NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
445554 |
2kk8   |
16355 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kk8
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 1373
_Distance_constraint_stats_list.Viol_count 327
_Distance_constraint_stats_list.Viol_total 185.163
_Distance_constraint_stats_list.Viol_max 0.121
_Distance_constraint_stats_list.Viol_rms 0.0039
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0003
_Distance_constraint_stats_list.Viol_average_violations_only 0.0283
_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 9 SER 0.102 0.045 19 0 "[ . 1 . 2]"
1 10 HIS 0.006 0.006 4 0 "[ . 1 . 2]"
1 11 MET 0.034 0.025 7 0 "[ . 1 . 2]"
1 12 LYS 0.108 0.045 16 0 "[ . 1 . 2]"
1 13 PHE 0.540 0.113 2 0 "[ . 1 . 2]"
1 14 LEU 0.086 0.038 20 0 "[ . 1 . 2]"
1 15 VAL 0.410 0.062 8 0 "[ . 1 . 2]"
1 16 GLU 0.073 0.024 2 0 "[ . 1 . 2]"
1 17 ASN 0.484 0.083 15 0 "[ . 1 . 2]"
1 18 LEU 0.234 0.067 4 0 "[ . 1 . 2]"
1 19 ASN 0.237 0.064 15 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 SER 0.010 0.010 5 0 "[ . 1 . 2]"
1 22 SER 0.231 0.042 5 0 "[ . 1 . 2]"
1 23 PHE 0.369 0.109 11 0 "[ . 1 . 2]"
1 24 GLU 0.100 0.043 16 0 "[ . 1 . 2]"
1 25 LEU 0.377 0.109 11 0 "[ . 1 . 2]"
1 26 GLU 0.023 0.014 11 0 "[ . 1 . 2]"
1 27 VAL 0.361 0.045 16 0 "[ . 1 . 2]"
1 28 ASP 0.024 0.018 12 0 "[ . 1 . 2]"
1 29 TYR 0.824 0.065 2 0 "[ . 1 . 2]"
1 30 ARG 0.016 0.016 8 0 "[ . 1 . 2]"
1 31 ASP 0.694 0.107 7 0 "[ . 1 . 2]"
1 32 THR 0.686 0.121 1 0 "[ . 1 . 2]"
1 33 LEU 0.429 0.079 18 0 "[ . 1 . 2]"
1 34 LEU 0.187 0.066 9 0 "[ . 1 . 2]"
1 35 VAL 0.272 0.080 18 0 "[ . 1 . 2]"
1 36 VAL 0.973 0.107 7 0 "[ . 1 . 2]"
1 37 LYS 0.164 0.035 12 0 "[ . 1 . 2]"
1 38 GLN 0.076 0.064 17 0 "[ . 1 . 2]"
1 39 LYS 0.062 0.051 3 0 "[ . 1 . 2]"
1 40 ILE 0.315 0.062 19 0 "[ . 1 . 2]"
1 41 GLU 0.081 0.032 3 0 "[ . 1 . 2]"
1 42 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 GLN 0.327 0.053 3 0 "[ . 1 . 2]"
1 45 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 46 ILE 0.363 0.050 2 0 "[ . 1 . 2]"
1 47 PRO 0.286 0.047 5 0 "[ . 1 . 2]"
1 48 VAL 0.197 0.035 12 0 "[ . 1 . 2]"
1 49 SER 0.059 0.025 16 0 "[ . 1 . 2]"
1 50 LYS 1.024 0.090 3 0 "[ . 1 . 2]"
1 51 GLN 0.078 0.050 14 0 "[ . 1 . 2]"
1 52 THR 0.551 0.054 2 0 "[ . 1 . 2]"
1 53 LEU 0.028 0.015 3 0 "[ . 1 . 2]"
1 54 ILE 0.156 0.063 8 0 "[ . 1 . 2]"
1 55 VAL 0.014 0.014 10 0 "[ . 1 . 2]"
1 56 ASP 0.036 0.023 17 0 "[ . 1 . 2]"
1 57 GLY 0.310 0.067 7 0 "[ . 1 . 2]"
1 58 ILE 0.249 0.067 7 0 "[ . 1 . 2]"
1 59 VAL 0.007 0.007 13 0 "[ . 1 . 2]"
1 60 ILE 0.059 0.030 6 0 "[ . 1 . 2]"
1 61 LEU 0.000 0.000 6 0 "[ . 1 . 2]"
1 62 ARG 0.079 0.048 19 0 "[ . 1 . 2]"
1 63 GLU 0.274 0.066 9 0 "[ . 1 . 2]"
1 64 ASP 0.038 0.020 4 0 "[ . 1 . 2]"
1 65 LEU 0.279 0.084 15 0 "[ . 1 . 2]"
1 66 THR 0.700 0.121 1 0 "[ . 1 . 2]"
1 67 VAL 0.310 0.050 14 0 "[ . 1 . 2]"
1 68 GLU 0.558 0.065 2 0 "[ . 1 . 2]"
1 69 GLN 0.270 0.084 15 0 "[ . 1 . 2]"
1 70 CYS 0.029 0.020 18 0 "[ . 1 . 2]"
1 71 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 72 ILE 0.175 0.050 14 0 "[ . 1 . 2]"
1 73 VAL 0.063 0.023 4 0 "[ . 1 . 2]"
1 74 PRO 0.049 0.019 14 0 "[ . 1 . 2]"
1 75 THR 0.270 0.066 5 0 "[ . 1 . 2]"
1 76 SER 0.284 0.066 5 0 "[ . 1 . 2]"
1 77 ASP 0.036 0.023 17 0 "[ . 1 . 2]"
1 78 ILE 0.304 0.062 8 0 "[ . 1 . 2]"
1 79 GLN 0.210 0.067 4 0 "[ . 1 . 2]"
1 80 LEU 0.800 0.083 15 0 "[ . 1 . 2]"
1 81 GLU 0.355 0.034 5 0 "[ . 1 . 2]"
1 82 VAL 0.362 0.064 13 0 "[ . 1 . 2]"
1 83 SER 0.342 0.090 3 0 "[ . 1 . 2]"
1 84 SER 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 9 SER HA 1 10 HIS HA 5.770 . 6.350 4.452 4.138 4.780 . 0 0 "[ . 1 . 2]" 1
2 1 9 SER HA 1 10 HIS QB 6.000 . 6.600 4.882 4.220 5.544 . 0 0 "[ . 1 . 2]" 1
3 1 9 SER HA 1 28 ASP HA 5.410 . 5.950 4.670 3.622 5.460 . 0 0 "[ . 1 . 2]" 1
4 1 9 SER HA 1 29 TYR H 5.110 . 5.620 3.762 3.166 5.102 . 0 0 "[ . 1 . 2]" 1
5 1 9 SER HA 1 29 TYR QB 5.010 . 5.510 3.802 2.647 5.510 . 0 0 "[ . 1 . 2]" 1
6 1 9 SER HA 1 29 TYR QD 3.630 . 3.990 2.308 1.783 3.555 0.017 17 0 "[ . 1 . 2]" 1
7 1 9 SER HA 1 29 TYR QE 4.310 . 4.740 3.155 2.104 4.324 . 0 0 "[ . 1 . 2]" 1
8 1 9 SER QB 1 29 TYR QD 3.810 . 4.190 3.138 1.755 4.230 0.045 19 0 "[ . 1 . 2]" 1
9 1 10 HIS H 1 11 MET H 5.110 . 5.620 4.015 3.090 4.479 . 0 0 "[ . 1 . 2]" 1
10 1 10 HIS H 1 29 TYR QD 5.360 . 5.900 4.018 2.359 5.088 . 0 0 "[ . 1 . 2]" 1
11 1 10 HIS HA 1 11 MET H 3.440 . 3.780 2.182 2.098 2.368 . 0 0 "[ . 1 . 2]" 1
12 1 10 HIS HA 1 26 GLU HG2 5.680 . 6.250 4.179 2.604 6.240 . 0 0 "[ . 1 . 2]" 1
13 1 10 HIS HA 1 26 GLU HG3 5.680 . 6.250 4.269 3.272 5.327 . 0 0 "[ . 1 . 2]" 1
14 1 10 HIS HA 1 28 ASP HA 4.320 . 4.750 2.699 1.794 4.141 0.006 4 0 "[ . 1 . 2]" 1
15 1 10 HIS QB 1 11 MET H 4.290 . 4.720 3.479 2.799 4.049 . 0 0 "[ . 1 . 2]" 1
16 1 10 HIS QB 1 26 GLU QG 4.960 . 5.460 3.062 1.951 5.128 . 0 0 "[ . 1 . 2]" 1
17 1 10 HIS QB 1 28 ASP HA 6.000 . 6.600 4.346 2.383 5.662 . 0 0 "[ . 1 . 2]" 1
18 1 10 HIS HB2 1 11 MET H 4.980 . 5.480 4.010 2.866 4.622 . 0 0 "[ . 1 . 2]" 1
19 1 10 HIS HB3 1 11 MET H 4.980 . 5.480 4.053 3.276 4.520 . 0 0 "[ . 1 . 2]" 1
20 1 11 MET H 1 11 MET QG 4.660 . 5.130 3.279 2.746 4.350 . 0 0 "[ . 1 . 2]" 1
21 1 11 MET H 1 12 LYS H 6.200 . 6.820 4.326 4.049 4.476 . 0 0 "[ . 1 . 2]" 1
22 1 11 MET H 1 26 GLU HA 5.260 . 5.790 4.320 3.747 4.832 . 0 0 "[ . 1 . 2]" 1
23 1 11 MET H 1 26 GLU QG 5.080 . 5.590 3.517 2.989 4.441 . 0 0 "[ . 1 . 2]" 1
24 1 11 MET H 1 27 VAL H 4.140 . 4.550 3.191 2.816 3.590 . 0 0 "[ . 1 . 2]" 1
25 1 11 MET H 1 27 VAL QG 4.520 . 4.970 3.395 2.946 4.415 . 0 0 "[ . 1 . 2]" 1
26 1 11 MET H 1 28 ASP HA 5.480 . 6.030 3.352 2.964 3.837 . 0 0 "[ . 1 . 2]" 1
27 1 11 MET HA 1 12 LYS H 3.210 . 3.530 2.209 2.091 2.441 . 0 0 "[ . 1 . 2]" 1
28 1 11 MET QB 1 12 LYS H 4.360 . 4.800 3.132 2.306 3.787 . 0 0 "[ . 1 . 2]" 1
29 1 11 MET QB 1 27 VAL H 4.970 . 5.470 3.858 3.261 4.563 . 0 0 "[ . 1 . 2]" 1
30 1 11 MET QB 1 27 VAL QG 4.120 . 4.530 2.907 1.960 4.463 . 0 0 "[ . 1 . 2]" 1
31 1 11 MET QB 1 29 TYR QD 4.630 . 5.090 4.601 3.163 5.023 . 0 0 "[ . 1 . 2]" 1
32 1 11 MET HB2 1 12 LYS H 5.000 . 5.500 4.160 3.448 4.519 . 0 0 "[ . 1 . 2]" 1
33 1 11 MET HB3 1 12 LYS H 5.000 . 5.500 3.265 2.342 4.172 . 0 0 "[ . 1 . 2]" 1
34 1 11 MET QG 1 12 LYS H 4.940 . 5.430 4.037 2.479 4.703 . 0 0 "[ . 1 . 2]" 1
35 1 11 MET QG 1 27 VAL QG 4.880 . 5.370 4.271 3.238 5.380 0.010 7 0 "[ . 1 . 2]" 1
36 1 11 MET QG 1 29 TYR QD 5.380 . 5.920 3.937 3.335 5.261 . 0 0 "[ . 1 . 2]" 1
37 1 11 MET QG 1 29 TYR QE 3.730 . 4.100 2.746 2.103 3.616 . 0 0 "[ . 1 . 2]" 1
38 1 11 MET HG2 1 29 TYR QD 6.100 . 6.710 4.794 3.548 6.458 . 0 0 "[ . 1 . 2]" 1
39 1 11 MET HG2 1 29 TYR QE 4.340 . 4.770 3.426 2.417 4.795 0.025 7 0 "[ . 1 . 2]" 1
40 1 11 MET HG3 1 29 TYR QD 6.100 . 6.710 4.423 3.525 5.573 . 0 0 "[ . 1 . 2]" 1
41 1 11 MET HG3 1 29 TYR QE 4.340 . 4.770 3.097 2.261 3.778 . 0 0 "[ . 1 . 2]" 1
42 1 12 LYS H 1 12 LYS QB 3.350 . 3.690 2.483 2.221 2.692 . 0 0 "[ . 1 . 2]" 1
43 1 12 LYS H 1 13 PHE H 4.990 . 5.490 4.257 3.841 4.552 . 0 0 "[ . 1 . 2]" 1
44 1 12 LYS H 1 27 VAL QG 5.700 . 6.270 5.016 4.143 6.097 . 0 0 "[ . 1 . 2]" 1
45 1 12 LYS HA 1 13 PHE H 3.190 . 3.510 2.192 2.128 2.294 . 0 0 "[ . 1 . 2]" 1
46 1 12 LYS HA 1 26 GLU HA 4.160 . 4.580 2.214 1.827 2.702 . 0 0 "[ . 1 . 2]" 1
47 1 12 LYS HA 1 26 GLU QG 6.000 . 6.600 3.868 3.120 4.807 . 0 0 "[ . 1 . 2]" 1
48 1 12 LYS HA 1 27 VAL H 4.460 . 4.910 3.287 2.895 3.959 . 0 0 "[ . 1 . 2]" 1
49 1 12 LYS HA 1 27 VAL MG1 5.980 . 6.580 4.622 3.241 6.443 . 0 0 "[ . 1 . 2]" 1
50 1 12 LYS HA 1 27 VAL QG 5.000 . 5.500 3.923 3.224 4.514 . 0 0 "[ . 1 . 2]" 1
51 1 12 LYS HA 1 27 VAL MG2 5.980 . 6.580 4.934 3.346 6.625 0.045 16 0 "[ . 1 . 2]" 1
52 1 12 LYS QB 1 13 PHE H 4.170 . 4.590 3.415 2.881 3.791 . 0 0 "[ . 1 . 2]" 1
53 1 12 LYS QB 1 24 GLU QB 5.160 . 5.680 2.799 1.780 4.483 0.020 17 0 "[ . 1 . 2]" 1
54 1 12 LYS QB 1 26 GLU HA 5.650 . 6.210 3.819 3.280 4.727 . 0 0 "[ . 1 . 2]" 1
55 1 12 LYS QB 1 26 GLU QB 5.340 . 5.870 4.118 3.556 5.121 . 0 0 "[ . 1 . 2]" 1
56 1 12 LYS QB 1 26 GLU QG 5.790 . 6.370 4.535 4.047 5.437 . 0 0 "[ . 1 . 2]" 1
57 1 12 LYS QD 1 24 GLU QB 4.390 . 4.830 3.266 1.777 4.415 0.023 7 0 "[ . 1 . 2]" 1
58 1 12 LYS QD 1 24 GLU QG 5.340 . 5.870 4.075 2.535 5.840 . 0 0 "[ . 1 . 2]" 1
59 1 12 LYS QD 1 26 GLU QG 5.230 . 5.750 4.243 3.204 5.697 . 0 0 "[ . 1 . 2]" 1
60 1 12 LYS HD2 1 26 GLU HA 6.200 . 6.820 5.141 3.936 6.679 . 0 0 "[ . 1 . 2]" 1
61 1 12 LYS HD3 1 26 GLU HA 6.200 . 6.820 5.083 4.076 6.556 . 0 0 "[ . 1 . 2]" 1
62 1 12 LYS QG 1 24 GLU QB 5.100 . 5.610 4.109 2.772 5.541 . 0 0 "[ . 1 . 2]" 1
63 1 12 LYS QG 1 26 GLU HA 5.020 . 5.520 2.616 1.924 3.793 . 0 0 "[ . 1 . 2]" 1
64 1 12 LYS QG 1 26 GLU QB 4.830 . 5.310 2.319 1.795 3.485 0.005 9 0 "[ . 1 . 2]" 1
65 1 12 LYS QG 1 26 GLU QG 4.490 . 4.940 2.757 2.177 3.754 . 0 0 "[ . 1 . 2]" 1
66 1 12 LYS HG2 1 13 PHE H 4.970 . 5.470 4.560 3.952 4.894 . 0 0 "[ . 1 . 2]" 1
67 1 12 LYS HG2 1 26 GLU HA 5.730 . 6.300 2.695 1.934 4.123 . 0 0 "[ . 1 . 2]" 1
68 1 12 LYS HG2 1 26 GLU HB2 6.200 . 6.820 2.395 1.813 3.801 . 0 0 "[ . 1 . 2]" 1
69 1 12 LYS HG2 1 26 GLU HB3 6.200 . 6.820 4.019 3.433 5.525 . 0 0 "[ . 1 . 2]" 1
70 1 12 LYS HG2 1 26 GLU HG2 6.200 . 6.820 4.445 3.692 6.104 . 0 0 "[ . 1 . 2]" 1
71 1 12 LYS HG2 1 26 GLU HG3 6.200 . 6.820 3.146 2.288 4.604 . 0 0 "[ . 1 . 2]" 1
72 1 12 LYS HG3 1 13 PHE H 4.970 . 5.470 5.194 4.847 5.332 . 0 0 "[ . 1 . 2]" 1
73 1 12 LYS HG3 1 26 GLU HA 5.730 . 6.300 3.701 2.903 4.431 . 0 0 "[ . 1 . 2]" 1
74 1 12 LYS HG3 1 26 GLU HB2 6.200 . 6.820 3.632 2.417 5.152 . 0 0 "[ . 1 . 2]" 1
75 1 12 LYS HG3 1 26 GLU HB3 6.200 . 6.820 5.199 4.110 6.602 . 0 0 "[ . 1 . 2]" 1
76 1 12 LYS HG3 1 26 GLU HG2 6.200 . 6.820 4.921 4.056 6.021 . 0 0 "[ . 1 . 2]" 1
77 1 12 LYS HG3 1 26 GLU HG3 6.200 . 6.820 3.322 2.338 5.056 . 0 0 "[ . 1 . 2]" 1
78 1 13 PHE H 1 13 PHE QB 3.660 . 4.030 2.847 2.592 3.137 . 0 0 "[ . 1 . 2]" 1
79 1 13 PHE H 1 13 PHE HD1 5.260 . 5.790 1.980 1.687 2.529 0.113 2 0 "[ . 1 . 2]" 1
80 1 13 PHE H 1 13 PHE HE1 4.460 . 4.910 4.024 3.871 4.266 . 0 0 "[ . 1 . 2]" 1
81 1 13 PHE H 1 14 LEU H 5.320 . 5.850 4.460 4.252 4.565 . 0 0 "[ . 1 . 2]" 1
82 1 13 PHE H 1 15 VAL QG 5.490 . 6.040 4.487 3.860 4.831 . 0 0 "[ . 1 . 2]" 1
83 1 13 PHE H 1 26 GLU HA 4.780 . 5.260 3.725 3.285 4.161 . 0 0 "[ . 1 . 2]" 1
84 1 13 PHE H 1 27 VAL QG 5.360 . 5.900 3.616 2.981 4.256 . 0 0 "[ . 1 . 2]" 1
85 1 13 PHE HA 1 14 LEU H 3.320 . 3.650 2.216 2.113 2.348 . 0 0 "[ . 1 . 2]" 1
86 1 13 PHE HA 1 14 LEU QB 5.010 . 5.510 4.010 3.929 4.076 . 0 0 "[ . 1 . 2]" 1
87 1 13 PHE QB 1 14 LEU H 3.820 . 4.200 2.886 2.624 3.096 . 0 0 "[ . 1 . 2]" 1
88 1 13 PHE QB 1 15 VAL QG 4.270 . 4.700 4.097 3.598 4.551 . 0 0 "[ . 1 . 2]" 1
89 1 13 PHE QB 1 27 VAL QG 5.780 . 6.360 3.724 2.974 4.965 . 0 0 "[ . 1 . 2]" 1
90 1 13 PHE QB 1 74 PRO HA 6.000 . 6.600 3.163 2.090 4.976 . 0 0 "[ . 1 . 2]" 1
91 1 13 PHE QB 1 78 ILE MD 5.140 . 5.650 2.699 1.817 4.509 . 0 0 "[ . 1 . 2]" 1
92 1 13 PHE HB2 1 14 LEU H 4.630 . 5.090 2.952 2.667 3.191 . 0 0 "[ . 1 . 2]" 1
93 1 13 PHE HB3 1 14 LEU H 4.630 . 5.090 4.085 3.907 4.188 . 0 0 "[ . 1 . 2]" 1
94 1 13 PHE HD1 1 27 VAL HB 5.680 . 6.250 4.448 2.733 5.709 . 0 0 "[ . 1 . 2]" 1
95 1 13 PHE HD1 1 27 VAL QG 4.300 . 4.730 2.401 2.070 3.308 . 0 0 "[ . 1 . 2]" 1
96 1 13 PHE HD2 1 14 LEU H 4.890 . 5.380 4.171 3.402 4.689 . 0 0 "[ . 1 . 2]" 1
97 1 13 PHE HD2 1 15 VAL QG 4.510 . 4.960 2.993 1.789 3.730 0.011 7 0 "[ . 1 . 2]" 1
98 1 13 PHE HD2 1 78 ILE H 6.100 . 6.710 5.739 3.195 6.725 0.015 6 0 "[ . 1 . 2]" 1
99 1 13 PHE HD2 1 78 ILE MD 6.200 . 6.820 2.251 1.759 3.260 0.041 12 0 "[ . 1 . 2]" 1
100 1 13 PHE HD2 1 78 ILE QG 5.160 . 5.680 4.018 2.757 5.262 . 0 0 "[ . 1 . 2]" 1
101 1 13 PHE HD2 1 78 ILE MG 5.910 . 6.500 3.019 2.191 4.309 . 0 0 "[ . 1 . 2]" 1
102 1 13 PHE HE1 1 15 VAL QG 4.830 . 5.310 3.998 3.280 4.875 . 0 0 "[ . 1 . 2]" 1
103 1 13 PHE HE1 1 25 LEU HB2 4.980 . 5.480 4.368 2.759 5.214 . 0 0 "[ . 1 . 2]" 1
104 1 13 PHE HE1 1 25 LEU HB3 4.360 . 4.800 2.769 1.789 3.554 0.011 2 0 "[ . 1 . 2]" 1
105 1 13 PHE HE1 1 25 LEU MD2 4.390 . 4.830 2.627 1.930 4.226 . 0 0 "[ . 1 . 2]" 1
