 1
2640 1 87 GLY H 1 88 PRO HD2 . . 5.500 3.993 1.964 4.845 . 0 0 "[ . 1 . 2]" 1
2641 1 87 GLY H 1 88 PRO QD . . 4.690 3.510 1.915 4.367 . 0 0 "[ . 1 . 2]" 1
2642 1 87 GLY H 1 88 PRO HD3 . . 5.500 4.131 1.955 5.110 . 0 0 "[ . 1 . 2]" 1
2643 1 87 GLY QA 1 88 PRO QD . . 2.850 1.987 1.835 2.214 . 0 0 "[ . 1 . 2]" 1
2644 1 87 GLY QA 1 88 PRO QG . . 4.620 3.743 3.641 4.006 . 0 0 "[ . 1 . 2]" 1
2645 1 90 SER HB2 1 91 GLY H . . 5.500 3.774 2.645 4.633 . 0 0 "[ . 1 . 2]" 1
2646 1 90 SER HB3 1 91 GLY H . . 5.500 3.379 2.148 4.427 . 0 0 "[ . 1 . 2]" 1
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