106 1 13 PHE HE1 1 27 VAL HB 5.880 . 6.470 3.328 1.762 4.845 0.038 12 0 "[ . 1 . 2]" 1
107 1 13 PHE HE1 1 27 VAL QG 3.460 . 3.810 2.107 1.784 2.846 0.016 18 0 "[ . 1 . 2]" 1
108 1 13 PHE HE1 1 40 ILE MD 4.640 . 5.100 4.854 4.284 5.162 0.062 19 0 "[ . 1 . 2]" 1
109 1 14 LEU H 1 14 LEU HB2 3.890 . 4.280 2.617 2.486 2.790 . 0 0 "[ . 1 . 2]" 1
110 1 14 LEU H 1 14 LEU QB 3.340 . 3.670 2.267 2.241 2.315 . 0 0 "[ . 1 . 2]" 1
111 1 14 LEU H 1 14 LEU HB3 3.890 . 4.280 2.493 2.389 2.613 . 0 0 "[ . 1 . 2]" 1
112 1 14 LEU H 1 15 VAL H 5.170 . 5.690 4.308 4.225 4.430 . 0 0 "[ . 1 . 2]" 1
113 1 14 LEU H 1 78 ILE MD 6.200 . 6.820 4.292 2.938 6.251 . 0 0 "[ . 1 . 2]" 1
114 1 14 LEU HA 1 14 LEU MD1 3.700 . 4.070 2.131 1.975 3.467 . 0 0 "[ . 1 . 2]" 1
115 1 14 LEU HA 1 15 VAL H 3.220 . 3.540 2.147 2.114 2.183 . 0 0 "[ . 1 . 2]" 1
116 1 14 LEU HA 1 15 VAL QG 4.990 . 5.490 3.543 3.366 3.686 . 0 0 "[ . 1 . 2]" 1
117 1 14 LEU HA 1 23 PHE H 5.460 . 6.010 4.529 3.830 4.957 . 0 0 "[ . 1 . 2]" 1
118 1 14 LEU HA 1 24 GLU HA 4.050 . 4.460 2.419 1.893 2.973 . 0 0 "[ . 1 . 2]" 1
119 1 14 LEU HA 1 24 GLU QG 5.740 . 6.310 3.394 2.412 4.332 . 0 0 "[ . 1 . 2]" 1
120 1 14 LEU HA 1 25 LEU H 4.630 . 5.090 3.579 3.105 3.952 . 0 0 "[ . 1 . 2]" 1
121 1 14 LEU QB 1 24 GLU QG 5.790 . 6.370 3.567 2.079 4.642 . 0 0 "[ . 1 . 2]" 1
122 1 14 LEU HB2 1 15 VAL H 5.210 . 5.730 4.430 4.344 4.523 . 0 0 "[ . 1 . 2]" 1
123 1 14 LEU HB3 1 15 VAL H 5.210 . 5.730 4.364 4.179 4.424 . 0 0 "[ . 1 . 2]" 1
124 1 14 LEU MD1 1 15 VAL H 4.230 . 4.650 3.005 2.639 4.662 0.012 5 0 "[ . 1 . 2]" 1
125 1 14 LEU MD1 1 22 SER HB2 4.440 . 4.880 3.097 1.861 4.356 . 0 0 "[ . 1 . 2]" 1
126 1 14 LEU MD1 1 22 SER QB 3.850 . 4.230 2.383 1.785 3.540 0.015 11 0 "[ . 1 . 2]" 1
127 1 14 LEU MD1 1 22 SER HB3 4.440 . 4.880 2.683 1.826 3.746 . 0 0 "[ . 1 . 2]" 1
128 1 14 LEU MD1 1 23 PHE H 4.150 . 4.570 3.339 2.613 4.589 0.019 5 0 "[ . 1 . 2]" 1
129 1 14 LEU MD1 1 24 GLU H 5.590 . 6.150 3.561 3.063 4.427 . 0 0 "[ . 1 . 2]" 1
130 1 14 LEU MD1 1 24 GLU HA 4.520 . 4.970 3.099 2.729 4.133 . 0 0 "[ . 1 . 2]" 1
131 1 14 LEU MD1 1 24 GLU HB2 6.200 . 6.820 4.141 2.676 5.327 . 0 0 "[ . 1 . 2]" 1
132 1 14 LEU MD1 1 24 GLU HB3 6.200 . 6.820 4.302 2.652 4.947 . 0 0 "[ . 1 . 2]" 1
133 1 14 LEU MD1 1 24 GLU HG2 4.940 . 5.430 3.310 2.168 5.129 . 0 0 "[ . 1 . 2]" 1
134 1 14 LEU MD1 1 24 GLU QG 4.330 . 4.760 2.803 1.797 4.006 0.003 12 0 "[ . 1 . 2]" 1
135 1 14 LEU MD1 1 24 GLU HG3 4.940 . 5.430 3.159 1.841 4.181 . 0 0 "[ . 1 . 2]" 1
136 1 14 LEU MD2 1 15 VAL H 4.620 . 5.080 4.852 3.649 5.048 . 0 0 "[ . 1 . 2]" 1
137 1 14 LEU MD2 1 15 VAL HA 6.200 . 6.820 5.431 3.272 5.747 . 0 0 "[ . 1 . 2]" 1
138 1 14 LEU MD2 1 22 SER HA 6.200 . 6.820 4.968 3.881 5.886 . 0 0 "[ . 1 . 2]" 1
139 1 14 LEU MD2 1 22 SER QB 4.690 . 5.160 3.120 2.344 4.247 . 0 0 "[ . 1 . 2]" 1
140 1 14 LEU MD2 1 24 GLU HA 6.200 . 6.820 5.390 4.951 5.868 . 0 0 "[ . 1 . 2]" 1
141 1 14 LEU MD2 1 24 GLU QG 5.460 . 6.010 4.556 3.263 5.597 . 0 0 "[ . 1 . 2]" 1
142 1 14 LEU HG 1 15 VAL H 5.050 . 5.560 3.592 3.232 3.818 . 0 0 "[ . 1 . 2]" 1
143 1 14 LEU HG 1 15 VAL HA 5.270 . 5.800 4.391 4.106 4.625 . 0 0 "[ . 1 . 2]" 1
144 1 14 LEU HG 1 22 SER HB2 4.820 . 5.300 4.354 1.952 5.338 0.038 20 0 "[ . 1 . 2]" 1
145 1 14 LEU HG 1 22 SER QB 4.230 . 4.650 3.163 1.936 4.584 . 0 0 "[ . 1 . 2]" 1
146 1 14 LEU HG 1 22 SER HB3 4.820 . 5.300 3.450 2.244 5.140 . 0 0 "[ . 1 . 2]" 1
147 1 15 VAL H 1 15 VAL HB 3.750 . 4.130 2.929 2.548 3.675 . 0 0 "[ . 1 . 2]" 1
148 1 15 VAL H 1 15 VAL MG1 4.450 . 4.890 3.522 2.706 3.873 . 0 0 "[ . 1 . 2]" 1
149 1 15 VAL H 1 15 VAL QG 3.660 . 4.030 2.036 1.788 2.310 0.012 4 0 "[ . 1 . 2]" 1
150 1 15 VAL H 1 15 VAL MG2 4.450 . 4.890 2.051 1.805 2.330 . 0 0 "[ . 1 . 2]" 1
151 1 15 VAL H 1 16 GLU H 5.410 . 5.950 4.235 4.052 4.446 . 0 0 "[ . 1 . 2]" 1
152 1 15 VAL H 1 22 SER HA 5.200 . 5.720 4.780 4.374 5.137 . 0 0 "[ . 1 . 2]" 1
153 1 15 VAL H 1 23 PHE H 4.040 . 4.440 3.289 2.847 3.722 . 0 0 "[ . 1 . 2]" 1
154 1 15 VAL H 1 24 GLU H 5.920 . 6.510 4.797 4.353 5.228 . 0 0 "[ . 1 . 2]" 1
155 1 15 VAL H 1 24 GLU HA 4.850 . 5.330 3.228 2.762 3.807 . 0 0 "[ . 1 . 2]" 1
156 1 15 VAL H 1 25 LEU H 5.150 . 5.670 3.354 2.944 3.856 . 0 0 "[ . 1 . 2]" 1
157 1 15 VAL HA 1 16 GLU H 3.150 . 3.470 2.181 2.108 2.281 . 0 0 "[ . 1 . 2]" 1
158 1 15 VAL HA 1 16 GLU HA 5.560 . 6.120 4.404 4.346 4.452 . 0 0 "[ . 1 . 2]" 1
159 1 15 VAL HA 1 16 GLU HB2 5.780 . 6.360 4.644 4.399 4.861 . 0 0 "[ . 1 . 2]" 1
160 1 15 VAL HA 1 16 GLU HB3 5.780 . 6.360 4.712 4.559 4.910 . 0 0 "[ . 1 . 2]" 1
161 1 15 VAL HA 1 78 ILE HB 4.760 . 5.240 3.526 2.490 4.583 . 0 0 "[ . 1 . 2]" 1
162 1 15 VAL HA 1 78 ILE MG 5.280 . 5.810 3.220 2.473 4.216 . 0 0 "[ . 1 . 2]" 1
163 1 15 VAL HA 1 79 GLN HA 5.460 . 6.010 4.748 3.755 5.501 . 0 0 "[ . 1 . 2]" 1
164 1 15 VAL HB 1 16 GLU H 4.550 . 5.010 4.112 3.421 4.425 . 0 0 "[ . 1 . 2]" 1
165 1 15 VAL HB 1 23 PHE H 4.980 . 5.480 3.398 2.426 4.852 . 0 0 "[ . 1 . 2]" 1
166 1 15 VAL HB 1 80 LEU MD1 6.200 . 6.820 3.497 1.783 4.451 0.017 4 0 "[ . 1 . 2]" 1
167 1 15 VAL HB 1 80 LEU HG 6.200 . 6.820 4.306 1.902 5.456 . 0 0 "[ . 1 . 2]" 1
168 1 15 VAL QG 1 16 GLU H 3.880 . 4.270 3.298 2.757 3.638 . 0 0 "[ . 1 . 2]" 1
169 1 15 VAL QG 1 17 ASN H 5.670 . 6.240 4.009 3.236 4.772 . 0 0 "[ . 1 . 2]" 1
170 1 15 VAL QG 1 22 SER HA 4.450 . 4.890 4.178 3.372 4.523 . 0 0 "[ . 1 . 2]" 1
171 1 15 VAL QG 1 23 PHE H 4.680 . 5.150 3.321 2.288 3.939 . 0 0 "[ . 1 . 2]" 1
172 1 15 VAL QG 1 23 PHE HB3 5.780 . 6.360 3.239 2.185 4.535 . 0 0 "[ . 1 . 2]" 1
173 1 15 VAL QG 1 23 PHE HD2 6.110 . 6.720 3.342 2.595 4.725 . 0 0 "[ . 1 . 2]" 1
174 1 15 VAL QG 1 24 GLU HA 5.640 . 6.200 3.761 3.490 4.183 . 0 0 "[ . 1 . 2]" 1
175 1 15 VAL QG 1 25 LEU H 4.610 . 5.070 2.750 2.232 3.332 . 0 0 "[ . 1 . 2]" 1
176 1 15 VAL QG 1 25 LEU HB2 4.540 . 4.990 2.389 1.878 3.433 . 0 0 "[ . 1 . 2]" 1
177 1 15 VAL QG 1 25 LEU HB3 4.340 . 4.770 2.883 2.218 3.698 . 0 0 "[ . 1 . 2]" 1
178 1 15 VAL QG 1 25 LEU MD1 6.110 . 6.720 2.604 1.787 3.665 0.013 3 0 "[ . 1 . 2]" 1
179 1 15 VAL QG 1 40 ILE MD 4.120 . 4.530 2.623 1.981 3.296 . 0 0 "[ . 1 . 2]" 1
180 1 15 VAL QG 1 44 GLN QE 4.140 . 4.550 3.173 2.354 4.578 0.028 13 0 "[ . 1 . 2]" 1
181 1 15 VAL QG 1 78 ILE HB 4.070 . 4.480 3.911 2.800 4.542 0.062 8 0 "[ . 1 . 2]" 1
182 1 15 VAL QG 1 78 ILE MG 4.110 . 4.520 2.782 1.884 3.424 . 0 0 "[ . 1 . 2]" 1
183 1 15 VAL QG 1 79 GLN HA 4.970 . 5.470 4.599 3.758 5.373 . 0 0 "[ . 1 . 2]" 1
184 1 15 VAL QG 1 80 LEU H 4.450 . 4.890 4.344 3.665 4.948 0.058 4 0 "[ . 1 . 2]" 1
185 1 15 VAL QG 1 80 LEU QB 4.920 . 5.410 3.744 3.300 4.436 . 0 0 "[ . 1 . 2]" 1
186 1 15 VAL QG 1 80 LEU MD1 4.680 . 5.150 2.144 1.962 2.538 . 0 0 "[ . 1 . 2]" 1
187 1 15 VAL QG 1 80 LEU MD2 5.080 . 5.590 2.951 2.327 3.420 . 0 0 "[ . 1 . 2]" 1
188 1 15 VAL QG 1 80 LEU HG 5.090 . 5.600 2.593 1.924 3.322 . 0 0 "[ . 1 . 2]" 1
189 1 15 VAL MG1 1 16 GLU H 5.090 . 5.600 3.452 2.793 3.938 . 0 0 "[ . 1 . 2]" 1
190 1 15 VAL MG1 1 23 PHE H 5.360 . 5.900 4.326 3.603 5.399 . 0 0 "[ . 1 . 2]" 1
191 1 15 VAL MG1 1 40 ILE MD 4.770 . 5.250 2.781 2.010 3.517 . 0 0 "[ . 1 . 2]" 1
192 1 15 VAL MG1 1 78 ILE HB 5.080 . 5.590 4.318 2.817 5.236 . 0 0 "[ . 1 . 2]" 1
193 1 15 VAL MG1 1 80 LEU MD1 5.500 . 6.050 2.264 1.967 3.070 . 0 0 "[ . 1 . 2]" 1
194 1 15 VAL MG2 1 16 GLU H 5.090 . 5.600 4.282 4.171 4.381 . 0 0 "[ . 1 . 2]" 1
195 1 15 VAL MG2 1 23 PHE H 5.360 . 5.900 3.683 2.293 4.296 . 0 0 "[ . 1 . 2]" 1
196 1 15 VAL MG2 1 40 ILE MD 4.770 . 5.250 3.279 2.715 3.983 . 0 0 "[ . 1 . 2]" 1
197 1 15 VAL MG2 1 78 ILE HB 5.080 . 5.590 4.881 3.419 5.645 0.055 15 0 "[ . 1 . 2]" 1
198 1 15 VAL MG2 1 80 LEU MD1 5.500 . 6.050 3.497 2.305 4.072 . 0 0 "[ . 1 . 2]" 1
199 1 16 GLU H 1 16 GLU HB2 3.840 . 4.220 2.725 2.513 2.871 . 0 0 "[ . 1 . 2]" 1
200 1 16 GLU H 1 16 GLU HB3 3.840 . 4.220 2.550 2.448 2.762 . 0 0 "[ . 1 . 2]" 1
201 1 16 GLU H 1 16 GLU HG2 5.460 . 6.010 4.520 4.386 4.748 . 0 0 "[ . 1 . 2]" 1
202 1 16 GLU H 1 16 GLU QG 4.590 . 5.050 4.025 3.972 4.088 . 0 0 "[ . 1 . 2]" 1
203 1 16 GLU H 1 16 GLU HG3 5.460 . 6.010 4.522 4.447 4.627 . 0 0 "[ . 1 . 2]" 1
204 1 16 GLU H 1 17 ASN H 5.280 . 5.810 4.235 3.913 4.594 . 0 0 "[ . 1 . 2]" 1
205 1 16 GLU H 1 79 GLN HA 4.000 . 4.400 3.255 2.346 3.918 . 0 0 "[ . 1 . 2]" 1
206 1 16 GLU H 1 80 LEU H 5.140 . 5.650 4.186 3.352 4.977 . 0 0 "[ . 1 . 2]" 1
207 1 16 GLU HA 1 17 ASN H 3.210 . 3.530 2.187 2.110 2.287 . 0 0 "[ . 1 . 2]" 1
208 1 16 GLU HA 1 17 ASN QB 5.550 . 6.110 4.118 3.865 4.262 . 0 0 "[ . 1 . 2]" 1
209 1 16 GLU HA 1 22 SER HA 4.360 . 4.800 2.321 1.776 3.328 0.024 2 0 "[ . 1 . 2]" 1
210 1 16 GLU HA 1 22 SER HB2 4.890 . 5.380 3.967 2.329 4.940 . 0 0 "[ . 1 . 2]" 1
211 1 16 GLU HA 1 22 SER QB 4.260 . 4.690 2.935 2.173 3.467 . 0 0 "[ . 1 . 2]" 1
212 1 16 GLU HA 1 22 SER HB3 4.890 . 5.380 3.256 2.213 4.559 . 0 0 "[ . 1 . 2]" 1
213 1 16 GLU QB 1 22 SER HA 5.360 . 5.900 4.151 3.210 5.311 . 0 0 "[ . 1 . 2]" 1
214 1 16 GLU QB 1 79 GLN HA 4.920 . 5.410 2.779 2.000 3.831 . 0 0 "[ . 1 . 2]" 1
215 1 16 GLU QB 1 79 GLN QE 4.860 . 5.350 3.781 2.956 4.859 . 0 0 "[ . 1 . 2]" 1
216 1 16 GLU HB2 1 17 ASN H 5.300 . 5.830 4.416 4.053 4.595 . 0 0 "[ . 1 . 2]" 1
217 1 16 GLU HB3 1 17 ASN H 5.300 . 5.830 4.312 3.918 4.491 . 0 0 "[ . 1 . 2]" 1
218 1 16 GLU QG 1 17 ASN H 4.510 . 4.960 3.278 2.352 3.919 . 0 0 "[ . 1 . 2]" 1
219 1 16 GLU QG 1 17 ASN HA 6.000 . 6.600 4.254 3.640 4.560 . 0 0 "[ . 1 . 2]" 1
220 1 16 GLU QG 1 18 LEU HA 4.270 . 4.700 3.861 3.161 4.638 . 0 0 "[ . 1 . 2]" 1
221 1 16 GLU QG 1 18 LEU MD1 4.680 . 5.150 4.114 2.494 5.165 0.015 10 0 "[ . 1 . 2]" 1
222 1 16 GLU QG 1 22 SER HA 6.000 . 6.600 4.068 2.780 5.557 . 0 0 "[ . 1 . 2]" 1
223 1 16 GLU QG 1 79 GLN HA 6.000 . 6.600 4.114 3.565 4.915 . 0 0 "[ . 1 . 2]" 1
224 1 17 ASN H 1 17 ASN HB2 4.150 . 4.570 2.733 2.507 3.111 . 0 0 "[ . 1 . 2]" 1
225 1 17 ASN H 1 17 ASN QB 3.600 . 3.960 2.351 2.269 2.628 . 0 0 "[ . 1 . 2]" 1
226 1 17 ASN H 1 17 ASN HB3 4.150 . 4.570 2.579 2.412 2.834 . 0 0 "[ . 1 . 2]" 1
227 1 17 ASN H 1 17 ASN QD 5.380 . 5.920 4.600 4.473 4.975 . 0 0 "[ . 1 . 2]" 1
228 1 17 ASN H 1 18 LEU H 5.350 . 5.890 4.421 4.232 4.528 . 0 0 "[ . 1 . 2]" 1
229 1 17 ASN H 1 22 SER H 5.470 . 6.020 4.462 3.779 4.868 . 0 0 "[ . 1 . 2]" 1
230 1 17 ASN H 1 22 SER HA 4.440 . 4.880 2.904 2.369 3.503 . 0 0 "[ . 1 . 2]" 1
231 1 17 ASN H 1 22 SER QB 4.710 . 5.180 4.211 3.593 5.053 . 0 0 "[ . 1 . 2]" 1
232 1 17 ASN HA 1 18 LEU H 3.410 . 3.750 2.148 2.117 2.244 . 0 0 "[ . 1 . 2]" 1
233 1 17 ASN HA 1 18 LEU HA 5.610 . 6.170 4.341 4.292 4.397 . 0 0 "[ . 1 . 2]" 1
234 1 17 ASN HA 1 18 LEU QB 4.880 . 5.370 4.059 3.998 4.316 . 0 0 "[ . 1 . 2]" 1
235 1 17 ASN HA 1 18 LEU MD2 6.200 . 6.820 5.939 5.299 6.064 . 0 0 "[ . 1 . 2]" 1
236 1 17 ASN HA 1 80 LEU H 4.600 . 5.060 2.669 2.201 3.057 . 0 0 "[ . 1 . 2]" 1
237 1 17 ASN HA 1 80 LEU QB 4.060 . 4.470 2.021 1.717 2.755 0.083 15 0 "[ . 1 . 2]" 1
238 1 17 ASN HA 1 80 LEU MD1 6.100 . 6.710 3.433 2.303 4.248 . 0 0 "[ . 1 . 2]" 1
239 1 17 ASN HA 1 80 LEU HG 6.130 . 6.740 3.826 3.184 4.603 . 0 0 "[ . 1 . 2]" 1
240 1 17 ASN QB 1 18 LEU HA 6.000 . 6.600 4.943 4.730 5.081 . 0 0 "[ . 1 . 2]" 1
241 1 17 ASN QB 1 19 ASN H 5.290 . 5.820 3.797 3.392 4.215 . 0 0 "[ . 1 . 2]" 1
242 1 17 ASN QB 1 20 GLY H 4.570 . 5.030 3.224 2.366 4.349 . 0 0 "[ . 1 . 2]" 1
243 1 17 ASN QB 1 21 SER H 4.540 . 4.990 2.482 1.790 4.059 0.010 5 0 "[ . 1 . 2]" 1
244 1 17 ASN QB 1 22 SER HA 4.930 . 5.420 4.118 2.888 4.831 . 0 0 "[ . 1 . 2]" 1
245 1 17 ASN QB 1 44 GLN QE 4.590 . 5.050 3.329 2.875 4.898 . 0 0 "[ . 1 . 2]" 1
246 1 17 ASN QB 1 80 LEU H 5.120 . 5.630 4.425 3.959 4.899 . 0 0 "[ . 1 . 2]" 1
247 1 17 ASN QB 1 80 LEU HG 5.420 . 5.960 4.180 3.533 4.676 . 0 0 "[ . 1 . 2]" 1
248 1 17 ASN HB2 1 20 GLY HA2 6.200 . 6.820 5.748 5.131 6.476 . 0 0 "[ . 1 . 2]" 1
249 1 17 ASN HB2 1 20 GLY HA3 6.200 . 6.820 4.063 3.395 4.857 . 0 0 "[ . 1 . 2]" 1
250 1 17 ASN HB2 1 21 SER H 5.360 . 5.900 3.716 2.907 5.452 . 0 0 "[ . 1 . 2]" 1
251 1 17 ASN HB2 1 22 SER HA 5.650 . 6.210 4.745 3.021 5.738 . 0 0 "[ . 1 . 2]" 1
252 1 17 ASN HB2 1 80 LEU HB2 6.200 . 6.820 3.054 2.224 3.702 . 0 0 "[ . 1 . 2]" 1
253 1 17 ASN HB2 1 80 LEU HB3 6.200 . 6.820 4.258 3.306 5.252 . 0 0 "[ . 1 . 2]" 1
254 1 17 ASN HB2 1 80 LEU MD1 6.100 . 6.710 2.603 1.775 3.497 0.025 19 0 "[ . 1 . 2]" 1
255 1 17 ASN HB3 1 20 GLY HA2 6.200 . 6.820 4.350 3.655 5.253 . 0 0 "[ . 1 . 2]" 1
256 1 17 ASN HB3 1 20 GLY HA3 6.200 . 6.820 2.832 2.039 4.042 . 0 0 "[ . 1 . 2]" 1
257 1 17 ASN HB3 1 21 SER H 5.360 . 5.900 2.535 1.801 4.188 . 0 0 "[ . 1 . 2]" 1
258 1 17 ASN HB3 1 22 SER HA 5.650 . 6.210 4.562 3.672 5.319 . 0 0 "[ . 1 . 2]" 1
259 1 17 ASN HB3 1 80 LEU HB2 6.200 . 6.820 4.306 3.706 4.756 . 0 0 "[ . 1 . 2]" 1
260 1 17 ASN HB3 1 80 LEU HB3 6.200 . 6.820 5.581 4.806 6.260 . 0 0 "[ . 1 . 2]" 1
261 1 17 ASN HB3 1 80 LEU MD1 6.100 . 6.710 4.140 3.389 4.946 . 0 0 "[ . 1 . 2]" 1
262 1 17 ASN QD 1 20 GLY QA 4.720 . 5.190 2.520 1.854 3.733 . 0 0 "[ . 1 . 2]" 1
263 1 17 ASN QD 1 21 SER H 4.890 . 5.380 3.219 2.198 4.211 . 0 0 "[ . 1 . 2]" 1
264 1 17 ASN QD 1 44 GLN HA 5.990 . 6.590 4.066 3.368 6.626 0.036 10 0 "[ . 1 . 2]" 1
265 1 17 ASN QD 1 44 GLN QB 4.890 . 5.380 2.525 1.770 4.084 0.030 5 0 "[ . 1 . 2]" 1
266 1 17 ASN QD 1 44 GLN QE 4.950 . 5.440 3.869 3.478 4.722 . 0 0 "[ . 1 . 2]" 1
267 1 17 ASN QD 1 46 ILE MD 4.090 . 4.500 2.500 1.797 3.329 0.003 8 0 "[ . 1 . 2]" 1
268 1 17 ASN QD 1 80 LEU MD1 3.890 . 4.280 3.442 2.743 4.036 . 0 0 "[ . 1 . 2]" 1
269 1 17 ASN HD21 1 20 GLY HA2 6.200 . 6.820 4.393 3.596 5.781 . 0 0 "[ . 1 . 2]" 1
270 1 17 ASN HD21 1 20 GLY HA3 6.200 . 6.820 2.727 1.893 4.086 . 0 0 "[ . 1 . 2]" 1
271 1 17 ASN HD21 1 21 SER H 5.650 . 6.210 3.299 2.248 4.370 . 0 0 "[ . 1 . 2]" 1
272 1 17 ASN HD21 1 44 GLN HB2 6.200 . 6.820 4.196 3.228 5.614 . 0 0 "[ . 1 . 2]" 1
273 1 17 ASN HD21 1 44 GLN HB3 6.200 . 6.820 2.729 1.800 4.566 0.000 5 0 "[ . 1 . 2]" 1
274 1 17 ASN HD21 1 46 ILE MD 4.750 . 5.220 3.306 2.351 4.292 . 0 0 "[ . 1 . 2]" 1
275 1 17 ASN HD21 1 80 LEU MD1 4.560 . 5.020 3.669 2.841 4.373 . 0 0 "[ . 1 . 2]" 1
276 1 17 ASN HD22 1 20 GLY HA2 6.200 . 6.820 4.533 3.958 6.094 . 0 0 "[ . 1 . 2]" 1
277 1 17 ASN HD22 1 20 GLY HA3 6.200 . 6.820 3.190 2.481 4.580 . 0 0 "[ . 1 . 2]" 1
278 1 17 ASN HD22 1 21 SER H 5.650 . 6.210 4.549 3.101 5.511 . 0 0 "[ . 1 . 2]" 1
279 1 17 ASN HD22 1 44 GLN HB2 6.200 . 6.820 4.753 4.177 6.204 . 0 0 "[ . 1 . 2]" 1
280 1 17 ASN HD22 1 44 GLN HB3 6.200 . 6.820 3.325 2.699 5.819 . 0 0 "[ . 1 . 2]" 1
281 1 17 ASN HD22 1 46 ILE MD 4.750 . 5.220 2.614 1.818 3.487 . 0 0 "[ . 1 . 2]" 1
282 1 17 ASN HD22 1 80 LEU MD1 4.560 . 5.020 4.210 3.598 4.737 . 0 0 "[ . 1 . 2]" 1
283 1 18 LEU H 1 18 LEU HB2 3.750 . 4.130 2.423 2.167 2.528 . 0 0 "[ . 1 . 2]" 1
284 1 18 LEU H 1 18 LEU QB 3.230 . 3.550 2.224 2.145 2.333 . 0 0 "[ . 1 . 2]" 1
285 1 18 LEU H 1 18 LEU HB3 3.750 . 4.130 2.666 2.461 3.573 . 0 0 "[ . 1 . 2]" 1
286 1 18 LEU H 1 18 LEU MD1 5.100 . 5.610 3.841 1.927 4.111 . 0 0 "[ . 1 . 2]" 1
287 1 18 LEU H 1 18 LEU MD2 4.950 . 5.440 4.211 3.867 4.280 . 0 0 "[ . 1 . 2]" 1
288 1 18 LEU H 1 19 ASN H 3.810 . 4.190 2.607 2.416 2.917 . 0 0 "[ . 1 . 2]" 1
289 1 18 LEU H 1 20 GLY H 5.240 . 5.760 4.489 3.701 5.740 . 0 0 "[ . 1 . 2]" 1
290 1 18 LEU H 1 80 LEU H 4.710 . 5.180 3.482 2.802 4.426 . 0 0 "[ . 1 . 2]" 1
291 1 18 LEU H 1 81 GLU HA 5.150 . 5.670 4.024 3.267 4.671 . 0 0 "[ . 1 . 2]" 1
292 1 18 LEU HA 1 18 LEU MD1 3.500 . 3.850 2.073 1.935 2.871 . 0 0 "[ . 1 . 2]" 1
293 1 18 LEU HA 1 19 ASN HA 5.890 . 6.480 4.541 4.488 4.620 . 0 0 "[ . 1 . 2]" 1
294 1 18 LEU HA 1 20 GLY H 5.460 . 6.010 4.318 3.611 5.789 . 0 0 "[ . 1 . 2]" 1
295 1 18 LEU QB 1 19 ASN HA 5.260 . 5.790 4.379 4.142 4.657 . 0 0 "[ . 1 . 2]" 1
296 1 18 LEU QB 1 79 GLN QE 5.780 . 6.360 4.303 2.447 6.403 0.043 16 0 "[ . 1 . 2]" 1
297 1 18 LEU HB2 1 19 ASN H 4.620 . 5.080 3.881 3.124 4.143 . 0 0 "[ . 1 . 2]" 1
298 1 18 LEU HB2 1 81 GLU HA 6.200 . 6.820 3.758 2.414 4.738 . 0 0 "[ . 1 . 2]" 1
299 1 18 LEU HB3 1 19 ASN H 4.620 . 5.080 2.940 2.215 3.874 . 0 0 "[ . 1 . 2]" 1
300 1 18 LEU HB3 1 81 GLU HA 6.200 . 6.820 3.603 2.352 5.864 . 0 0 "[ . 1 . 2]" 1
301 1 18 LEU MD1 1 19 ASN H 5.840 . 6.420 4.576 4.027 4.780 . 0 0 "[ . 1 . 2]" 1
302 1 18 LEU MD1 1 79 GLN HE21 4.520 . 4.970 3.904 2.574 5.037 0.067 4 0 "[ . 1 . 2]" 1
303 1 18 LEU MD1 1 79 GLN QE 3.850 . 4.230 3.260 1.947 4.273 0.043 3 0 "[ . 1 . 2]" 1
304 1 18 LEU MD1 1 79 GLN HE22 4.520 . 4.970 3.599 1.990 4.917 . 0 0 "[ . 1 . 2]" 1
305 1 18 LEU MD1 1 79 GLN HG2 6.200 . 6.820 4.632 3.571 5.820 . 0 0 "[ . 1 . 2]" 1
306 1 18 LEU MD1 1 79 GLN HG3 6.200 . 6.820 4.850 2.915 6.199 . 0 0 "[ . 1 . 2]" 1
307 1 18 LEU MD2 1 19 ASN H 5.310 . 5.840 4.629 3.873 5.207 . 0 0 "[ . 1 . 2]" 1
308 1 18 LEU HG 1 19 ASN HA 6.030 . 6.630 4.464 3.741 6.507 . 0 0 "[ . 1 . 2]" 1
309 1 19 ASN H 1 19 ASN HB2 4.010 . 4.410 2.785 2.423 3.395 . 0 0 "[ . 1 . 2]" 1
310 1 19 ASN H 1 19 ASN HB3 4.010 . 4.410 3.220 2.436 3.799 . 0 0 "[ . 1 . 2]" 1
311 1 19 ASN H 1 20 GLY H 3.650 . 4.020 2.771 2.019 3.753 . 0 0 "[ . 1 . 2]" 1
312 1 19 ASN H 1 20 GLY QA 5.540 . 6.090 4.070 3.838 4.297 . 0 0 "[ . 1 . 2]" 1
313 1 19 ASN HA 1 19 ASN HD21 4.220 . 4.640 3.086 1.789 4.448 0.011 5 0 "[ . 1 . 2]" 1
314 1 19 ASN HA 1 19 ASN QD 3.630 . 3.990 2.960 1.783 4.054 0.064 15 0 "[ . 1 . 2]" 1
315 1 19 ASN HA 1 19 ASN HD22 4.220 . 4.640 3.961 3.444 4.673 0.033 15 0 "[ . 1 . 2]" 1
316 1 19 ASN QB 1 82 VAL H 4.920 . 5.410 4.105 3.210 4.966 . 0 0 "[ . 1 . 2]" 1
317 1 19 ASN QB 1 82 VAL HB 4.380 . 4.820 3.149 1.823 4.208 . 0 0 "[ . 1 . 2]" 1
318 1 19 ASN QB 1 82 VAL QG 4.510 . 4.960 2.201 1.762 3.110 0.038 17 0 "[ . 1 . 2]" 1
319 1 19 ASN HB2 1 82 VAL HB 5.070 . 5.580 3.651 1.936 5.596 0.016 13 0 "[ . 1 . 2]" 1
320 1 19 ASN HB2 1 82 VAL MG1 6.760 . 7.440 3.149 1.776 5.151 0.024 17 0 "[ . 1 . 2]" 1
321 1 19 ASN HB2 1 82 VAL MG2 6.760 . 7.440 3.457 1.875 5.907 . 0 0 "[ . 1 . 2]" 1
322 1 19 ASN HB3 1 82 VAL HB 5.070 . 5.580 3.874 1.842 5.401 . 0 0 "[ . 1 . 2]" 1
323 1 19 ASN HB3 1 82 VAL MG1 6.760 . 7.440 3.466 1.808 5.809 . 0 0 "[ . 1 . 2]" 1
324 1 19 ASN HB3 1 82 VAL MG2 6.760 . 7.440 3.683 2.176 5.301 . 0 0 "[ . 1 . 2]" 1
325 1 19 ASN QD 1 82 VAL QG 5.120 . 5.630 3.481 2.001 4.537 . 0 0 "[ . 1 . 2]" 1
326 1 20 GLY H 1 21 SER H 4.170 . 4.590 3.788 3.310 4.377 . 0 0 "[ . 1 . 2]" 1
327 1 21 SER H 1 21 SER QB 3.700 . 4.070 2.756 2.507 3.221 . 0 0 "[ . 1 . 2]" 1
328 1 21 SER H 1 22 SER H 5.000 . 5.500 4.377 4.260 4.554 . 0 0 "[ . 1 . 2]" 1
329 1 21 SER QB 1 22 SER H 3.870 . 4.260 3.214 2.543 3.698 . 0 0 "[ . 1 . 2]" 1
330 1 21 SER HB2 1 22 SER H 4.430 . 4.870 3.756 2.584 4.196 . 0 0 "[ . 1 . 2]" 1
331 1 21 SER HB3 1 22 SER H 4.430 . 4.870 3.656 2.780 4.152 . 0 0 "[ . 1 . 2]" 1
332 1 22 SER H 1 22 SER QB 3.700 . 4.070 2.554 2.252 2.908 . 0 0 "[ . 1 . 2]" 1
333 1 22 SER HA 1 23 PHE H 3.330 . 3.660 2.186 2.120 2.304 . 0 0 "[ . 1 . 2]" 1
334 1 22 SER HA 1 44 GLN HE21 5.640 . 6.200 5.097 3.659 6.241 0.041 13 0 "[ . 1 . 2]" 1
335 1 22 SER HA 1 44 GLN QE 4.850 . 5.330 3.982 3.013 5.126 . 0 0 "[ . 1 . 2]" 1
336 1 22 SER HA 1 44 GLN HE22 5.640 . 6.200 4.170 3.197 5.455 . 0 0 "[ . 1 . 2]" 1
337 1 22 SER HB2 1 23 PHE H 4.020 . 4.420 4.096 2.947 4.462 0.042 5 0 "[ . 1 . 2]" 1
338 1 22 SER HB3 1 23 PHE H 4.020 . 4.420 3.724 2.866 4.348 . 0 0 "[ . 1 . 2]" 1
339 1 23 PHE H 1 24 GLU H 5.420 . 5.960 4.357 4.165 4.474 . 0 0 "[ . 1 . 2]" 1
340 1 23 PHE HA 1 23 PHE HE1 4.740 . 5.210 4.796 4.707 4.970 . 0 0 "[ . 1 . 2]" 1
341 1 23 PHE HA 1 24 GLU H 3.420 . 3.760 2.182 2.130 2.257 . 0 0 "[ . 1 . 2]" 1
342 1 23 PHE HB2 1 23 PHE HD1 3.210 . 3.530 2.574 2.476 2.668 . 0 0 "[ . 1 . 2]" 1
343 1 23 PHE HB2 1 23 PHE HE1 5.310 . 5.840 4.744 4.697 4.794 . 0 0 "[ . 1 . 2]" 1
344 1 23 PHE HB2 1 24 GLU H 4.930 . 5.420 4.169 4.031 4.265 . 0 0 "[ . 1 . 2]" 1
345 1 23 PHE HB2 1 44 GLN HE21 5.720 . 6.290 3.289 2.171 4.818 . 0 0 "[ . 1 . 2]" 1
346 1 23 PHE HB2 1 44 GLN QE 4.970 . 5.470 2.782 2.059 4.062 . 0 0 "[ . 1 . 2]" 1
347 1 23 PHE HB2 1 44 GLN HE22 5.720 . 6.290 3.091 2.269 4.375 . 0 0 "[ . 1 . 2]" 1
348 1 23 PHE HB3 1 23 PHE HD2 3.480 . 3.830 2.317 2.281 2.368 . 0 0 "[ . 1 . 2]" 1
349 1 23 PHE HB3 1 23 PHE HE2 4.610 . 5.070 4.612 4.591 4.639 . 0 0 "[ . 1 . 2]" 1
350 1 23 PHE HB3 1 24 GLU H 4.060 . 4.470 4.131 3.942 4.304 . 0 0 "[ . 1 . 2]" 1
351 1 23 PHE HB3 1 44 GLN HE21 5.330 . 5.860 2.795 2.111 4.565 . 0 0 "[ . 1 . 2]" 1
352 1 23 PHE HB3 1 44 GLN QE 4.490 . 4.940 2.612 1.747 4.268 0.053 3 0 "[ . 1 . 2]" 1
353 1 23 PHE HB3 1 44 GLN HE22 5.330 . 5.860 3.291 1.774 5.130 0.026 3 0 "[ . 1 . 2]" 1
354 1 23 PHE HD2 1 25 LEU MD1 4.510 . 4.960 3.063 2.494 3.845 . 0 0 "[ . 1 . 2]" 1
355 1 23 PHE HD2 1 25 LEU HG 5.630 . 6.190 3.374 2.326 5.037 . 0 0 "[ . 1 . 2]" 1
356 1 23 PHE HE1 1 24 GLU H 4.520 . 4.970 4.611 4.252 4.844 . 0 0 "[ . 1 . 2]" 1
357 1 23 PHE HE2 1 25 LEU HA 6.200 . 6.820 2.610 2.219 3.549 . 0 0 "[ . 1 . 2]" 1
358 1 23 PHE HE2 1 25 LEU HB2 5.650 . 6.210 3.596 2.492 5.753 . 0 0 "[ . 1 . 2]" 1
359 1 23 PHE HE2 1 25 LEU HB3 5.800 . 6.380 4.670 3.989 5.402 . 0 0 "[ . 1 . 2]" 1
360 1 23 PHE HE2 1 25 LEU MD1 5.100 . 5.610 3.462 1.770 4.734 0.030 11 0 "[ . 1 . 2]" 1
361 1 23 PHE HE2 1 25 LEU HG 3.410 . 3.750 2.638 1.780 3.859 0.109 11 0 "[ . 1 . 2]" 1
362 1 24 GLU H 1 24 GLU QB 3.470 . 3.820 2.449 2.257 3.086 . 0 0 "[ . 1 . 2]" 1
363 1 24 GLU H 1 24 GLU QG 4.110 . 4.520 2.749 1.757 3.995 0.043 16 0 "[ . 1 . 2]" 1
364 1 24 GLU HA 1 25 LEU H 3.250 . 3.580 2.191 2.144 2.264 . 0 0 "[ . 1 . 2]" 1
365 1 24 GLU QB 1 25 LEU H 4.150 . 4.570 3.694 3.528 3.978 . 0 0 "[ . 1 . 2]" 1
366 1 24 GLU QB 1 25 LEU HA 5.990 . 6.590 4.454 4.197 4.738 . 0 0 "[ . 1 . 2]" 1
367 1 24 GLU QG 1 25 LEU H 5.120 . 5.630 4.138 2.930 4.921 . 0 0 "[ . 1 . 2]" 1
368 1 25 LEU H 1 25 LEU HB3 4.040 . 4.440 2.785 2.536 3.609 . 0 0 "[ . 1 . 2]" 1
369 1 25 LEU H 1 25 LEU HG 5.060 . 5.570 4.375 3.080 4.583 . 0 0 "[ . 1 . 2]" 1
370 1 25 LEU H 1 26 GLU H 5.200 . 5.720 4.451 4.263 4.558 . 0 0 "[ . 1 . 2]" 1
371 1 25 LEU HA 1 25 LEU MD1 4.320 . 4.750 3.609 2.189 3.830 . 0 0 "[ . 1 . 2]" 1
372 1 25 LEU HA 1 25 LEU MD2 4.480 . 4.930 2.872 1.954 3.907 . 0 0 "[ . 1 . 2]" 1
373 1 25 LEU HA 1 26 GLU H 3.310 . 3.640 2.168 2.109 2.375 . 0 0 "[ . 1 . 2]" 1
374 1 25 LEU HA 1 26 GLU QB 5.990 . 6.590 4.042 3.946 4.149 . 0 0 "[ . 1 . 2]" 1
375 1 25 LEU HB2 1 26 GLU H 5.100 . 5.610 4.331 3.842 4.571 . 0 0 "[ . 1 . 2]" 1
376 1 25 LEU HB2 1 27 VAL QG 5.860 . 6.450 4.928 4.101 5.916 . 0 0 "[ . 1 . 2]" 1
377 1 25 LEU HB3 1 26 GLU H 5.960 . 6.560 3.909 2.543 4.164 . 0 0 "[ . 1 . 2]" 1
378 1 25 LEU HB3 1 27 VAL QG 4.360 . 4.800 3.662 2.704 4.687 . 0 0 "[ . 1 . 2]" 1
379 1 25 LEU MD1 1 39 LYS HB2 5.460 . 6.010 2.898 1.790 4.501 0.010 1 0 "[ . 1 . 2]" 1
380 1 25 LEU MD1 1 39 LYS HB3 4.330 . 4.760 2.837 1.914 4.464 . 0 0 "[ . 1 . 2]" 1
381 1 25 LEU MD1 1 40 ILE H 5.350 . 5.890 3.474 2.904 4.133 . 0 0 "[ . 1 . 2]" 1
382 1 25 LEU MD1 1 40 ILE QG 4.650 . 5.120 2.078 1.774 3.463 0.026 17 0 "[ . 1 . 2]" 1
383 1 25 LEU MD2 1 26 GLU H 3.860 . 4.250 2.541 1.896 4.264 0.014 11 0 "[ . 1 . 2]" 1
384 1 25 LEU MD2 1 39 LYS HB2 5.890 . 6.480 3.237 2.494 4.119 . 0 0 "[ . 1 . 2]" 1
385 1 25 LEU MD2 1 39 LYS HB3 4.530 . 4.980 2.989 2.363 4.096 . 0 0 "[ . 1 . 2]" 1
386 1 25 LEU MD2 1 39 LYS QD 3.840 . 4.220 2.672 1.881 4.271 0.051 3 0 "[ . 1 . 2]" 1
387 1 25 LEU HG 1 26 GLU H 5.150 . 5.670 3.374 2.371 4.691 . 0 0 "[ . 1 . 2]" 1
388 1 25 LEU HG 1 40 ILE QG 4.890 . 5.380 4.492 4.045 5.242 . 0 0 "[ . 1 . 2]" 1
389 1 26 GLU H 1 26 GLU QB 3.650 . 4.020 2.312 2.245 2.461 . 0 0 "[ . 1 . 2]" 1
390 1 26 GLU H 1 26 GLU QG 4.360 . 4.800 3.993 3.942 4.049 . 0 0 "[ . 1 . 2]" 1
391 1 26 GLU HA 1 27 VAL H 3.250 . 3.580 2.141 2.101 2.208 . 0 0 "[ . 1 . 2]" 1
392 1 26 GLU HA 1 27 VAL QG 5.140 . 5.650 3.594 3.346 3.938 . 0 0 "[ . 1 . 2]" 1
393 1 26 GLU QG 1 27 VAL H 4.130 . 4.540 3.121 2.762 3.597 . 0 0 "[ . 1 . 2]" 1
394 1 26 GLU QG 1 27 VAL QG 4.710 . 5.180 4.175 3.878 4.601 . 0 0 "[ . 1 . 2]" 1
395 1 26 GLU HG2 1 27 VAL H 4.690 . 5.160 3.520 3.035 5.083 . 0 0 "[ . 1 . 2]" 1
396 1 26 GLU HG3 1 27 VAL H 4.690 . 5.160 3.551 3.070 4.084 . 0 0 "[ . 1 . 2]" 1
397 1 27 VAL H 1 27 VAL QG 3.820 . 4.200 2.150 1.924 2.656 . 0 0 "[ . 1 . 2]" 1
398 1 27 VAL H 1 28 ASP H 4.910 . 5.400 4.456 4.395 4.526 . 0 0 "[ . 1 . 2]" 1
399 1 27 VAL HA 1 28 ASP H 3.400 . 3.740 2.343 2.136 2.598 . 0 0 "[ . 1 . 2]" 1
400 1 27 VAL HA 1 28 ASP HA 6.080 . 6.690 4.403 4.350 4.488 . 0 0 "[ . 1 . 2]" 1
401 1 27 VAL HA 1 28 ASP HB2 5.850 . 6.430 4.345 4.151 4.513 . 0 0 "[ . 1 . 2]" 1
402 1 27 VAL HA 1 28 ASP HB3 5.850 . 6.430 4.802 4.609 4.994 . 0 0 "[ . 1 . 2]" 1
403 1 27 VAL HA 1 35 VAL MG1 6.200 . 6.820 6.346 5.510 6.854 0.034 9 0 "[ . 1 . 2]" 1
404 1 27 VAL HA 1 36 VAL MG1 6.200 . 6.820 6.487 5.655 6.861 0.041 2 0 "[ . 1 . 2]" 1
405 1 27 VAL HB 1 28 ASP H 4.170 . 4.590 3.153 1.943 4.086 . 0 0 "[ . 1 . 2]" 1
406 1 27 VAL HB 1 36 VAL MG1 5.870 . 6.460 5.190 4.661 5.883 . 0 0 "[ . 1 . 2]" 1
407 1 27 VAL HB 1 36 VAL MG2 5.180 . 5.700 3.546 2.620 4.459 . 0 0 "[ . 1 . 2]" 1
408 1 27 VAL QG 1 28 ASP H 4.230 . 4.650 2.641 1.782 3.406 0.018 12 0 "[ . 1 . 2]" 1
409 1 27 VAL QG 1 28 ASP HA 5.340 . 5.870 3.691 3.281 4.147 . 0 0 "[ . 1 . 2]" 1
410 1 27 VAL QG 1 36 VAL HB 4.470 . 4.920 2.832 2.409 3.740 . 0 0 "[ . 1 . 2]" 1
411 1 28 ASP H 1 28 ASP HB2 4.130 . 4.540 2.773 2.615 3.123 . 0 0 "[ . 1 . 2]" 1
412 1 28 ASP H 1 28 ASP QB 3.630 . 3.990 2.401 2.292 2.596 . 0 0 "[ . 1 . 2]" 1
413 1 28 ASP H 1 28 ASP HB3 4.130 . 4.540 2.637 2.480 2.774 . 0 0 "[ . 1 . 2]" 1
414 1 28 ASP H 1 31 ASP H 5.330 . 5.860 3.775 3.498 4.200 . 0 0 "[ . 1 . 2]" 1
415 1 28 ASP H 1 31 ASP HB2 5.310 . 5.840 2.747 2.096 3.235 . 0 0 "[ . 1 . 2]" 1
416 1 28 ASP H 1 31 ASP QB 4.480 . 4.930 2.685 2.035 3.181 . 0 0 "[ . 1 . 2]" 1
417 1 28 ASP H 1 31 ASP HB3 5.310 . 5.840 3.881 2.754 4.693 . 0 0 "[ . 1 . 2]" 1
418 1 28 ASP HA 1 29 TYR QB 6.000 . 6.600 4.463 4.252 4.649 . 0 0 "[ . 1 . 2]" 1
419 1 28 ASP HA 1 67 VAL QG 6.110 . 6.720 4.472 3.878 4.872 . 0 0 "[ . 1 . 2]" 1
420 1 28 ASP QB 1 30 ARG H 4.530 . 4.980 2.873 2.530 3.229 . 0 0 "[ . 1 . 2]" 1
421 1 28 ASP QB 1 31 ASP QB 4.860 . 5.350 3.155 1.888 3.749 . 0 0 "[ . 1 . 2]" 1
422 1 28 ASP HB2 1 29 TYR H 5.190 . 5.710 4.066 3.895 4.283 . 0 0 "[ . 1 . 2]" 1
423 1 28 ASP HB2 1 30 ARG H 5.150 . 5.670 4.205 4.010 4.426 . 0 0 "[ . 1 . 2]" 1
424 1 28 ASP HB2 1 31 ASP H 4.500 . 4.950 4.492 3.974 4.904 . 0 0 "[ . 1 . 2]" 1
425 1 28 ASP HB3 1 29 TYR H 5.190 . 5.710 3.704 3.211 3.936 . 0 0 "[ . 1 . 2]" 1
426 1 28 ASP HB3 1 30 ARG H 5.150 . 5.670 2.927 2.555 3.319 . 0 0 "[ . 1 . 2]" 1
427 1 28 ASP HB3 1 31 ASP H 4.500 . 4.950 2.828 2.277 3.299 . 0 0 "[ . 1 . 2]" 1
428 1 29 TYR H 1 29 TYR HB2 4.080 . 4.490 2.325 2.195 2.429 . 0 0 "[ . 1 . 2]" 1
429 1 29 TYR H 1 29 TYR QB 3.580 . 3.940 2.296 2.174 2.392 . 0 0 "[ . 1 . 2]" 1
430 1 29 TYR H 1 29 TYR HB3 4.080 . 4.490 3.562 3.499 3.606 . 0 0 "[ . 1 . 2]" 1
431 1 29 TYR H 1 29 TYR QD 3.220 . 3.540 2.363 1.885 2.958 . 0 0 "[ . 1 . 2]" 1
432 1 29 TYR H 1 29 TYR QE 5.580 . 6.140 4.492 4.186 4.911 . 0 0 "[ . 1 . 2]" 1
433 1 29 TYR H 1 30 ARG QB 5.000 . 5.500 4.334 4.045 4.662 . 0 0 "[ . 1 . 2]" 1
434 1 29 TYR H 1 67 VAL QG 5.120 . 5.630 4.184 3.749 4.631 . 0 0 "[ . 1 . 2]" 1
435 1 29 TYR HA 1 29 TYR QD 4.010 . 4.410 2.942 2.611 3.167 . 0 0 "[ . 1 . 2]" 1
436 1 29 TYR HA 1 31 ASP H 5.890 . 6.480 3.739 3.437 4.040 . 0 0 "[ . 1 . 2]" 1
437 1 29 TYR HA 1 67 VAL H 5.190 . 5.710 4.329 3.854 4.804 . 0 0 "[ . 1 . 2]" 1
438 1 29 TYR HA 1 67 VAL HB 4.010 . 4.410 2.529 1.752 4.459 0.049 6 0 "[ . 1 . 2]" 1
439 1 29 TYR HA 1 67 VAL MG1 4.600 . 5.060 3.045 2.305 4.572 . 0 0 "[ . 1 . 2]" 1
440 1 29 TYR HA 1 67 VAL QG 3.750 . 4.130 2.465 1.922 3.063 . 0 0 "[ . 1 . 2]" 1
441 1 29 TYR HA 1 67 VAL MG2 4.600 . 5.060 3.212 1.924 3.892 . 0 0 "[ . 1 . 2]" 1
442 1 29 TYR HA 1 68 GLU H 4.500 . 4.950 3.283 3.021 3.826 . 0 0 "[ . 1 . 2]" 1
443 1 29 TYR QB 1 30 ARG QB 5.030 . 5.530 4.024 3.570 4.637 . 0 0 "[ . 1 . 2]" 1
444 1 29 TYR QB 1 67 VAL QG 5.230 . 5.750 3.818 3.425 4.368 . 0 0 "[ . 1 . 2]" 1
445 1 29 TYR QB 1 68 GLU H 5.120 . 5.630 3.593 3.132 4.237 . 0 0 "[ . 1 . 2]" 1
446 1 29 TYR QB 1 68 GLU HB3 5.200 . 5.720 3.462 3.157 3.912 . 0 0 "[ . 1 . 2]" 1
447 1 29 TYR HB2 1 30 ARG H 5.370 . 5.910 3.128 2.866 3.434 . 0 0 "[ . 1 . 2]" 1
448 1 29 TYR HB2 1 68 GLU HB2 5.090 . 5.600 3.552 3.310 3.918 . 0 0 "[ . 1 . 2]" 1
449 1 29 TYR HB3 1 30 ARG H 5.370 . 5.910 3.825 3.490 4.026 . 0 0 "[ . 1 . 2]" 1
450 1 29 TYR HB3 1 68 GLU HB2 5.090 . 5.600 1.887 1.735 2.282 0.065 2 0 "[ . 1 . 2]" 1
451 1 29 TYR QD 1 30 ARG H 4.970 . 5.470 4.461 4.090 4.784 . 0 0 "[ . 1 . 2]" 1
452 1 29 TYR QD 1 67 VAL QG 3.530 . 3.880 3.172 2.197 3.770 . 0 0 "[ . 1 . 2]" 1
453 1 29 TYR QD 1 68 GLU H 5.310 . 5.840 3.746 2.974 4.846 . 0 0 "[ . 1 . 2]" 1
454 1 29 TYR QD 1 68 GLU HA 3.870 . 4.260 2.118 1.736 3.376 0.064 11 0 "[ . 1 . 2]" 1
455 1 29 TYR QD 1 68 GLU HB2 3.620 . 3.980 2.653 1.936 3.631 . 0 0 "[ . 1 . 2]" 1
456 1 29 TYR QD 1 68 GLU HB3 5.680 . 6.250 4.041 3.530 5.189 . 0 0 "[ . 1 . 2]" 1
457 1 29 TYR QD 1 68 GLU HG3 3.470 . 3.820 2.816 2.039 3.665 . 0 0 "[ . 1 . 2]" 1
458 1 30 ARG H 1 30 ARG HG2 5.110 . 5.620 4.111 2.082 4.516 . 0 0 "[ . 1 . 2]" 1
459 1 30 ARG H 1 30 ARG QG 4.320 . 4.750 3.669 2.067 4.020 . 0 0 "[ . 1 . 2]" 1
460 1 30 ARG H 1 30 ARG HG3 5.110 . 5.620 4.294 2.657 4.592 . 0 0 "[ . 1 . 2]" 1
461 1 30 ARG H 1 31 ASP H 3.730 . 4.100 2.464 2.305 2.603 . 0 0 "[ . 1 . 2]" 1
462 1 30 ARG H 1 31 ASP HA 5.660 . 6.230 4.968 4.684 5.148 . 0 0 "[ . 1 . 2]" 1
463 1 30 ARG H 1 31 ASP HB2 6.200 . 6.820 4.481 4.139 4.732 . 0 0 "[ . 1 . 2]" 1
464 1 30 ARG H 1 31 ASP HB3 6.200 . 6.820 5.768 4.732 6.151 . 0 0 "[ . 1 . 2]" 1
465 1 30 ARG H 1 67 VAL MG1 6.200 . 6.820 5.536 4.869 6.244 . 0 0 "[ . 1 . 2]" 1
466 1 30 ARG H 1 67 VAL MG2 6.200 . 6.820 4.884 4.037 5.341 . 0 0 "[ . 1 . 2]" 1
467 1 30 ARG HA 1 31 ASP HA 5.750 . 6.320 4.738 4.614 4.824 . 0 0 "[ . 1 . 2]" 1
468 1 30 ARG HA 1 66 THR HB 4.990 . 5.490 4.314 2.930 5.506 0.016 8 0 "[ . 1 . 2]" 1
469 1 30 ARG QB 1 31 ASP H 4.470 . 4.920 3.251 2.859 3.796 . 0 0 "[ . 1 . 2]" 1
470 1 30 ARG QB 1 31 ASP HA 6.000 . 6.600 4.267 3.944 4.790 . 0 0 "[ . 1 . 2]" 1
471 1 30 ARG HB2 1 31 ASP H 5.280 . 5.810 4.181 3.646 4.507 . 0 0 "[ . 1 . 2]" 1
472 1 30 ARG HB3 1 31 ASP H 5.280 . 5.810 3.434 2.933 4.273 . 0 0 "[ . 1 . 2]" 1
473 1 31 ASP H 1 31 ASP HB2 4.030 . 4.430 2.333 2.207 2.580 . 0 0 "[ . 1 . 2]" 1
474 1 31 ASP H 1 31 ASP QB 3.320 . 3.650 2.280 2.184 2.413 . 0 0 "[ . 1 . 2]" 1
475 1 31 ASP H 1 31 ASP HB3 4.030 . 4.430 3.391 2.585 3.634 . 0 0 "[ . 1 . 2]" 1
476 1 31 ASP H 1 67 VAL MG1 5.400 . 5.940 4.835 4.468 5.398 . 0 0 "[ . 1 . 2]" 1
477 1 31 ASP H 1 67 VAL QG 4.060 . 4.470 3.416 3.077 3.761 . 0 0 "[ . 1 . 2]" 1
478 1 31 ASP H 1 67 VAL MG2 5.400 . 5.940 3.495 3.136 3.838 . 0 0 "[ . 1 . 2]" 1
479 1 31 ASP HA 1 32 THR H 3.350 . 3.690 2.225 2.070 2.467 . 0 0 "[ . 1 . 2]" 1
480 1 31 ASP HA 1 32 THR MG 5.220 . 5.740 4.481 3.403 5.419 . 0 0 "[ . 1 . 2]" 1
481 1 31 ASP HA 1 35 VAL HB 5.090 . 5.600 3.921 3.208 4.719 . 0 0 "[ . 1 . 2]" 1
482 1 31 ASP HA 1 35 VAL MG1 4.980 . 5.480 4.051 3.532 4.933 . 0 0 "[ . 1 . 2]" 1
483 1 31 ASP HA 1 35 VAL MG2 5.040 . 5.540 3.968 3.256 4.485 . 0 0 "[ . 1 . 2]" 1
484 1 31 ASP QB 1 32 THR H 4.080 . 4.490 3.016 2.235 3.657 . 0 0 "[ . 1 . 2]" 1
485 1 31 ASP QB 1 35 VAL HB 4.450 . 4.890 3.450 2.621 4.565 . 0 0 "[ . 1 . 2]" 1
486 1 31 ASP QB 1 35 VAL MG1 3.950 . 4.350 3.773 2.963 4.430 0.080 18 0 "[ . 1 . 2]" 1
487 1 31 ASP QB 1 35 VAL MG2 4.880 . 5.370 4.442 3.643 5.284 . 0 0 "[ . 1 . 2]" 1
488 1 31 ASP QB 1 36 VAL H 4.490 . 4.940 4.034 3.488 4.772 . 0 0 "[ . 1 . 2]" 1
489 1 31 ASP QB 1 36 VAL HB 4.910 . 5.400 3.372 2.599 3.890 . 0 0 "[ . 1 . 2]" 1
490 1 31 ASP QB 1 36 VAL MG1 4.480 . 4.930 4.311 3.730 4.772 . 0 0 "[ . 1 . 2]" 1
491 1 31 ASP QB 1 67 VAL QG 3.900 . 4.290 2.622 2.219 3.072 . 0 0 "[ . 1 . 2]" 1
492 1 31 ASP HB2 1 32 THR H 4.880 . 5.370 4.128 3.638 4.467 . 0 0 "[ . 1 . 2]" 1
493 1 31 ASP HB2 1 35 VAL HB 5.060 . 5.570 4.980 4.391 5.554 . 0 0 "[ . 1 . 2]" 1
494 1 31 ASP HB2 1 36 VAL H 5.360 . 5.900 5.607 4.968 6.007 0.107 7 0 "[ . 1 . 2]" 1
495 1 31 ASP HB2 1 36 VAL HB 5.690 . 6.260 4.518 3.837 5.240 . 0 0 "[ . 1 . 2]" 1
496 1 31 ASP HB2 1 36 VAL MG1 5.310 . 5.840 5.474 4.685 5.892 0.052 18 0 "[ . 1 . 2]" 1
497 1 31 ASP HB2 1 67 VAL H 6.200 . 6.820 4.720 4.028 5.880 . 0 0 "[ . 1 . 2]" 1
498 1 31 ASP HB3 1 32 THR H 4.880 . 5.370 3.120 2.256 3.970 . 0 0 "[ . 1 . 2]" 1
499 1 31 ASP HB3 1 35 VAL HB 5.060 . 5.570 3.558 2.642 4.981 . 0 0 "[ . 1 . 2]" 1
500 1 31 ASP HB3 1 36 VAL H 5.360 . 5.900 4.145 3.540 5.017 . 0 0 "[ . 1 . 2]" 1
501 1 31 ASP HB3 1 36 VAL HB 5.690 . 6.260 3.494 2.635 4.083 . 0 0 "[ . 1 . 2]" 1
502 1 31 ASP HB3 1 36 VAL MG1 5.310 . 5.840 4.523 3.917 5.062 . 0 0 "[ . 1 . 2]" 1
503 1 31 ASP HB3 1 67 VAL H 6.200 . 6.820 4.741 3.930 5.520 . 0 0 "[ . 1 . 2]" 1
504 1 32 THR H 1 32 THR MG 3.600 . 3.960 3.088 2.023 3.829 . 0 0 "[ . 1 . 2]" 1
505 1 32 THR H 1 33 LEU H 5.690 . 6.260 4.557 4.423 4.628 . 0 0 "[ . 1 . 2]" 1
506 1 32 THR H 1 35 VAL H 4.440 . 4.880 3.779 3.459 4.259 . 0 0 "[ . 1 . 2]" 1
507 1 32 THR H 1 35 VAL HB 3.650 . 4.020 2.671 2.353 3.214 . 0 0 "[ . 1 . 2]" 1
508 1 32 THR H 1 35 VAL MG1 4.420 . 4.860 3.783 3.427 4.243 . 0 0 "[ . 1 . 2]" 1
509 1 32 THR H 1 35 VAL MG2 3.910 . 4.300 2.846 2.287 3.503 . 0 0 "[ . 1 . 2]" 1
510 1 32 THR H 1 36 VAL H 5.510 . 6.060 4.328 3.511 4.770 . 0 0 "[ . 1 . 2]" 1
511 1 32 THR HA 1 32 THR MG 3.450 . 3.790 2.429 2.190 3.218 . 0 0 "[ . 1 . 2]" 1
512 1 32 THR HA 1 33 LEU H 3.340 . 3.670 2.364 2.247 2.473 . 0 0 "[ . 1 . 2]" 1
513 1 32 THR HA 1 33 LEU HB2 6.110 . 6.720 4.808 4.516 4.940 . 0 0 "[ . 1 . 2]" 1
514 1 32 THR HA 1 33 LEU QB 5.250 . 5.780 4.580 4.230 4.701 . 0 0 "[ . 1 . 2]" 1
515 1 32 THR HA 1 33 LEU HB3 6.110 . 6.720 5.763 5.101 5.894 . 0 0 "[ . 1 . 2]" 1
516 1 32 THR HA 1 33 LEU HG 6.200 . 6.820 4.053 3.634 6.660 . 0 0 "[ . 1 . 2]" 1
517 1 32 THR HA 1 34 LEU H 4.340 . 4.770 4.168 3.835 4.471 . 0 0 "[ . 1 . 2]" 1
518 1 32 THR HA 1 35 VAL H 4.960 . 5.460 4.596 4.368 4.873 . 0 0 "[ . 1 . 2]" 1
519 1 32 THR HA 1 66 THR HA 3.740 . 4.110 1.844 1.679 2.468 0.121 1 0 "[ . 1 . 2]" 1
520 1 32 THR HA 1 67 VAL H 4.470 . 4.920 3.189 2.651 3.982 . 0 0 "[ . 1 . 2]" 1
521 1 32 THR MG 1 33 LEU H 4.450 . 4.890 2.909 2.022 3.714 . 0 0 "[ . 1 . 2]" 1
522 1 32 THR MG 1 34 LEU H 4.850 . 5.330 3.008 1.923 4.306 . 0 0 "[ . 1 . 2]" 1
523 1 32 THR MG 1 35 VAL H 4.960 . 5.460 3.604 1.783 4.546 0.017 18 0 "[ . 1 . 2]" 1
524 1 32 THR MG 1 66 THR HA 4.650 . 5.120 3.075 2.170 4.218 . 0 0 "[ . 1 . 2]" 1
525 1 32 THR MG 1 66 THR HB 4.530 . 4.980 4.396 2.024 5.082 0.102 7 0 "[ . 1 . 2]" 1
526 1 33 LEU H 1 33 LEU QB 3.340 . 3.670 2.415 2.218 2.466 . 0 0 "[ . 1 . 2]" 1
527 1 33 LEU H 1 33 LEU MD1 4.840 . 5.320 3.646 3.547 3.886 . 0 0 "[ . 1 . 2]" 1
528 1 33 LEU H 1 33 LEU QD 3.900 . 4.290 3.079 2.949 3.617 . 0 0 "[ . 1 . 2]" 1
529 1 33 LEU H 1 33 LEU MD2 4.840 . 5.320 3.332 3.114 4.310 . 0 0 "[ . 1 . 2]" 1
530 1 33 LEU H 1 33 LEU HG 4.530 . 4.980 2.399 2.167 4.516 . 0 0 "[ . 1 . 2]" 1
531 1 33 LEU H 1 34 LEU H 3.850 . 4.230 2.674 2.585 2.802 . 0 0 "[ . 1 . 2]" 1
532 1 33 LEU H 1 63 GLU HA 4.870 . 5.360 4.126 3.537 4.447 . 0 0 "[ . 1 . 2]" 1
533 1 33 LEU H 1 65 LEU H 5.430 . 5.970 4.151 3.485 4.726 . 0 0 "[ . 1 . 2]" 1
534 1 33 LEU H 1 66 THR HA 4.370 . 4.810 3.017 2.555 3.373 . 0 0 "[ . 1 . 2]" 1
535 1 33 LEU H 1 67 VAL H 4.810 . 5.290 4.468 3.961 4.864 . 0 0 "[ . 1 . 2]" 1
536 1 33 LEU HA 1 33 LEU MD1 4.030 . 4.430 3.745 2.096 3.871 . 0 0 "[ . 1 . 2]" 1
537 1 33 LEU HA 1 33 LEU QD 3.490 . 3.840 1.960 1.880 2.087 . 0 0 "[ . 1 . 2]" 1
538 1 33 LEU HA 1 33 LEU MD2 4.030 . 4.430 2.054 1.884 3.861 . 0 0 "[ . 1 . 2]" 1
539 1 33 LEU HA 1 33 LEU HG 4.250 . 4.680 3.068 2.786 3.161 . 0 0 "[ . 1 . 2]" 1
540 1 33 LEU HA 1 36 VAL H 4.070 . 4.480 3.368 3.112 3.629 . 0 0 "[ . 1 . 2]" 1
541 1 33 LEU HA 1 36 VAL HB 4.320 . 4.750 3.696 3.274 3.979 . 0 0 "[ . 1 . 2]" 1
542 1 33 LEU HA 1 36 VAL MG1 4.010 . 4.410 1.835 1.721 2.060 0.079 18 0 "[ . 1 . 2]" 1
543 1 33 LEU QB 1 34 LEU H 4.320 . 4.750 2.884 2.511 3.500 . 0 0 "[ . 1 . 2]" 1
544 1 33 LEU QB 1 34 LEU HA 5.180 . 5.700 4.046 3.879 4.315 . 0 0 "[ . 1 . 2]" 1
545 1 33 LEU QB 1 36 VAL H 6.000 . 6.600 4.968 4.681 5.262 . 0 0 "[ . 1 . 2]" 1
546 1 33 LEU QB 1 63 GLU HA 3.380 . 3.720 2.020 1.763 2.651 0.037 13 0 "[ . 1 . 2]" 1
547 1 33 LEU QB 1 63 GLU QB 5.680 . 6.250 3.510 2.741 4.421 . 0 0 "[ . 1 . 2]" 1
548 1 33 LEU QB 1 63 GLU QG 5.280 . 5.810 3.622 2.658 4.977 . 0 0 "[ . 1 . 2]" 1
549 1 33 LEU QB 1 64 ASP H 5.770 . 6.350 4.315 3.484 4.884 . 0 0 "[ . 1 . 2]" 1
550 1 33 LEU QB 1 65 LEU H 4.530 . 4.980 3.515 2.863 4.383 . 0 0 "[ . 1 . 2]" 1
551 1 33 LEU HB2 1 63 GLU HA 3.870 . 4.260 2.135 1.797 3.416 0.003 13 0 "[ . 1 . 2]" 1
552 1 33 LEU HB3 1 63 GLU HA 3.870 . 4.260 2.877 1.933 3.952 . 0 0 "[ . 1 . 2]" 1
553 1 33 LEU QD 1 36 VAL HB 5.660 . 6.230 4.086 3.494 4.326 . 0 0 "[ . 1 . 2]" 1
554 1 33 LEU QD 1 53 LEU QB 5.310 . 5.840 4.042 2.866 4.801 . 0 0 "[ . 1 . 2]" 1
555 1 33 LEU QD 1 60 ILE HB 4.500 . 4.950 3.537 2.155 4.322 . 0 0 "[ . 1 . 2]" 1
556 1 33 LEU QD 1 62 ARG QB 4.930 . 5.420 3.172 2.005 4.047 . 0 0 "[ . 1 . 2]" 1
557 1 33 LEU QD 1 63 GLU HA 3.870 . 4.260 3.070 1.783 3.877 0.017 2 0 "[ . 1 . 2]" 1
558 1 33 LEU QD 1 63 GLU QB 5.130 . 5.640 4.488 3.348 5.233 . 0 0 "[ . 1 . 2]" 1
559 1 33 LEU QD 1 63 GLU QG 5.900 . 6.490 4.209 2.533 5.485 . 0 0 "[ . 1 . 2]" 1
560 1 33 LEU QD 1 64 ASP H 5.780 . 6.360 4.382 3.302 4.771 . 0 0 "[ . 1 . 2]" 1
561 1 33 LEU QD 1 65 LEU HB2 4.170 . 4.590 2.357 1.804 3.533 . 0 0 "[ . 1 . 2]" 1
562 1 33 LEU QD 1 67 VAL HA 4.330 . 4.760 3.093 2.289 4.557 . 0 0 "[ . 1 . 2]" 1
563 1 33 LEU QD 1 70 CYS QB 4.730 . 5.200 2.918 2.170 4.187 . 0 0 "[ . 1 . 2]" 1
564 1 33 LEU HG 1 34 LEU H 4.910 . 5.400 4.482 4.144 4.710 . 0 0 "[ . 1 . 2]" 1
565 1 33 LEU HG 1 36 VAL MG1 4.710 . 5.180 4.273 2.931 4.625 . 0 0 "[ . 1 . 2]" 1
566 1 33 LEU HG 1 60 ILE MG 5.300 . 5.830 4.424 4.147 4.909 . 0 0 "[ . 1 . 2]" 1
567 1 33 LEU HG 1 63 GLU HA 4.890 . 5.380 4.311 3.409 5.094 . 0 0 "[ . 1 . 2]" 1
568 1 34 LEU H 1 34 LEU HB2 3.660 . 4.030 2.568 2.409 2.862 . 0 0 "[ . 1 . 2]" 1
569 1 34 LEU H 1 34 LEU HB3 3.660 . 4.030 2.492 2.363 2.594 . 0 0 "[ . 1 . 2]" 1
570 1 34 LEU H 1 34 LEU MD1 4.730 . 5.200 4.112 3.986 4.273 . 0 0 "[ . 1 . 2]" 1
571 1 34 LEU H 1 34 LEU MD2 4.860 . 5.350 4.258 4.221 4.370 . 0 0 "[ . 1 . 2]" 1
572 1 34 LEU H 1 34 LEU HG 5.330 . 5.860 4.464 4.349 4.534 . 0 0 "[ . 1 . 2]" 1
573 1 34 LEU H 1 35 VAL H 3.950 . 4.350 2.555 2.232 2.709 . 0 0 "[ . 1 . 2]" 1
574 1 34 LEU H 1 35 VAL HB 5.380 . 5.920 4.810 4.332 5.017 . 0 0 "[ . 1 . 2]" 1
575 1 34 LEU H 1 35 VAL MG2 5.190 . 5.710 3.940 3.683 4.314 . 0 0 "[ . 1 . 2]" 1
576 1 34 LEU H 1 63 GLU HA 4.510 . 4.960 3.497 2.880 3.996 . 0 0 "[ . 1 . 2]" 1
577 1 34 LEU H 1 63 GLU QG 5.720 . 6.290 4.719 3.573 5.670 . 0 0 "[ . 1 . 2]" 1
578 1 34 LEU HA 1 34 LEU MD2 3.840 . 4.220 3.881 3.831 3.926 . 0 0 "[ . 1 . 2]" 1
579 1 34 LEU HA 1 37 LYS H 4.500 . 4.950 3.779 3.481 4.102 . 0 0 "[ . 1 . 2]" 1
580 1 34 LEU HA 1 37 LYS HB2 4.290 . 4.720 3.146 2.709 3.825 . 0 0 "[ . 1 . 2]" 1
581 1 34 LEU HA 1 37 LYS HB3 6.070 . 6.680 4.669 4.160 5.388 . 0 0 "[ . 1 . 2]" 1
582 1 34 LEU HA 1 37 LYS HD2 6.200 . 6.820 4.261 2.823 6.020 . 0 0 "[ . 1 . 2]" 1
583 1 34 LEU HA 1 37 LYS QD 5.430 . 5.970 3.710 2.521 5.249 . 0 0 "[ . 1 . 2]" 1
584 1 34 LEU HA 1 37 LYS HD3 6.200 . 6.820 4.646 2.539 5.781 . 0 0 "[ . 1 . 2]" 1
585 1 34 LEU HA 1 38 GLN QG 5.610 . 6.170 4.618 4.215 5.042 . 0 0 "[ . 1 . 2]" 1
586 1 34 LEU HA 1 63 GLU HA 5.870 . 6.460 4.050 3.332 4.770 . 0 0 "[ . 1 . 2]" 1
587 1 34 LEU HA 1 63 GLU QB 5.340 . 5.870 2.640 2.036 3.964 . 0 0 "[ . 1 . 2]" 1
588 1 34 LEU QB 1 35 VAL H 3.860 . 4.250 2.684 2.213 3.010 . 0 0 "[ . 1 . 2]" 1
589 1 34 LEU QB 1 37 LYS HB2 6.000 . 6.600 5.003 4.587 5.570 . 0 0 "[ . 1 . 2]" 1
590 1 34 LEU QB 1 63 GLU QB 4.540 . 4.990 2.109 1.792 2.594 0.008 11 0 "[ . 1 . 2]" 1
591 1 34 LEU QB 1 63 GLU QG 5.430 . 5.970 3.962 3.104 4.571 . 0 0 "[ . 1 . 2]" 1
592 1 34 LEU MD1 1 35 VAL HA 6.200 . 6.820 4.763 4.451 4.952 . 0 0 "[ . 1 . 2]" 1
593 1 34 LEU MD1 1 37 LYS H 4.780 . 5.260 4.814 4.412 5.231 . 0 0 "[ . 1 . 2]" 1
594 1 34 LEU MD1 1 37 LYS HA 6.200 . 6.820 6.083 5.527 6.707 . 0 0 "[ . 1 . 2]" 1
595 1 34 LEU MD1 1 37 LYS HB2 4.890 . 5.380 3.475 2.942 4.206 . 0 0 "[ . 1 . 2]" 1
596 1 34 LEU MD1 1 37 LYS QG 5.760 . 6.340 4.204 2.909 5.292 . 0 0 "[ . 1 . 2]" 1
597 1 34 LEU MD1 1 38 GLN QE 4.350 . 4.790 3.435 2.256 4.399 . 0 0 "[ . 1 . 2]" 1
598 1 34 LEU MD1 1 38 GLN HG2 5.210 . 5.730 4.542 3.811 5.209 . 0 0 "[ . 1 . 2]" 1
599 1 34 LEU MD1 1 38 GLN QG 4.460 . 4.910 3.825 3.347 4.469 . 0 0 "[ . 1 . 2]" 1
600 1 34 LEU MD1 1 38 GLN HG3 5.210 . 5.730 4.251 3.512 5.440 . 0 0 "[ . 1 . 2]" 1
601 1 34 LEU MD1 1 63 GLU QB 5.420 . 5.960 2.429 2.075 2.926 . 0 0 "[ . 1 . 2]" 1
602 1 34 LEU MD1 1 63 GLU QG 6.000 . 6.600 3.350 2.399 4.117 . 0 0 "[ . 1 . 2]" 1
603 1 34 LEU MD2 1 35 VAL H 5.110 . 5.620 4.434 3.706 4.832 . 0 0 "[ . 1 . 2]" 1
604 1 34 LEU MD2 1 35 VAL HA 5.210 . 5.730 4.825 4.349 5.213 . 0 0 "[ . 1 . 2]" 1
605 1 34 LEU MD2 1 38 GLN QE 4.690 . 5.160 3.826 2.929 4.569 . 0 0 "[ . 1 . 2]" 1
606 1 34 LEU MD2 1 38 GLN QG 5.000 . 5.500 4.837 4.464 5.387 . 0 0 "[ . 1 . 2]" 1
607 1 34 LEU MD2 1 63 GLU QB 3.370 . 3.710 3.383 2.743 3.776 0.066 9 0 "[ . 1 . 2]" 1
608 1 34 LEU HG 1 35 VAL H 5.180 . 5.700 3.928 3.211 4.330 . 0 0 "[ . 1 . 2]" 1
609 1 34 LEU HG 1 35 VAL HA 5.390 . 5.930 3.770 3.242 4.182 . 0 0 "[ . 1 . 2]" 1
610 1 34 LEU HG 1 35 VAL MG2 5.140 . 5.650 3.821 3.288 4.317 . 0 0 "[ . 1 . 2]" 1
611 1 34 LEU HG 1 38 GLN HE21 4.930 . 5.420 3.292 1.925 4.406 . 0 0 "[ . 1 . 2]" 1
612 1 34 LEU HG 1 38 GLN QE 4.330 . 4.760 3.128 1.865 4.018 . 0 0 "[ . 1 . 2]" 1
613 1 34 LEU HG 1 38 GLN HE22 4.930 . 5.420 4.082 2.499 5.484 0.064 17 0 "[ . 1 . 2]" 1
614 1 34 LEU HG 1 38 GLN QG 4.400 . 4.840 3.742 3.257 4.346 . 0 0 "[ . 1 . 2]" 1
615 1 35 VAL H 1 35 VAL HB 3.400 . 3.740 2.515 2.402 2.602 . 0 0 "[ . 1 . 2]" 1
616 1 35 VAL H 1 35 VAL MG1 4.550 . 5.010 3.777 3.747 3.810 . 0 0 "[ . 1 . 2]" 1
617 1 35 VAL H 1 35 VAL MG2 3.500 . 3.850 2.211 2.003 2.460 . 0 0 "[ . 1 . 2]" 1
618 1 35 VAL H 1 36 VAL H 3.890 . 4.280 2.525 2.276 2.722 . 0 0 "[ . 1 . 2]" 1
619 1 35 VAL H 1 36 VAL MG1 4.870 . 5.360 3.791 3.532 4.015 . 0 0 "[ . 1 . 2]" 1
620 1 35 VAL H 1 38 GLN H 6.010 . 6.610 4.943 4.802 5.210 . 0 0 "[ . 1 . 2]" 1
621 1 35 VAL HA 1 37 LYS H 5.990 . 6.590 4.192 4.052 4.350 . 0 0 "[ . 1 . 2]" 1
622 1 35 VAL HA 1 38 GLN H 4.710 . 5.180 3.431 3.271 3.580 . 0 0 "[ . 1 . 2]" 1
623 1 35 VAL HA 1 38 GLN QB 3.930 . 4.320 3.201 2.758 3.558 . 0 0 "[ . 1 . 2]" 1
624 1 35 VAL HA 1 38 GLN QE 5.120 . 5.630 3.633 1.788 4.769 0.012 15 0 "[ . 1 . 2]" 1
625 1 35 VAL HA 1 38 GLN QG 4.170 . 4.590 2.877 2.238 3.406 . 0 0 "[ . 1 . 2]" 1
626 1 35 VAL HB 1 36 VAL H 3.660 . 4.030 2.661 2.426 2.810 . 0 0 "[ . 1 . 2]" 1
627 1 35 VAL MG1 1 36 VAL H 4.840 . 5.320 3.469 3.215 3.681 . 0 0 "[ . 1 . 2]" 1
628 1 35 VAL MG1 1 36 VAL HA 4.100 . 4.510 3.430 3.258 3.629 . 0 0 "[ . 1 . 2]" 1
629 1 35 VAL MG1 1 38 GLN H 4.680 . 5.150 4.380 4.228 4.596 . 0 0 "[ . 1 . 2]" 1
630 1 35 VAL MG1 1 38 GLN HB2 5.690 . 6.260 3.519 3.204 3.851 . 0 0 "[ . 1 . 2]" 1
631 1 35 VAL MG1 1 38 GLN QB 4.910 . 5.400 3.434 3.134 3.755 . 0 0 "[ . 1 . 2]" 1
632 1 35 VAL MG1 1 38 GLN HB3 5.690 . 6.260 4.789 4.441 5.201 . 0 0 "[ . 1 . 2]" 1
633 1 35 VAL MG1 1 38 GLN QG 4.330 . 4.760 4.159 3.320 4.734 . 0 0 "[ . 1 . 2]" 1
634 1 35 VAL MG1 1 39 LYS H 5.180 . 5.700 4.283 3.847 4.707 . 0 0 "[ . 1 . 2]" 1
635 1 35 VAL MG1 1 39 LYS QD 4.730 . 5.200 3.382 2.346 4.158 . 0 0 "[ . 1 . 2]" 1
636 1 35 VAL MG1 1 39 LYS QG 5.640 . 6.200 3.044 2.453 3.677 . 0 0 "[ . 1 . 2]" 1
637 1 35 VAL MG2 1 36 VAL H 5.040 . 5.540 3.849 3.740 3.956 . 0 0 "[ . 1 . 2]" 1
638 1 36 VAL H 1 36 VAL HB 3.930 . 4.320 2.547 2.489 2.599 . 0 0 "[ . 1 . 2]" 1
639 1 36 VAL H 1 36 VAL MG1 3.290 . 3.620 2.161 2.054 2.242 . 0 0 "[ . 1 . 2]" 1
640 1 36 VAL H 1 36 VAL MG2 4.270 . 4.700 3.785 3.770 3.803 . 0 0 "[ . 1 . 2]" 1
641 1 36 VAL H 1 37 LYS HB3 6.200 . 6.820 6.186 6.065 6.330 . 0 0 "[ . 1 . 2]" 1
642 1 36 VAL H 1 38 GLN H 5.210 . 5.730 4.165 4.054 4.285 . 0 0 "[ . 1 . 2]" 1
643 1 36 VAL HA 1 39 LYS H 4.380 . 4.820 3.167 2.898 3.449 . 0 0 "[ . 1 . 2]" 1
644 1 36 VAL HA 1 39 LYS HB2 5.250 . 5.780 2.759 2.110 3.343 . 0 0 "[ . 1 . 2]" 1
645 1 36 VAL HA 1 39 LYS HB3 5.840 . 6.420 4.270 3.731 4.730 . 0 0 "[ . 1 . 2]" 1
646 1 36 VAL HA 1 39 LYS HD2 5.300 . 5.830 2.881 1.914 4.807 . 0 0 "[ . 1 . 2]" 1
647 1 36 VAL HA 1 39 LYS QD 4.470 . 4.920 2.482 1.906 4.274 . 0 0 "[ . 1 . 2]" 1
648 1 36 VAL HA 1 39 LYS HD3 5.300 . 5.830 3.446 2.046 4.789 . 0 0 "[ . 1 . 2]" 1
649 1 36 VAL HA 1 39 LYS HG2 6.200 . 6.820 4.317 3.611 5.021 . 0 0 "[ . 1 . 2]" 1
650 1 36 VAL HA 1 39 LYS HG3 6.200 . 6.820 2.871 2.130 3.444 . 0 0 "[ . 1 . 2]" 1
651 1 36 VAL HB 1 37 LYS H 4.170 . 4.590 4.041 3.997 4.105 . 0 0 "[ . 1 . 2]" 1
652 1 36 VAL MG1 1 37 LYS H 4.240 . 4.660 2.316 2.203 2.458 . 0 0 "[ . 1 . 2]" 1
653 1 36 VAL MG1 1 37 LYS HB2 5.300 . 5.830 3.985 3.761 4.269 . 0 0 "[ . 1 . 2]" 1
654 1 36 VAL MG1 1 37 LYS HB3 5.400 . 5.940 4.729 4.485 4.891 . 0 0 "[ . 1 . 2]" 1
655 1 36 VAL MG1 1 37 LYS QD 6.000 . 6.600 4.130 3.325 4.729 . 0 0 "[ . 1 . 2]" 1
656 1 36 VAL MG1 1 38 GLN H 5.010 . 5.510 4.401 4.266 4.536 . 0 0 "[ . 1 . 2]" 1
657 1 36 VAL MG1 1 40 ILE QG 6.000 . 6.600 3.767 3.470 4.009 . 0 0 "[ . 1 . 2]" 1
658 1 36 VAL MG2 1 37 LYS H 4.950 . 5.440 3.815 3.633 3.953 . 0 0 "[ . 1 . 2]" 1
659 1 36 VAL MG2 1 39 LYS H 5.140 . 5.650 4.229 4.051 4.438 . 0 0 "[ . 1 . 2]" 1
660 1 36 VAL MG2 1 39 LYS QG 5.480 . 6.030 4.080 3.551 4.661 . 0 0 "[ . 1 . 2]" 1
661 1 36 VAL MG2 1 40 ILE H 4.840 . 5.320 3.743 3.498 4.074 . 0 0 "[ . 1 . 2]" 1
662 1 36 VAL MG2 1 40 ILE HB 6.200 . 6.820 4.487 4.279 4.955 . 0 0 "[ . 1 . 2]" 1
663 1 36 VAL MG2 1 40 ILE QG 4.710 . 5.180 2.426 2.178 2.826 . 0 0 "[ . 1 . 2]" 1
664 1 37 LYS H 1 37 LYS HB2 3.820 . 4.200 2.366 2.152 2.487 . 0 0 "[ . 1 . 2]" 1
665 1 37 LYS H 1 37 LYS HB3 3.940 . 4.330 3.578 3.459 3.618 . 0 0 "[ . 1 . 2]" 1
666 1 37 LYS H 1 37 LYS HD2 6.200 . 6.820 4.471 3.765 5.101 . 0 0 "[ . 1 . 2]" 1
667 1 37 LYS H 1 37 LYS QD 5.460 . 6.010 3.988 3.574 4.552 . 0 0 "[ . 1 . 2]" 1
668 1 37 LYS H 1 37 LYS HD3 6.200 . 6.820 4.646 3.730 5.148 . 0 0 "[ . 1 . 2]" 1
669 1 37 LYS H 1 37 LYS QG 3.710 . 4.080 2.528 2.239 3.036 . 0 0 "[ . 1 . 2]" 1
670 1 37 LYS H 1 38 GLN H 3.870 . 4.260 2.635 2.488 2.787 . 0 0 "[ . 1 . 2]" 1
671 1 37 LYS HA 1 40 ILE H 4.680 . 5.150 3.250 2.863 3.724 . 0 0 "[ . 1 . 2]" 1
672 1 37 LYS HA 1 40 ILE HB 4.330 . 4.760 2.681 2.211 3.254 . 0 0 "[ . 1 . 2]" 1
673 1 37 LYS HA 1 40 ILE MD 4.470 . 4.920 2.545 1.967 3.363 . 0 0 "[ . 1 . 2]" 1
674 1 37 LYS HA 1 48 VAL MG1 6.200 . 6.820 5.029 4.145 6.824 0.004 17 0 "[ . 1 . 2]" 1
675 1 37 LYS HA 1 48 VAL MG2 6.200 . 6.820 4.231 3.748 5.133 . 0 0 "[ . 1 . 2]" 1
676 1 37 LYS HA 1 51 GLN HE21 5.330 . 5.860 4.900 4.394 5.388 . 0 0 "[ . 1 . 2]" 1
677 1 37 LYS HA 1 51 GLN HE22 5.160 . 5.680 3.451 3.036 3.899 . 0 0 "[ . 1 . 2]" 1
678 1 37 LYS HB2 1 38 GLN H 4.250 . 4.680 2.844 2.505 3.144 . 0 0 "[ . 1 . 2]" 1
679 1 37 LYS HB2 1 38 GLN QG 4.070 . 4.480 3.498 3.061 4.137 . 0 0 "[ . 1 . 2]" 1
680 1 37 LYS HB2 1 48 VAL HA 6.200 . 6.820 4.899 4.350 6.024 . 0 0 "[ . 1 . 2]" 1
681 1 37 LYS HB3 1 38 GLN H 4.710 . 5.180 3.617 3.238 3.874 . 0 0 "[ . 1 . 2]" 1
682 1 37 LYS HB3 1 38 GLN QG 4.600 . 5.060 4.268 3.605 4.942 . 0 0 "[ . 1 . 2]" 1
683 1 37 LYS HB3 1 40 ILE MD 5.870 . 6.460 4.568 3.655 5.549 . 0 0 "[ . 1 . 2]" 1
684 1 37 LYS HB3 1 48 VAL HA 5.250 . 5.780 3.295 2.759 4.330 . 0 0 "[ . 1 . 2]" 1
685 1 37 LYS HB3 1 48 VAL MG1 4.530 . 4.980 2.856 1.858 4.893 . 0 0 "[ . 1 . 2]" 1
686 1 37 LYS HB3 1 48 VAL MG2 4.530 . 4.980 2.368 1.774 3.434 0.026 15 0 "[ . 1 . 2]" 1
687 1 37 LYS HB3 1 51 GLN HE21 5.500 . 6.050 4.465 3.741 5.082 . 0 0 "[ . 1 . 2]" 1
688 1 37 LYS HB3 1 51 GLN HE22 5.000 . 5.500 3.390 2.534 3.997 . 0 0 "[ . 1 . 2]" 1
689 1 37 LYS QD 1 40 ILE MD 6.000 . 6.600 4.288 2.549 5.167 . 0 0 "[ . 1 . 2]" 1
690 1 37 LYS QD 1 48 VAL QG 5.900 . 6.490 2.504 1.765 3.549 0.035 12 0 "[ . 1 . 2]" 1
691 1 37 LYS QD 1 51 GLN QG 5.790 . 6.370 4.519 3.343 5.870 . 0 0 "[ . 1 . 2]" 1
692 1 37 LYS HD2 1 48 VAL HA 5.920 . 6.510 4.768 2.497 6.257 . 0 0 "[ . 1 . 2]" 1
693 1 37 LYS HD3 1 48 VAL HA 5.920 . 6.510 4.468 2.525 6.195 . 0 0 "[ . 1 . 2]" 1
694 1 37 LYS QG 1 48 VAL QG 5.900 . 6.490 3.197 2.166 3.896 . 0 0 "[ . 1 . 2]" 1
695 1 37 LYS QG 1 53 LEU MD1 4.430 . 4.870 2.658 2.053 4.026 . 0 0 "[ . 1 . 2]" 1
696 1 38 GLN H 1 38 GLN HB2 4.110 . 4.520 2.516 2.421 2.629 . 0 0 "[ . 1 . 2]" 1
697 1 38 GLN H 1 38 GLN QB 3.500 . 3.850 2.470 2.386 2.569 . 0 0 "[ . 1 . 2]" 1
698 1 38 GLN H 1 38 GLN HB3 4.110 . 4.520 3.596 3.571 3.615 . 0 0 "[ . 1 . 2]" 1
699 1 38 GLN H 1 38 GLN QE 5.990 . 6.590 4.300 3.446 4.928 . 0 0 "[ . 1 . 2]" 1
700 1 38 GLN H 1 38 GLN HG2 4.140 . 4.550 3.113 2.060 3.571 . 0 0 "[ . 1 . 2]" 1
701 1 38 GLN H 1 38 GLN QG 3.530 . 3.880 2.156 2.045 2.476 . 0 0 "[ . 1 . 2]" 1
702 1 38 GLN H 1 38 GLN HG3 4.140 . 4.550 2.542 2.068 3.851 . 0 0 "[ . 1 . 2]" 1
703 1 38 GLN H 1 39 LYS HB2 5.480 . 6.030 4.716 4.532 4.871 . 0 0 "[ . 1 . 2]" 1
704 1 38 GLN HA 1 38 GLN QE 5.340 . 5.870 4.501 3.628 4.898 . 0 0 "[ . 1 . 2]" 1
705 1 38 GLN HA 1 39 LYS HA 4.960 . 5.460 4.755 4.663 4.831 . 0 0 "[ . 1 . 2]" 1
706 1 38 GLN HA 1 41 GLU H 5.050 . 5.560 3.455 3.201 3.771 . 0 0 "[ . 1 . 2]" 1
707 1 38 GLN HA 1 41 GLU HB2 4.680 . 5.150 3.166 2.833 3.636 . 0 0 "[ . 1 . 2]" 1
708 1 38 GLN HA 1 41 GLU HB3 4.680 . 5.150 2.818 2.327 3.677 . 0 0 "[ . 1 . 2]" 1
709 1 38 GLN HA 1 42 ARG H 5.910 . 6.500 4.576 4.097 5.541 . 0 0 "[ . 1 . 2]" 1
710 1 38 GLN HA 1 48 VAL MG1 6.200 . 6.820 4.957 4.121 5.736 . 0 0 "[ . 1 . 2]" 1
711 1 38 GLN HA 1 48 VAL MG2 6.200 . 6.820 3.319 2.285 4.766 . 0 0 "[ . 1 . 2]" 1
712 1 38 GLN QB 1 39 LYS H 4.200 . 4.620 2.739 2.458 2.991 . 0 0 "[ . 1 . 2]" 1
713 1 39 LYS H 1 39 LYS HB2 3.700 . 4.070 2.469 2.278 2.608 . 0 0 "[ . 1 . 2]" 1
714 1 39 LYS H 1 39 LYS HB3 3.920 . 4.310 3.596 3.555 3.612 . 0 0 "[ . 1 . 2]" 1
715 1 39 LYS H 1 39 LYS HD2 5.640 . 6.200 4.272 3.718 4.870 . 0 0 "[ . 1 . 2]" 1
716 1 39 LYS H 1 39 LYS QD 4.810 . 5.290 3.848 3.567 4.381 . 0 0 "[ . 1 . 2]" 1
717 1 39 LYS H 1 39 LYS HD3 5.640 . 6.200 4.537 3.825 4.969 . 0 0 "[ . 1 . 2]" 1
718 1 39 LYS H 1 39 LYS QG 4.120 . 4.530 2.299 1.971 2.731 . 0 0 "[ . 1 . 2]" 1
719 1 39 LYS H 1 40 ILE H 3.930 . 4.320 2.528 2.278 2.775 . 0 0 "[ . 1 . 2]" 1
720 1 39 LYS H 1 40 ILE QG 5.260 . 5.790 4.009 3.753 4.344 . 0 0 "[ . 1 . 2]" 1
721 1 39 LYS HA 1 39 LYS QG 3.720 . 4.090 2.462 2.278 2.595 . 0 0 "[ . 1 . 2]" 1
722 1 39 LYS HA 1 42 ARG H 4.920 . 5.410 3.705 3.158 4.271 . 0 0 "[ . 1 . 2]" 1
723 1 39 LYS HB2 1 40 ILE H 5.200 . 5.720 2.585 2.320 3.042 . 0 0 "[ . 1 . 2]" 1
724 1 39 LYS HB2 1 40 ILE QG 5.790 . 6.370 3.168 2.792 3.650 . 0 0 "[ . 1 . 2]" 1
725 1 39 LYS HB3 1 39 LYS QD 3.540 . 3.890 2.554 2.262 3.051 . 0 0 "[ . 1 . 2]" 1
726 1 39 LYS HB3 1 40 ILE H 4.330 . 4.760 3.608 3.065 3.963 . 0 0 "[ . 1 . 2]" 1
727 1 39 LYS HB3 1 40 ILE HA 6.200 . 6.820 4.431 3.978 4.736 . 0 0 "[ . 1 . 2]" 1
728 1 40 ILE H 1 40 ILE HB 3.560 . 3.920 2.545 2.456 2.649 . 0 0 "[ . 1 . 2]" 1
729 1 40 ILE H 1 40 ILE MD 4.800 . 5.280 3.573 3.510 3.647 . 0 0 "[ . 1 . 2]" 1
730 1 40 ILE H 1 40 ILE HG12 4.050 . 4.460 3.363 3.228 3.563 . 0 0 "[ . 1 . 2]" 1
731 1 40 ILE H 1 40 ILE QG 3.450 . 3.790 2.083 1.937 2.283 . 0 0 "[ . 1 . 2]" 1
732 1 40 ILE H 1 40 ILE HG13 4.050 . 4.460 2.103 1.952 2.310 . 0 0 "[ . 1 . 2]" 1
733 1 40 ILE H 1 41 GLU H 3.990 . 4.390 2.590 2.358 2.728 . 0 0 "[ . 1 . 2]" 1
734 1 40 ILE H 1 51 GLN HE22 5.280 . 5.810 4.161 3.712 4.681 . 0 0 "[ . 1 . 2]" 1
735 1 40 ILE HA 1 43 SER H 4.800 . 5.280 3.365 2.934 3.895 . 0 0 "[ . 1 . 2]" 1
736 1 40 ILE HA 1 43 SER QB 4.730 . 5.200 2.932 2.094 4.065 . 0 0 "[ . 1 . 2]" 1
737 1 40 ILE HA 1 44 GLN H 5.030 . 5.530 3.503 2.918 3.932 . 0 0 "[ . 1 . 2]" 1
738 1 40 ILE HA 1 44 GLN QB 6.000 . 6.600 4.310 3.257 4.935 . 0 0 "[ . 1 . 2]" 1
739 1 40 ILE HA 1 44 GLN QG 5.180 . 5.700 3.525 2.950 3.881 . 0 0 "[ . 1 . 2]" 1
740 1 40 ILE HB 1 41 GLU H 4.050 . 4.460 2.730 2.513 2.969 . 0 0 "[ . 1 . 2]" 1
741 1 40 ILE HB 1 51 GLN HE21 4.540 . 4.990 3.987 3.376 4.784 . 0 0 "[ . 1 . 2]" 1
742 1 40 ILE HB 1 51 GLN HE22 4.350 . 4.790 2.813 2.292 3.521 . 0 0 "[ . 1 . 2]" 1
743 1 40 ILE HB 1 80 LEU MD1 6.200 . 6.820 4.227 3.854 5.090 . 0 0 "[ . 1 . 2]" 1
744 1 40 ILE HB 1 80 LEU MD2 6.200 . 6.820 4.858 4.258 5.922 . 0 0 "[ . 1 . 2]" 1
745 1 40 ILE MD 1 40 ILE MG 3.620 . 3.980 1.939 1.880 1.987 . 0 0 "[ . 1 . 2]" 1
746 1 40 ILE MD 1 41 GLU H 5.440 . 5.980 4.656 4.508 4.846 . 0 0 "[ . 1 . 2]" 1
747 1 40 ILE MD 1 44 GLN QE 5.990 . 6.590 5.550 5.124 6.637 0.047 12 0 "[ . 1 . 2]" 1
748 1 40 ILE MD 1 44 GLN QG 6.000 . 6.600 4.351 3.972 5.138 . 0 0 "[ . 1 . 2]" 1
749 1 40 ILE QG 1 41 GLU H 4.760 . 5.240 3.997 3.889 4.091 . 0 0 "[ . 1 . 2]" 1
750 1 40 ILE MG 1 41 GLU H 4.650 . 5.120 3.558 3.310 3.730 . 0 0 "[ . 1 . 2]" 1
751 1 40 ILE MG 1 41 GLU HA 5.480 . 6.030 3.558 3.334 3.771 . 0 0 "[ . 1 . 2]" 1
752 1 40 ILE MG 1 43 SER QB 5.250 . 5.780 3.838 3.083 4.862 . 0 0 "[ . 1 . 2]" 1
753 1 40 ILE MG 1 44 GLN H 4.740 . 5.210 3.347 3.065 3.766 . 0 0 "[ . 1 . 2]" 1
754 1 40 ILE MG 1 44 GLN HA 5.640 . 6.200 4.715 4.445 5.159 . 0 0 "[ . 1 . 2]" 1
755 1 40 ILE MG 1 44 GLN HB2 4.830 . 5.310 2.564 2.076 2.943 . 0 0 "[ . 1 . 2]" 1
756 1 40 ILE MG 1 44 GLN QB 4.230 . 4.650 2.522 2.056 2.881 . 0 0 "[ . 1 . 2]" 1
757 1 40 ILE MG 1 44 GLN HB3 4.830 . 5.310 3.746 3.200 4.175 . 0 0 "[ . 1 . 2]" 1
758 1 40 ILE MG 1 44 GLN QE 4.340 . 4.770 3.743 3.123 4.510 . 0 0 "[ . 1 . 2]" 1
759 1 40 ILE MG 1 44 GLN HG2 5.140 . 5.650 2.607 2.239 4.149 . 0 0 "[ . 1 . 2]" 1
760 1 40 ILE MG 1 44 GLN QG 4.490 . 4.940 2.218 1.886 2.707 . 0 0 "[ . 1 . 2]" 1
761 1 40 ILE MG 1 44 GLN HG3 5.140 . 5.650 2.459 1.955 2.816 . 0 0 "[ . 1 . 2]" 1
762 1 40 ILE MG 1 45 HIS H 5.700 . 6.270 4.723 4.189 5.072 . 0 0 "[ . 1 . 2]" 1
763 1 40 ILE MG 1 46 ILE H 5.670 . 6.240 4.286 3.531 4.900 . 0 0 "[ . 1 . 2]" 1
764 1 40 ILE MG 1 46 ILE HG12 5.470 . 6.020 3.383 2.537 4.101 . 0 0 "[ . 1 . 2]" 1
765 1 40 ILE MG 1 51 GLN HE21 4.940 . 5.430 3.752 2.651 4.799 . 0 0 "[ . 1 . 2]" 1
766 1 40 ILE MG 1 51 GLN HE22 4.650 . 5.120 3.527 2.859 4.241 . 0 0 "[ . 1 . 2]" 1
767 1 40 ILE MG 1 51 GLN QG 6.000 . 6.600 2.995 2.587 3.675 . 0 0 "[ . 1 . 2]" 1
768 1 41 GLU H 1 41 GLU HB2 3.880 . 4.270 2.494 2.377 2.578 . 0 0 "[ . 1 . 2]" 1
769 1 41 GLU H 1 41 GLU HB3 3.880 . 4.270 2.542 2.454 2.629 . 0 0 "[ . 1 . 2]" 1
770 1 41 GLU H 1 42 ARG H 3.880 . 4.270 2.748 2.583 3.006 . 0 0 "[ . 1 . 2]" 1
771 1 41 GLU H 1 46 ILE HG13 6.200 . 6.820 5.292 4.746 5.673 . 0 0 "[ . 1 . 2]" 1
772 1 41 GLU H 1 48 VAL MG1 6.200 . 6.820 6.075 5.296 6.833 0.013 10 0 "[ . 1 . 2]" 1
773 1 41 GLU H 1 48 VAL MG2 6.200 . 6.820 4.503 3.704 5.748 . 0 0 "[ . 1 . 2]" 1
774 1 41 GLU H 1 51 GLN HE21 4.660 . 5.130 3.777 3.457 4.415 . 0 0 "[ . 1 . 2]" 1
775 1 41 GLU H 1 51 GLN HE22 4.120 . 4.530 2.446 2.186 2.965 . 0 0 "[ . 1 . 2]" 1
776 1 41 GLU HA 1 42 ARG HA 6.020 . 6.620 4.696 4.599 4.811 . 0 0 "[ . 1 . 2]" 1
777 1 41 GLU HA 1 44 GLN H 4.920 . 5.410 4.062 3.670 4.514 . 0 0 "[ . 1 . 2]" 1
778 1 41 GLU HA 1 45 HIS H 4.410 . 4.850 3.809 3.362 4.451 . 0 0 "[ . 1 . 2]" 1
779 1 41 GLU HA 1 45 HIS HA 5.600 . 6.160 4.422 3.577 5.310 . 0 0 "[ . 1 . 2]" 1
780 1 41 GLU HA 1 46 ILE H 3.440 . 3.780 2.958 2.360 3.285 . 0 0 "[ . 1 . 2]" 1
781 1 41 GLU HA 1 46 ILE HA 6.200 . 6.820 4.887 4.417 5.202 . 0 0 "[ . 1 . 2]" 1
782 1 41 GLU HA 1 46 ILE HG13 5.570 . 6.130 3.326 2.896 3.666 . 0 0 "[ . 1 . 2]" 1
783 1 41 GLU HA 1 51 GLN HE21 5.370 . 5.910 2.746 2.194 3.412 . 0 0 "[ . 1 . 2]" 1
784 1 41 GLU HA 1 51 GLN HE22 5.520 . 6.070 2.897 2.383 3.513 . 0 0 "[ . 1 . 2]" 1
785 1 41 GLU QB 1 42 ARG H 3.770 . 4.150 2.612 2.339 2.955 . 0 0 "[ . 1 . 2]" 1
786 1 41 GLU QB 1 42 ARG QB 5.550 . 6.110 3.776 3.481 3.993 . 0 0 "[ . 1 . 2]" 1
787 1 41 GLU QB 1 47 PRO HA 5.990 . 6.590 3.747 3.359 4.699 . 0 0 "[ . 1 . 2]" 1
788 1 41 GLU QB 1 51 GLN HE21 4.760 . 5.240 2.739 2.334 3.184 . 0 0 "[ . 1 . 2]" 1
789 1 41 GLU QB 1 51 GLN HE22 4.700 . 5.170 2.147 1.898 2.451 . 0 0 "[ . 1 . 2]" 1
790 1 41 GLU HB2 1 42 ARG H 4.500 . 4.950 3.905 3.754 4.061 . 0 0 "[ . 1 . 2]" 1
791 1 41 GLU HB3 1 42 ARG H 4.500 . 4.950 2.655 2.362 3.040 . 0 0 "[ . 1 . 2]" 1
792 1 41 GLU QG 1 42 ARG H 4.720 . 5.190 3.716 3.451 4.107 . 0 0 "[ . 1 . 2]" 1
793 1 41 GLU QG 1 42 ARG HA 5.670 . 6.240 3.700 3.361 4.556 . 0 0 "[ . 1 . 2]" 1
794 1 41 GLU QG 1 46 ILE H 4.700 . 5.170 3.922 3.361 4.543 . 0 0 "[ . 1 . 2]" 1
795 1 41 GLU QG 1 47 PRO HA 4.150 . 4.570 2.150 1.768 3.513 0.032 3 0 "[ . 1 . 2]" 1
796 1 41 GLU QG 1 47 PRO QD 5.790 . 6.370 4.134 3.766 5.177 . 0 0 "[ . 1 . 2]" 1
797 1 41 GLU QG 1 48 VAL H 5.340 . 5.870 3.233 2.735 4.328 . 0 0 "[ . 1 . 2]" 1
798 1 41 GLU QG 1 48 VAL QG 5.880 . 6.470 3.629 2.851 4.549 . 0 0 "[ . 1 . 2]" 1
799 1 41 GLU HG2 1 46 ILE H 5.410 . 5.950 4.665 3.666 5.636 . 0 0 "[ . 1 . 2]" 1
800 1 41 GLU HG3 1 46 ILE H 5.410 . 5.950 4.357 3.583 5.747 . 0 0 "[ . 1 . 2]" 1
801 1 42 ARG H 1 42 ARG QB 3.140 . 3.450 2.259 2.196 2.325 . 0 0 "[ . 1 . 2]" 1
802 1 42 ARG H 1 43 SER H 3.830 . 4.210 2.497 2.213 2.760 . 0 0 "[ . 1 . 2]" 1
803 1 42 ARG H 1 44 GLN H 5.230 . 5.750 4.237 3.904 4.534 . 0 0 "[ . 1 . 2]" 1
804 1 42 ARG HA 1 45 HIS H 5.020 . 5.520 3.857 3.458 4.358 . 0 0 "[ . 1 . 2]" 1
805 1 42 ARG HA 1 45 HIS HA 5.700 . 6.270 3.740 3.155 4.318 . 0 0 "[ . 1 . 2]" 1
806 1 42 ARG QB 1 43 SER H 3.730 . 4.100 2.720 2.154 3.271 . 0 0 "[ . 1 . 2]" 1
807 1 43 SER H 1 43 SER HB2 3.930 . 4.320 2.786 2.502 3.595 . 0 0 "[ . 1 . 2]" 1
808 1 43 SER H 1 43 SER HB3 3.930 . 4.320 3.141 2.441 3.663 . 0 0 "[ . 1 . 2]" 1
809 1 43 SER H 1 44 GLN H 3.650 . 4.020 2.543 2.322 2.728 . 0 0 "[ . 1 . 2]" 1
810 1 43 SER QB 1 44 GLN H 4.360 . 4.800 2.637 2.365 3.237 . 0 0 "[ . 1 . 2]" 1
811 1 43 SER HB2 1 44 GLN H 5.000 . 5.500 3.101 2.447 3.986 . 0 0 "[ . 1 . 2]" 1
812 1 43 SER HB3 1 44 GLN H 5.000 . 5.500 3.395 2.390 4.008 . 0 0 "[ . 1 . 2]" 1
813 1 44 GLN H 1 44 GLN QB 3.690 . 4.060 2.390 2.301 2.534 . 0 0 "[ . 1 . 2]" 1
814 1 44 GLN H 1 44 GLN HG2 4.710 . 5.180 2.664 2.470 3.320 . 0 0 "[ . 1 . 2]" 1
815 1 44 GLN H 1 44 GLN QG 3.880 . 4.270 2.578 2.375 2.772 . 0 0 "[ . 1 . 2]" 1
816 1 44 GLN H 1 44 GLN HG3 4.710 . 5.180 3.813 2.432 4.024 . 0 0 "[ . 1 . 2]" 1
817 1 44 GLN H 1 45 HIS H 3.380 . 3.720 2.299 2.122 2.502 . 0 0 "[ . 1 . 2]" 1
818 1 44 GLN H 1 45 HIS HA 5.890 . 6.480 4.531 4.344 4.741 . 0 0 "[ . 1 . 2]" 1
819 1 44 GLN H 1 46 ILE H 5.230 . 5.750 3.793 3.596 4.254 . 0 0 "[ . 1 . 2]" 1
820 1 44 GLN H 1 46 ILE HG13 5.930 . 6.520 5.136 4.774 5.671 . 0 0 "[ . 1 . 2]" 1
821 1 44 GLN HA 1 44 GLN HE21 5.150 . 5.670 3.890 2.427 4.615 . 0 0 "[ . 1 . 2]" 1
822 1 44 GLN HA 1 44 GLN QE 4.420 . 4.860 3.520 2.343 4.428 . 0 0 "[ . 1 . 2]" 1
823 1 44 GLN HA 1 44 GLN HE22 5.150 . 5.670 4.054 3.091 5.700 0.030 10 0 "[ . 1 . 2]" 1
824 1 44 GLN HA 1 45 HIS HD2 5.950 . 6.540 4.061 2.882 6.400 . 0 0 "[ . 1 . 2]" 1
825 1 44 GLN HA 1 46 ILE MD 6.090 . 6.700 4.959 4.726 5.230 . 0 0 "[ . 1 . 2]" 1
826 1 44 GLN QB 1 46 ILE H 4.850 . 5.330 2.816 2.592 3.185 . 0 0 "[ . 1 . 2]" 1
827 1 44 GLN QB 1 46 ILE MD 3.790 . 4.170 2.607 2.478 2.740 . 0 0 "[ . 1 . 2]" 1
828 1 44 GLN QB 1 46 ILE HG12 5.170 . 5.690 1.953 1.787 2.266 0.013 6 0 "[ . 1 . 2]" 1
829 1 44 GLN HB2 1 45 HIS H 5.400 . 5.940 3.302 3.057 3.511 . 0 0 "[ . 1 . 2]" 1
830 1 44 GLN HB2 1 46 ILE MD 4.540 . 4.990 3.009 2.720 3.448 . 0 0 "[ . 1 . 2]" 1
831 1 44 GLN HB3 1 45 HIS H 5.400 . 5.940 4.088 3.867 4.264 . 0 0 "[ . 1 . 2]" 1
832 1 44 GLN HB3 1 46 ILE MD 4.540 . 4.990 2.887 2.618 3.220 . 0 0 "[ . 1 . 2]" 1
833 1 44 GLN HG2 1 80 LEU MD1 6.200 . 6.820 3.721 3.188 5.760 . 0 0 "[ . 1 . 2]" 1
834 1 44 GLN HG3 1 80 LEU MD1 6.200 . 6.820 2.531 2.019 5.027 . 0 0 "[ . 1 . 2]" 1
835 1 45 HIS H 1 45 HIS HD2 5.390 . 5.930 3.809 3.036 4.567 . 0 0 "[ . 1 . 2]" 1
836 1 45 HIS H 1 46 ILE H 4.110 . 4.520 2.612 2.536 2.702 . 0 0 "[ . 1 . 2]" 1
837 1 45 HIS H 1 46 ILE MD 6.200 . 6.820 5.331 5.134 5.518 . 0 0 "[ . 1 . 2]" 1
838 1 45 HIS H 1 46 ILE HG12 5.590 . 6.150 4.009 3.816 4.202 . 0 0 "[ . 1 . 2]" 1
839 1 45 HIS QB 1 45 HIS HD2 3.410 . 3.750 2.802 2.622 3.301 . 0 0 "[ . 1 . 2]" 1
840 1 45 HIS HB2 1 45 HIS HD2 3.950 . 4.350 2.938 2.682 3.965 . 0 0 "[ . 1 . 2]" 1
841 1 45 HIS HB3 1 45 HIS HD2 3.950 . 4.350 3.797 3.179 3.967 . 0 0 "[ . 1 . 2]" 1
842 1 46 ILE H 1 46 ILE HB 3.910 . 4.300 3.736 3.659 3.811 . 0 0 "[ . 1 . 2]" 1
843 1 46 ILE H 1 46 ILE MD 4.220 . 4.640 3.775 3.638 3.890 . 0 0 "[ . 1 . 2]" 1
844 1 46 ILE H 1 46 ILE HG12 5.050 . 5.560 2.106 1.924 2.251 . 0 0 "[ . 1 . 2]" 1
845 1 46 ILE H 1 46 ILE HG13 4.090 . 4.500 2.842 2.747 2.947 . 0 0 "[ . 1 . 2]" 1
846 1 46 ILE HA 1 47 PRO HD2 3.920 . 4.310 2.341 1.938 2.703 . 0 0 "[ . 1 . 2]" 1
847 1 46 ILE HA 1 47 PRO QD 3.380 . 3.720 1.869 1.787 1.999 0.013 15 0 "[ . 1 . 2]" 1
848 1 46 ILE HA 1 47 PRO HD3 3.920 . 4.310 2.083 1.825 2.483 . 0 0 "[ . 1 . 2]" 1
849 1 46 ILE HA 1 47 PRO HG2 5.800 . 6.380 4.313 4.133 4.491 . 0 0 "[ . 1 . 2]" 1
850 1 46 ILE HA 1 47 PRO HG3 5.800 . 6.380 4.195 3.992 4.442 . 0 0 "[ . 1 . 2]" 1
851 1 46 ILE HA 1 50 LYS QD 4.770 . 5.250 3.905 2.575 4.852 . 0 0 "[ . 1 . 2]" 1
852 1 46 ILE HB 1 47 PRO HD2 6.200 . 6.820 2.911 2.404 3.326 . 0 0 "[ . 1 . 2]" 1
853 1 46 ILE HB 1 47 PRO QD 5.360 . 5.900 2.822 2.352 3.196 . 0 0 "[ . 1 . 2]" 1
854 1 46 ILE HB 1 47 PRO HD3 6.200 . 6.820 3.901 3.338 4.260 . 0 0 "[ . 1 . 2]" 1
855 1 46 ILE HB 1 50 LYS H 4.700 . 5.170 4.828 4.475 5.100 . 0 0 "[ . 1 . 2]" 1
856 1 46 ILE HB 1 50 LYS HB2 4.860 . 5.350 3.217 2.378 4.324 . 0 0 "[ . 1 . 2]" 1
857 1 46 ILE HB 1 50 LYS HD2 4.530 . 4.980 4.235 3.046 4.998 0.018 5 0 "[ . 1 . 2]" 1
858 1 46 ILE HB 1 50 LYS HD3 4.530 . 4.980 4.116 1.860 5.030 0.050 15 0 "[ . 1 . 2]" 1
859 1 46 ILE HB 1 51 GLN HE21 5.610 . 6.170 4.558 4.178 4.999 . 0 0 "[ . 1 . 2]" 1
860 1 46 ILE MD 1 51 GLN HE21 5.410 . 5.950 4.069 3.617 4.740 . 0 0 "[ . 1 . 2]" 1
861 1 46 ILE MD 1 51 GLN QG 5.970 . 6.570 2.233 2.047 2.669 . 0 0 "[ . 1 . 2]" 1
862 1 46 ILE HG13 1 51 GLN H 5.470 . 6.020 5.183 4.576 5.620 . 0 0 "[ . 1 . 2]" 1
863 1 46 ILE HG13 1 51 GLN HE21 4.230 . 4.650 2.877 2.259 3.779 . 0 0 "[ . 1 . 2]" 1
864 1 46 ILE HG13 1 51 GLN HE22 5.690 . 6.260 4.116 3.745 4.576 . 0 0 "[ . 1 . 2]" 1
865 1 46 ILE HG13 1 51 GLN HG2 5.340 . 5.870 2.671 1.959 4.373 . 0 0 "[ . 1 . 2]" 1
866 1 46 ILE HG13 1 51 GLN QG 4.620 . 5.080 2.280 1.918 2.662 . 0 0 "[ . 1 . 2]" 1
867 1 46 ILE HG13 1 51 GLN HG3 5.340 . 5.870 2.736 1.959 3.548 . 0 0 "[ . 1 . 2]" 1
868 1 46 ILE MG 1 47 PRO HD2 4.560 . 5.020 3.403 3.048 3.784 . 0 0 "[ . 1 . 2]" 1
869 1 46 ILE MG 1 47 PRO QD 3.990 . 4.390 3.145 2.961 3.311 . 0 0 "[ . 1 . 2]" 1
870 1 46 ILE MG 1 47 PRO HD3 4.560 . 5.020 3.817 3.375 4.230 . 0 0 "[ . 1 . 2]" 1
871 1 46 ILE MG 1 50 LYS HB3 4.060 . 4.470 4.238 3.640 4.520 0.050 2 0 "[ . 1 . 2]" 1
872 1 46 ILE MG 1 50 LYS HD2 5.990 . 6.590 4.347 3.238 4.995 . 0 0 "[ . 1 . 2]" 1
873 1 46 ILE MG 1 50 LYS QD 5.190 . 5.710 3.636 2.001 4.319 . 0 0 "[ . 1 . 2]" 1
874 1 46 ILE MG 1 50 LYS HD3 5.990 . 6.590 4.055 2.014 4.966 . 0 0 "[ . 1 . 2]" 1
875 1 46 ILE MG 1 51 GLN HG2 6.090 . 6.700 4.878 4.370 6.246 . 0 0 "[ . 1 . 2]" 1
876 1 46 ILE MG 1 51 GLN QG 5.240 . 5.760 4.328 4.088 4.784 . 0 0 "[ . 1 . 2]" 1
877 1 46 ILE MG 1 51 GLN HG3 6.090 . 6.700 4.950 4.399 5.686 . 0 0 "[ . 1 . 2]" 1
878 1 47 PRO HA 1 48 VAL H 3.320 . 3.650 2.233 2.176 2.426 . 0 0 "[ . 1 . 2]" 1
879 1 47 PRO HA 1 48 VAL MG1 6.080 . 6.690 5.125 3.826 5.542 . 0 0 "[ . 1 . 2]" 1
880 1 47 PRO HA 1 48 VAL QG 5.320 . 5.850 3.651 3.473 3.945 . 0 0 "[ . 1 . 2]" 1
881 1 47 PRO HA 1 48 VAL MG2 6.080 . 6.690 4.089 3.510 5.505 . 0 0 "[ . 1 . 2]" 1
882 1 47 PRO HA 1 49 SER H 5.090 . 5.600 4.204 3.830 4.734 . 0 0 "[ . 1 . 2]" 1
883 1 47 PRO QB 1 48 VAL H 4.110 . 4.520 2.889 2.494 3.097 . 0 0 "[ . 1 . 2]" 1
884 1 47 PRO QB 1 49 SER H 4.130 . 4.540 2.762 2.334 3.029 . 0 0 "[ . 1 . 2]" 1
885 1 47 PRO QB 1 50 LYS H 4.780 . 5.260 2.921 2.355 3.481 . 0 0 "[ . 1 . 2]" 1
886 1 47 PRO QB 1 50 LYS HB2 4.750 . 5.220 3.317 2.711 4.529 . 0 0 "[ . 1 . 2]" 1
887 1 47 PRO QB 1 50 LYS QD 4.790 . 5.270 3.599 2.765 4.513 . 0 0 "[ . 1 . 2]" 1
888 1 47 PRO HB2 1 49 SER H 4.900 . 5.390 2.876 2.350 3.203 . 0 0 "[ . 1 . 2]" 1
889 1 47 PRO HB3 1 49 SER H 4.900 . 5.390 3.774 3.316 4.622 . 0 0 "[ . 1 . 2]" 1
890 1 47 PRO QD 1 50 LYS HB2 5.310 . 5.840 2.731 2.146 3.390 . 0 0 "[ . 1 . 2]" 1
891 1 47 PRO QD 1 50 LYS HB3 4.880 . 5.370 3.565 2.370 4.442 . 0 0 "[ . 1 . 2]" 1
892 1 47 PRO QD 1 50 LYS QD 4.540 . 4.990 2.139 1.753 2.927 0.047 5 0 "[ . 1 . 2]" 1
893 1 47 PRO HD2 1 50 LYS HB2 6.200 . 6.820 2.763 2.157 3.477 . 0 0 "[ . 1 . 2]" 1
894 1 47 PRO HD2 1 50 LYS HD2 6.200 . 6.820 2.331 1.791 3.208 0.009 18 0 "[ . 1 . 2]" 1
895 1 47 PRO HD2 1 50 LYS HD3 6.200 . 6.820 3.184 1.782 4.421 0.018 5 0 "[ . 1 . 2]" 1
896 1 47 PRO HD3 1 50 LYS HB2 6.200 . 6.820 4.368 3.862 4.956 . 0 0 "[ . 1 . 2]" 1
897 1 47 PRO HD3 1 50 LYS HD2 6.200 . 6.820 3.692 3.202 4.502 . 0 0 "[ . 1 . 2]" 1
898 1 47 PRO HD3 1 50 LYS HD3 6.200 . 6.820 4.661 3.122 5.829 . 0 0 "[ . 1 . 2]" 1
899 1 47 PRO QG 1 49 SER H 4.550 . 5.010 4.569 3.704 5.035 0.025 16 0 "[ . 1 . 2]" 1
900 1 47 PRO QG 1 50 LYS H 4.500 . 4.950 4.050 2.907 4.812 . 0 0 "[ . 1 . 2]" 1
901 1 47 PRO QG 1 50 LYS HB2 4.560 . 5.020 3.215 1.789 4.492 0.011 8 0 "[ . 1 . 2]" 1
902 1 47 PRO QG 1 50 LYS QD 4.660 . 5.130 2.447 1.924 3.813 . 0 0 "[ . 1 . 2]" 1
903 1 47 PRO HG2 1 50 LYS HD2 6.200 . 6.820 2.553 1.969 4.170 . 0 0 "[ . 1 . 2]" 1
904 1 47 PRO HG2 1 50 LYS HD3 6.200 . 6.820 3.928 3.239 5.041 . 0 0 "[ . 1 . 2]" 1
905 1 47 PRO HG3 1 50 LYS HD2 6.200 . 6.820 3.797 2.576 5.537 . 0 0 "[ . 1 . 2]" 1
906 1 47 PRO HG3 1 50 LYS HD3 6.200 . 6.820 5.166 4.262 6.351 . 0 0 "[ . 1 . 2]" 1
907 1 48 VAL H 1 48 VAL HB 3.690 . 4.060 2.534 2.455 2.627 . 0 0 "[ . 1 . 2]" 1
908 1 48 VAL H 1 49 SER H 4.190 . 4.610 2.838 2.621 3.117 . 0 0 "[ . 1 . 2]" 1
909 1 48 VAL H 1 51 GLN HE21 5.590 . 6.150 3.767 3.112 4.726 . 0 0 "[ . 1 . 2]" 1
910 1 48 VAL H 1 51 GLN HE22 5.890 . 6.480 4.427 3.952 5.025 . 0 0 "[ . 1 . 2]" 1
911 1 48 VAL HA 1 50 LYS H 5.860 . 6.450 3.894 3.532 4.185 . 0 0 "[ . 1 . 2]" 1
912 1 48 VAL HA 1 51 GLN H 4.980 . 5.480 3.633 3.350 3.939 . 0 0 "[ . 1 . 2]" 1
913 1 48 VAL HA 1 51 GLN QB 4.860 . 5.350 2.913 2.116 3.439 . 0 0 "[ . 1 . 2]" 1
914 1 48 VAL HA 1 51 GLN HE21 4.500 . 4.950 2.632 1.780 3.691 0.020 17 0 "[ . 1 . 2]" 1
915 1 48 VAL HA 1 51 GLN HE22 4.700 . 5.170 3.044 2.520 3.946 . 0 0 "[ . 1 . 2]" 1
916 1 48 VAL HA 1 51 GLN QG 4.820 . 5.300 3.032 2.209 4.213 . 0 0 "[ . 1 . 2]" 1
917 1 48 VAL HB 1 49 SER H 4.320 . 4.750 3.020 2.416 4.098 . 0 0 "[ . 1 . 2]" 1
918 1 48 VAL QG 1 49 SER H 4.200 . 4.620 2.982 2.204 3.342 . 0 0 "[ . 1 . 2]" 1
919 1 48 VAL QG 1 49 SER HA 4.510 . 4.960 3.254 3.034 3.457 . 0 0 "[ . 1 . 2]" 1
920 1 48 VAL QG 1 50 LYS H 5.260 . 5.790 4.239 3.910 4.476 . 0 0 "[ . 1 . 2]" 1
921 1 48 VAL MG1 1 49 SER H 4.910 . 5.400 3.146 2.224 3.617 . 0 0 "[ . 1 . 2]" 1
922 1 48 VAL MG1 1 49 SER HA 5.340 . 5.870 3.329 3.085 3.497 . 0 0 "[ . 1 . 2]" 1
923 1 48 VAL MG1 1 50 LYS H 6.150 . 6.770 4.550 4.239 4.847 . 0 0 "[ . 1 . 2]" 1
924 1 48 VAL MG1 1 51 GLN H 6.200 . 6.820 4.525 4.146 5.073 . 0 0 "[ . 1 . 2]" 1
925 1 48 VAL MG1 1 51 GLN HE22 6.200 . 6.820 4.524 3.940 5.237 . 0 0 "[ . 1 . 2]" 1
926 1 48 VAL MG2 1 49 SER H 4.910 . 5.400 3.862 3.608 3.950 . 0 0 "[ . 1 . 2]" 1
927 1 48 VAL MG2 1 49 SER HA 5.340 . 5.870 4.981 3.515 5.427 . 0 0 "[ . 1 . 2]" 1
928 1 48 VAL MG2 1 50 LYS H 6.150 . 6.770 5.066 4.586 5.260 . 0 0 "[ . 1 . 2]" 1
929 1 48 VAL MG2 1 51 GLN H 6.200 . 6.820 5.128 4.139 5.609 . 0 0 "[ . 1 . 2]" 1
930 1 48 VAL MG2 1 51 GLN HE22 6.200 . 6.820 3.224 2.712 4.164 . 0 0 "[ . 1 . 2]" 1
931 1 49 SER H 1 49 SER QB 3.610 . 3.970 2.539 2.248 2.770 . 0 0 "[ . 1 . 2]" 1
932 1 49 SER H 1 50 LYS H 3.950 . 4.350 2.593 2.462 2.728 . 0 0 "[ . 1 . 2]" 1
933 1 49 SER HA 1 51 GLN H 5.160 . 5.680 3.767 3.519 3.896 . 0 0 "[ . 1 . 2]" 1
934 1 50 LYS H 1 50 LYS HB3 3.730 . 4.100 3.450 2.451 3.780 . 0 0 "[ . 1 . 2]" 1
935 1 50 LYS H 1 50 LYS QD 5.630 . 6.190 4.240 3.996 4.598 . 0 0 "[ . 1 . 2]" 1
936 1 50 LYS H 1 51 GLN H 3.390 . 3.730 2.267 2.058 2.399 . 0 0 "[ . 1 . 2]" 1
937 1 50 LYS H 1 51 GLN QB 5.860 . 6.450 4.084 3.472 4.518 . 0 0 "[ . 1 . 2]" 1
938 1 50 LYS H 1 51 GLN QG 4.750 . 5.220 3.717 2.944 5.270 0.050 14 0 "[ . 1 . 2]" 1
939 1 50 LYS HA 1 50 LYS QD 4.400 . 4.840 3.978 3.892 4.260 . 0 0 "[ . 1 . 2]" 1
940 1 50 LYS HA 1 82 VAL QG 5.120 . 5.630 4.564 3.956 5.203 . 0 0 "[ . 1 . 2]" 1
941 1 50 LYS HA 1 83 SER H 3.870 . 4.260 3.177 2.326 4.142 . 0 0 "[ . 1 . 2]" 1
942 1 50 LYS HA 1 83 SER HB2 4.020 . 4.420 3.156 1.796 3.948 0.004 12 0 "[ . 1 . 2]" 1
943 1 50 LYS HA 1 83 SER QB 3.450 . 3.790 2.249 1.767 3.671 0.033 18 0 "[ . 1 . 2]" 1
944 1 50 LYS HA 1 83 SER HB3 4.020 . 4.420 2.687 1.773 4.510 0.090 3 0 "[ . 1 . 2]" 1
945 1 50 LYS HB2 1 51 GLN H 5.170 . 5.690 3.741 3.381 4.261 . 0 0 "[ . 1 . 2]" 1
946 1 50 LYS HB2 1 82 VAL HA 5.480 . 6.030 4.984 4.127 6.088 0.058 8 0 "[ . 1 . 2]" 1
947 1 50 LYS HB2 1 82 VAL QG 4.260 . 4.690 3.902 2.705 4.754 0.064 13 0 "[ . 1 . 2]" 1
948 1 50 LYS HB2 1 83 SER H 4.410 . 4.850 4.351 2.983 4.896 0.046 17 0 "[ . 1 . 2]" 1
949 1 50 LYS HB3 1 51 GLN H 4.060 . 4.470 4.072 3.020 4.337 . 0 0 "[ . 1 . 2]" 1
950 1 50 LYS HB3 1 82 VAL HB 5.890 . 6.480 5.418 4.007 6.493 0.013 8 0 "[ . 1 . 2]" 1
951 1 50 LYS HB3 1 82 VAL QG 4.120 . 4.530 3.067 2.036 4.582 0.052 10 0 "[ . 1 . 2]" 1
952 1 50 LYS HB3 1 83 SER H 4.580 . 5.040 3.145 2.470 4.686 . 0 0 "[ . 1 . 2]" 1
953 1 51 GLN H 1 51 GLN QB 3.380 . 3.720 2.365 2.152 2.513 . 0 0 "[ . 1 . 2]" 1
954 1 51 GLN H 1 51 GLN HE21 5.510 . 6.060 4.525 3.790 5.143 . 0 0 "[ . 1 . 2]" 1
955 1 51 GLN H 1 51 GLN HE22 6.200 . 6.820 5.677 5.286 6.213 . 0 0 "[ . 1 . 2]" 1
956 1 51 GLN H 1 51 GLN QG 3.870 . 4.260 2.775 2.132 3.988 . 0 0 "[ . 1 . 2]" 1
957 1 51 GLN H 1 52 THR H 5.430 . 5.970 4.104 3.861 4.540 . 0 0 "[ . 1 . 2]" 1
958 1 51 GLN HA 1 52 THR H 3.390 . 3.730 2.242 2.157 2.354 . 0 0 "[ . 1 . 2]" 1
959 1 51 GLN HA 1 52 THR HB 6.200 . 6.820 4.779 4.518 4.878 . 0 0 "[ . 1 . 2]" 1
960 1 51 GLN HA 1 80 LEU MD2 4.470 . 4.920 3.624 2.848 4.230 . 0 0 "[ . 1 . 2]" 1
961 1 51 GLN QB 1 53 LEU H 5.890 . 6.480 4.376 3.991 4.878 . 0 0 "[ . 1 . 2]" 1
962 1 51 GLN HB2 1 52 THR HA 6.200 . 6.820 5.109 4.770 5.879 . 0 0 "[ . 1 . 2]" 1
963 1 51 GLN HB3 1 52 THR HA 6.200 . 6.820 4.769 4.027 4.951 . 0 0 "[ . 1 . 2]" 1
964 1 51 GLN QG 1 80 LEU MD1 5.250 . 5.780 3.384 2.854 4.207 . 0 0 "[ . 1 . 2]" 1
965 1 51 GLN QG 1 80 LEU MD2 5.610 . 6.170 3.503 2.196 4.421 . 0 0 "[ . 1 . 2]" 1
966 1 52 THR H 1 52 THR HB 3.880 . 4.270 2.610 2.473 2.935 . 0 0 "[ . 1 . 2]" 1
967 1 52 THR H 1 53 LEU H 5.350 . 5.890 4.223 3.966 4.463 . 0 0 "[ . 1 . 2]" 1
968 1 52 THR H 1 53 LEU MD2 6.040 . 6.640 4.933 4.395 6.586 . 0 0 "[ . 1 . 2]" 1
969 1 52 THR H 1 80 LEU MD2 3.830 . 4.210 3.874 2.867 4.264 0.054 2 0 "[ . 1 . 2]" 1
970 1 52 THR H 1 81 GLU H 4.320 . 4.750 3.597 3.158 4.146 . 0 0 "[ . 1 . 2]" 1
971 1 52 THR HA 1 53 LEU H 3.240 . 3.560 2.176 2.141 2.212 . 0 0 "[ . 1 . 2]" 1
972 1 52 THR HA 1 53 LEU HA 4.820 . 5.300 4.431 4.376 4.486 . 0 0 "[ . 1 . 2]" 1
973 1 52 THR HA 1 53 LEU QB 4.940 . 5.430 4.411 4.140 4.496 . 0 0 "[ . 1 . 2]" 1
974 1 52 THR HA 1 53 LEU HG 5.610 . 6.170 4.206 3.761 6.184 0.014 6 0 "[ . 1 . 2]" 1
975 1 52 THR HA 1 59 VAL MG2 5.330 . 5.860 3.558 2.779 4.243 . 0 0 "[ . 1 . 2]" 1
976 1 52 THR HB 1 53 LEU H 5.510 . 6.060 4.354 4.194 4.451 . 0 0 "[ . 1 . 2]" 1
977 1 52 THR HB 1 54 ILE MD 5.280 . 5.810 3.616 2.641 4.354 . 0 0 "[ . 1 . 2]" 1
978 1 52 THR HB 1 54 ILE HG12 5.910 . 6.500 4.700 4.300 5.282 . 0 0 "[ . 1 . 2]" 1
979 1 52 THR HB 1 54 ILE HG13 5.150 . 5.670 3.604 3.180 5.024 . 0 0 "[ . 1 . 2]" 1
980 1 52 THR HB 1 59 VAL MG2 6.200 . 6.820 4.539 4.222 4.961 . 0 0 "[ . 1 . 2]" 1
981 1 52 THR HB 1 80 LEU MD2 5.510 . 6.060 4.770 4.060 5.241 . 0 0 "[ . 1 . 2]" 1
982 1 52 THR HB 1 81 GLU H 4.620 . 5.080 2.634 2.309 3.058 . 0 0 "[ . 1 . 2]" 1
983 1 52 THR HB 1 81 GLU HB2 4.370 . 4.810 3.474 2.530 4.381 . 0 0 "[ . 1 . 2]" 1
984 1 52 THR HB 1 81 GLU QB 3.620 . 3.980 1.994 1.766 2.842 0.034 5 0 "[ . 1 . 2]" 1
985 1 52 THR HB 1 81 GLU HB3 4.370 . 4.810 2.092 1.772 4.253 0.028 5 0 "[ . 1 . 2]" 1
986 1 52 THR HB 1 81 GLU QG 6.000 . 6.600 3.708 3.214 4.465 . 0 0 "[ . 1 . 2]" 1
987 1 52 THR MG 1 53 LEU H 3.860 . 4.250 3.232 2.810 3.501 . 0 0 "[ . 1 . 2]" 1
988 1 52 THR MG 1 53 LEU HA 4.650 . 5.120 4.334 4.074 4.525 . 0 0 "[ . 1 . 2]" 1
989 1 52 THR MG 1 54 ILE MD 4.270 . 4.700 2.764 2.068 3.627 . 0 0 "[ . 1 . 2]" 1
990 1 52 THR MG 1 54 ILE HG12 4.780 . 5.260 2.818 2.451 4.024 . 0 0 "[ . 1 . 2]" 1
991 1 52 THR MG 1 54 ILE HG13 4.480 . 4.930 2.454 1.938 3.241 . 0 0 "[ . 1 . 2]" 1
992 1 52 THR MG 1 59 VAL HB 4.990 . 5.490 3.387 2.464 4.039 . 0 0 "[ . 1 . 2]" 1
993 1 52 THR MG 1 59 VAL MG2 3.630 . 3.990 2.168 1.793 2.634 0.007 13 0 "[ . 1 . 2]" 1
994 1 52 THR MG 1 81 GLU HB2 5.630 . 6.190 3.817 2.853 4.541 . 0 0 "[ . 1 . 2]" 1
995 1 52 THR MG 1 81 GLU QB 4.900 . 5.390 2.743 2.462 3.326 . 0 0 "[ . 1 . 2]" 1
996 1 52 THR MG 1 81 GLU HB3 5.630 . 6.190 2.878 2.511 4.633 . 0 0 "[ . 1 . 2]" 1
997 1 53 LEU H 1 53 LEU QB 3.420 . 3.760 2.419 2.249 2.495 . 0 0 "[ . 1 . 2]" 1
998 1 53 LEU H 1 53 LEU MD1 4.980 . 5.480 3.707 3.520 4.312 . 0 0 "[ . 1 . 2]" 1
999 1 53 LEU H 1 53 LEU MD2 4.920 . 5.410 3.450 3.244 4.266 . 0 0 "[ . 1 . 2]" 1
1000 1 53 LEU H 1 53 LEU HG 4.830 . 5.310 2.508 2.219 4.317 . 0 0 "[ . 1 . 2]" 1
1001 1 53 LEU H 1 54 ILE H 4.840 . 5.320 4.252 4.074 4.445 . 0 0 "[ . 1 . 2]" 1
1002 1 53 LEU H 1 59 VAL MG2 5.300 . 5.830 3.340 2.502 4.080 . 0 0 "[ . 1 . 2]" 1
1003 1 53 LEU H 1 60 ILE HB 5.910 . 6.500 4.660 3.811 5.721 . 0 0 "[ . 1 . 2]" 1
1004 1 53 LEU H 1 80 LEU MD2 5.250 . 5.780 4.235 3.451 4.747 . 0 0 "[ . 1 . 2]" 1
1005 1 53 LEU HA 1 53 LEU MD2 3.880 . 4.270 2.056 1.947 2.306 . 0 0 "[ . 1 . 2]" 1
1006 1 53 LEU HA 1 54 ILE H 3.240 . 3.560 2.199 2.140 2.265 . 0 0 "[ . 1 . 2]" 1
1007 1 53 LEU HA 1 54 ILE HG13 5.540 . 6.090 4.095 3.909 5.041 . 0 0 "[ . 1 . 2]" 1
1008 1 53 LEU HA 1 80 LEU MD2 4.710 . 5.180 2.504 2.148 2.953 . 0 0 "[ . 1 . 2]" 1
1009 1 53 LEU QB 1 54 ILE H 4.240 . 4.660 3.612 3.345 3.864 . 0 0 "[ . 1 . 2]" 1
1010 1 53 LEU QB 1 55 VAL QG 4.770 . 5.250 3.109 2.399 4.417 . 0 0 "[ . 1 . 2]" 1
1011 1 53 LEU QB 1 80 LEU MD2 5.600 . 6.160 3.872 3.336 4.271 . 0 0 "[ . 1 . 2]" 1
1012 1 53 LEU HB2 1 60 ILE HB 5.170 . 5.690 2.488 1.785 5.261 0.015 3 0 "[ . 1 . 2]" 1
1013 1 53 LEU HB3 1 60 ILE HB 5.170 . 5.690 3.013 2.358 4.482 . 0 0 "[ . 1 . 2]" 1
1014 1 53 LEU MD1 1 60 ILE HB 4.770 . 5.250 2.907 2.323 4.061 . 0 0 "[ . 1 . 2]" 1
1015 1 53 LEU MD2 1 54 ILE H 4.190 . 4.610 3.777 2.555 3.993 . 0 0 "[ . 1 . 2]" 1
1016 1 53 LEU MD2 1 60 ILE HB 6.200 . 6.820 4.577 4.039 5.734 . 0 0 "[ . 1 . 2]" 1
1017 1 53 LEU MD2 1 80 LEU HA 5.090 . 5.600 4.067 3.582 4.856 . 0 0 "[ . 1 . 2]" 1
1018 1 53 LEU MD2 1 80 LEU QB 5.540 . 6.090 4.472 4.155 5.273 . 0 0 "[ . 1 . 2]" 1
1019 1 54 ILE H 1 54 ILE HB 3.880 . 4.270 2.599 2.492 2.687 . 0 0 "[ . 1 . 2]" 1
1020 1 54 ILE H 1 54 ILE MD 4.720 . 5.190 3.766 2.579 4.077 . 0 0 "[ . 1 . 2]" 1
1021 1 54 ILE H 1 54 ILE HG12 5.340 . 5.870 3.744 3.552 4.540 . 0 0 "[ . 1 . 2]" 1
1022 1 54 ILE H 1 54 ILE HG13 4.100 . 4.510 2.576 2.332 3.840 . 0 0 "[ . 1 . 2]" 1
1023 1 54 ILE H 1 78 ILE HA 5.070 . 5.580 4.799 4.384 5.252 . 0 0 "[ . 1 . 2]" 1
1024 1 54 ILE H 1 78 ILE MG 4.620 . 5.080 3.941 3.335 4.502 . 0 0 "[ . 1 . 2]" 1
1025 1 54 ILE H 1 79 GLN H 4.400 . 4.840 3.640 3.173 4.341 . 0 0 "[ . 1 . 2]" 1
1026 1 54 ILE H 1 80 LEU HA 5.170 . 5.690 3.410 3.056 3.758 . 0 0 "[ . 1 . 2]" 1
1027 1 54 ILE HA 1 55 VAL H 3.320 . 3.650 2.175 2.137 2.245 . 0 0 "[ . 1 . 2]" 1
1028 1 54 ILE HA 1 55 VAL QG 5.280 . 5.810 3.680 3.396 3.862 . 0 0 "[ . 1 . 2]" 1
1029 1 54 ILE HA 1 57 GLY QA 5.990 . 6.590 5.155 4.760 5.677 . 0 0 "[ . 1 . 2]" 1
1030 1 54 ILE HA 1 58 ILE H 5.030 . 5.530 4.421 3.882 5.396 . 0 0 "[ . 1 . 2]" 1
1031 1 54 ILE HA 1 59 VAL H 5.400 . 5.940 4.483 3.872 4.972 . 0 0 "[ . 1 . 2]" 1
1032 1 54 ILE HA 1 59 VAL HA 3.960 . 4.360 2.432 2.010 3.065 . 0 0 "[ . 1 . 2]" 1
1033 1 54 ILE HA 1 60 ILE H 4.330 . 4.760 3.580 3.053 4.685 . 0 0 "[ . 1 . 2]" 1
1034 1 54 ILE HB 1 55 VAL QG 6.110 . 6.720 4.988 4.713 5.375 . 0 0 "[ . 1 . 2]" 1
1035 1 54 ILE HB 1 79 GLN H 4.460 . 4.910 2.952 2.275 3.611 . 0 0 "[ . 1 . 2]" 1
1036 1 54 ILE HB 1 79 GLN QB 4.060 . 4.470 2.823 1.895 4.026 . 0 0 "[ . 1 . 2]" 1
1037 1 54 ILE MD 1 54 ILE MG 3.750 . 4.130 2.001 1.897 3.152 . 0 0 "[ . 1 . 2]" 1
1038 1 54 ILE MD 1 79 GLN HA 5.840 . 6.420 5.431 4.717 6.131 . 0 0 "[ . 1 . 2]" 1
1039 1 54 ILE MD 1 80 LEU HA 5.610 . 6.170 4.357 2.762 5.173 . 0 0 "[ . 1 . 2]" 1
1040 1 54 ILE MD 1 81 GLU H 4.610 . 5.070 3.338 1.776 3.932 0.024 8 0 "[ . 1 . 2]" 1
1041 1 54 ILE MD 1 81 GLU HB2 4.380 . 4.820 2.321 1.805 3.035 . 0 0 "[ . 1 . 2]" 1
1042 1 54 ILE MD 1 81 GLU QB 3.850 . 4.230 2.203 1.793 2.965 0.007 13 0 "[ . 1 . 2]" 1
1043 1 54 ILE MD 1 81 GLU HB3 4.380 . 4.820 2.882 2.177 4.166 . 0 0 "[ . 1 . 2]" 1
1044 1 54 ILE MD 1 81 GLU QG 4.820 . 5.300 3.614 2.025 4.364 . 0 0 "[ . 1 . 2]" 1
1045 1 54 ILE HG12 1 55 VAL H 5.950 . 6.540 4.716 4.461 5.205 . 0 0 "[ . 1 . 2]" 1
1046 1 54 ILE HG12 1 59 VAL HA 4.900 . 5.390 3.465 2.778 4.379 . 0 0 "[ . 1 . 2]" 1
1047 1 54 ILE HG12 1 59 VAL HB 5.570 . 6.130 3.287 2.394 4.307 . 0 0 "[ . 1 . 2]" 1
1048 1 54 ILE HG13 1 59 VAL HA 5.920 . 6.510 4.270 2.426 5.190 . 0 0 "[ . 1 . 2]" 1
1049 1 54 ILE HG13 1 59 VAL MG2 5.830 . 6.410 3.924 3.032 4.893 . 0 0 "[ . 1 . 2]" 1
1050 1 54 ILE HG13 1 80 LEU HA 4.890 . 5.380 4.233 3.524 5.443 0.063 8 0 "[ . 1 . 2]" 1
1051 1 54 ILE HG13 1 81 GLU H 4.700 . 5.170 3.450 2.947 4.648 . 0 0 "[ . 1 . 2]" 1
1052 1 54 ILE MG 1 55 VAL H 4.030 . 4.430 3.190 2.777 3.472 . 0 0 "[ . 1 . 2]" 1
1053 1 54 ILE MG 1 56 ASP H 5.190 . 5.710 3.784 3.092 4.598 . 0 0 "[ . 1 . 2]" 1
1054 1 54 ILE MG 1 57 GLY H 3.790 . 4.170 3.161 1.783 4.215 0.045 18 0 "[ . 1 . 2]" 1
1055 1 54 ILE MG 1 57 GLY HA2 4.580 . 5.040 2.778 2.305 3.283 . 0 0 "[ . 1 . 2]" 1
1056 1 54 ILE MG 1 57 GLY QA 3.960 . 4.360 2.734 2.279 3.221 . 0 0 "[ . 1 . 2]" 1
1057 1 54 ILE MG 1 57 GLY HA3 4.580 . 5.040 4.085 3.597 4.671 . 0 0 "[ . 1 . 2]" 1
1058 1 54 ILE MG 1 58 ILE H 4.000 . 4.400 3.414 2.824 4.314 . 0 0 "[ . 1 . 2]" 1
1059 1 54 ILE MG 1 58 ILE HA 5.470 . 6.020 4.212 3.382 4.948 . 0 0 "[ . 1 . 2]" 1
1060 1 54 ILE MG 1 59 VAL H 5.220 . 5.740 4.298 3.336 5.080 . 0 0 "[ . 1 . 2]" 1
1061 1 54 ILE MG 1 59 VAL HA 4.770 . 5.250 3.744 3.033 4.530 . 0 0 "[ . 1 . 2]" 1
1062 1 55 VAL H 1 55 VAL HB 3.760 . 4.140 2.914 2.548 3.761 . 0 0 "[ . 1 . 2]" 1
1063 1 55 VAL H 1 55 VAL QG 3.710 . 4.080 2.287 1.858 2.651 . 0 0 "[ . 1 . 2]" 1
1064 1 55 VAL H 1 58 ILE H 4.010 . 4.410 3.411 3.004 4.211 . 0 0 "[ . 1 . 2]" 1
1065 1 55 VAL H 1 58 ILE HB 5.500 . 6.050 4.085 3.548 4.704 . 0 0 "[ . 1 . 2]" 1
1066 1 55 VAL H 1 59 VAL H 5.810 . 6.390 4.934 4.634 5.358 . 0 0 "[ . 1 . 2]" 1
1067 1 55 VAL H 1 59 VAL HA 4.590 . 5.050 3.407 2.946 3.867 . 0 0 "[ . 1 . 2]" 1
1068 1 55 VAL H 1 60 ILE H 5.040 . 5.540 3.855 3.292 4.389 . 0 0 "[ . 1 . 2]" 1
1069 1 55 VAL H 1 60 ILE HG12 4.430 . 4.870 3.171 2.633 4.176 . 0 0 "[ . 1 . 2]" 1
1070 1 55 VAL HA 1 56 ASP H 3.340 . 3.670 2.132 2.095 2.210 . 0 0 "[ . 1 . 2]" 1
1071 1 55 VAL HA 1 57 GLY H 4.900 . 5.390 4.220 3.257 4.908 . 0 0 "[ . 1 . 2]" 1
1072 1 55 VAL HB 1 56 ASP H 5.410 . 5.950 4.159 3.059 4.438 . 0 0 "[ . 1 . 2]" 1
1073 1 55 VAL HB 1 60 ILE MD 4.770 . 5.250 3.580 2.371 5.264 0.014 10 0 "[ . 1 . 2]" 1
1074 1 55 VAL HB 1 60 ILE HG12 5.720 . 6.290 3.531 2.149 5.278 . 0 0 "[ . 1 . 2]" 1
1075 1 55 VAL HB 1 60 ILE HG13 6.200 . 6.820 3.760 2.221 5.575 . 0 0 "[ . 1 . 2]" 1
1076 1 55 VAL QG 1 56 ASP H 3.950 . 4.350 3.099 2.675 3.655 . 0 0 "[ . 1 . 2]" 1
1077 1 55 VAL QG 1 56 ASP QB 4.970 . 5.470 2.888 2.323 3.499 . 0 0 "[ . 1 . 2]" 1
1078 1 55 VAL QG 1 58 ILE H 4.360 . 4.800 3.876 2.987 4.497 . 0 0 "[ . 1 . 2]" 1
1079 1 55 VAL QG 1 58 ILE HB 5.930 . 6.520 3.659 2.196 5.267 . 0 0 "[ . 1 . 2]" 1
1080 1 55 VAL QG 1 58 ILE QG 5.490 . 6.040 4.632 3.525 5.820 . 0 0 "[ . 1 . 2]" 1
1081 1 55 VAL QG 1 60 ILE H 5.370 . 5.910 3.791 3.371 4.299 . 0 0 "[ . 1 . 2]" 1
1082 1 55 VAL QG 1 60 ILE HG12 4.280 . 4.710 2.394 2.096 2.774 . 0 0 "[ . 1 . 2]" 1
1083 1 55 VAL QG 1 60 ILE HG13 4.720 . 5.190 2.495 2.169 3.020 . 0 0 "[ . 1 . 2]" 1
1084 1 55 VAL QG 1 76 SER QB 4.650 . 5.120 3.004 2.203 4.353 . 0 0 "[ . 1 . 2]" 1
1085 1 55 VAL QG 1 77 ASP H 5.440 . 5.980 4.561 3.347 5.704 . 0 0 "[ . 1 . 2]" 1
1086 1 55 VAL MG1 1 58 ILE H 5.440 . 5.980 4.477 3.040 5.882 . 0 0 "[ . 1 . 2]" 1
1087 1 55 VAL MG2 1 58 ILE H 5.440 . 5.980 4.662 3.061 5.384 . 0 0 "[ . 1 . 2]" 1
1088 1 56 ASP H 1 57 GLY H 4.180 . 4.600 3.280 2.568 3.986 . 0 0 "[ . 1 . 2]" 1
1089 1 56 ASP H 1 58 ILE H 5.440 . 5.980 4.455 4.061 5.236 . 0 0 "[ . 1 . 2]" 1
1090 1 56 ASP H 1 77 ASP H 4.720 . 5.190 3.633 3.069 4.911 . 0 0 "[ . 1 . 2]" 1
1091 1 56 ASP H 1 77 ASP HB2 5.160 . 5.680 4.850 3.918 5.635 . 0 0 "[ . 1 . 2]" 1
1092 1 56 ASP H 1 77 ASP QB 4.470 . 4.920 3.277 2.278 3.947 . 0 0 "[ . 1 . 2]" 1
1093 1 56 ASP H 1 77 ASP HB3 5.160 . 5.680 3.339 2.293 4.030 . 0 0 "[ . 1 . 2]" 1
1094 1 56 ASP HA 1 57 GLY QA 5.250 . 5.780 4.154 3.907 4.246 . 0 0 "[ . 1 . 2]" 1
1095 1 56 ASP HA 1 58 ILE H 5.700 . 6.270 4.758 4.338 5.299 . 0 0 "[ . 1 . 2]" 1
1096 1 56 ASP HA 1 77 ASP H 4.820 . 5.300 3.153 1.965 5.011 . 0 0 "[ . 1 . 2]" 1
1097 1 56 ASP HA 1 77 ASP HB2 5.200 . 5.720 4.152 3.203 5.520 . 0 0 "[ . 1 . 2]" 1
1098 1 56 ASP HA 1 77 ASP QB 4.440 . 4.880 2.714 1.777 3.703 0.023 17 0 "[ . 1 . 2]" 1
1099 1 56 ASP HA 1 77 ASP HB3 5.200 . 5.720 2.760 1.786 3.762 0.014 17 0 "[ . 1 . 2]" 1
1100 1 57 GLY H 1 58 ILE H 4.140 . 4.550 2.109 1.733 3.060 0.067 7 0 "[ . 1 . 2]" 1
1101 1 57 GLY H 1 58 ILE MD 5.590 . 6.150 4.907 4.010 6.182 0.032 11 0 "[ . 1 . 2]" 1
1102 1 57 GLY QA 1 58 ILE HA 4.940 . 5.430 4.017 3.948 4.041 . 0 0 "[ . 1 . 2]" 1
1103 1 57 GLY QA 1 58 ILE MG 5.990 . 6.590 5.235 5.166 5.284 . 0 0 "[ . 1 . 2]" 1
1104 1 57 GLY HA2 1 58 ILE MD 6.200 . 6.820 5.556 4.486 6.391 . 0 0 "[ . 1 . 2]" 1
1105 1 57 GLY HA3 1 58 ILE MD 6.200 . 6.820 4.747 3.768 5.438 . 0 0 "[ . 1 . 2]" 1
1106 1 58 ILE H 1 58 ILE HB 3.540 . 3.890 2.619 2.473 2.773 . 0 0 "[ . 1 . 2]" 1
1107 1 58 ILE H 1 58 ILE MD 4.770 . 5.250 3.795 3.452 4.097 . 0 0 "[ . 1 . 2]" 1
1108 1 58 ILE H 1 58 ILE HG12 4.160 . 4.580 3.390 2.453 4.000 . 0 0 "[ . 1 . 2]" 1
1109 1 58 ILE H 1 58 ILE QG 3.650 . 4.020 2.635 2.115 3.068 . 0 0 "[ . 1 . 2]" 1
1110 1 58 ILE H 1 58 ILE HG13 4.160 . 4.580 3.206 2.137 4.378 . 0 0 "[ . 1 . 2]" 1
1111 1 58 ILE H 1 58 ILE MG 4.430 . 4.870 3.837 3.773 3.911 . 0 0 "[ . 1 . 2]" 1
1112 1 58 ILE H 1 59 VAL H 4.850 . 5.330 4.397 4.259 4.532 . 0 0 "[ . 1 . 2]" 1
1113 1 58 ILE HA 1 58 ILE MD 3.950 . 4.350 3.121 1.983 3.894 . 0 0 "[ . 1 . 2]" 1
1114 1 58 ILE HA 1 59 VAL H 3.220 . 3.540 2.176 2.135 2.254 . 0 0 "[ . 1 . 2]" 1
1115 1 58 ILE HA 1 59 VAL HB 4.950 . 5.440 4.644 4.551 4.727 . 0 0 "[ . 1 . 2]" 1
1116 1 58 ILE HB 1 59 VAL H 5.080 . 5.590 4.140 3.954 4.318 . 0 0 "[ . 1 . 2]" 1
1117 1 58 ILE QG 1 59 VAL H 5.610 . 6.170 4.361 4.146 4.745 . 0 0 "[ . 1 . 2]" 1
1118 1 58 ILE MG 1 59 VAL H 3.330 . 3.660 2.622 2.389 2.939 . 0 0 "[ . 1 . 2]" 1
1119 1 59 VAL H 1 59 VAL HB 3.380 . 3.720 2.758 2.666 2.975 . 0 0 "[ . 1 . 2]" 1
1120 1 59 VAL H 1 59 VAL MG1 3.970 . 4.370 1.950 1.870 2.073 . 0 0 "[ . 1 . 2]" 1
1121 1 59 VAL HA 1 60 ILE H 3.210 . 3.530 2.141 2.111 2.179 . 0 0 "[ . 1 . 2]" 1
1122 1 59 VAL HA 1 60 ILE HB 5.300 . 5.830 4.646 4.584 4.783 . 0 0 "[ . 1 . 2]" 1
1123 1 59 VAL HA 1 60 ILE HG12 5.040 . 5.540 3.712 3.555 3.817 . 0 0 "[ . 1 . 2]" 1
1124 1 59 VAL MG1 1 61 LEU HG 4.580 . 5.040 2.868 2.213 3.730 . 0 0 "[ . 1 . 2]" 1
1125 1 59 VAL MG2 1 60 ILE H 3.600 . 3.960 2.702 2.429 2.908 . 0 0 "[ . 1 . 2]" 1
1126 1 59 VAL MG2 1 60 ILE HG12 4.910 . 5.400 4.706 4.503 4.865 . 0 0 "[ . 1 . 2]" 1
1127 1 60 ILE H 1 60 ILE HB 3.680 . 4.050 2.559 2.490 2.633 . 0 0 "[ . 1 . 2]" 1
1128 1 60 ILE H 1 60 ILE MD 4.640 . 5.100 3.411 3.129 3.603 . 0 0 "[ . 1 . 2]" 1
1129 1 60 ILE H 1 60 ILE HG12 3.640 . 4.000 2.447 2.138 2.692 . 0 0 "[ . 1 . 2]" 1
1130 1 60 ILE HA 1 60 ILE MD 3.820 . 4.200 2.026 1.942 2.105 . 0 0 "[ . 1 . 2]" 1
1131 1 60 ILE HA 1 61 LEU H 3.290 . 3.620 2.151 2.111 2.252 . 0 0 "[ . 1 . 2]" 1
1132 1 60 ILE HA 1 61 LEU HA 6.030 . 6.630 4.396 4.377 4.429 . 0 0 "[ . 1 . 2]" 1
1133 1 60 ILE HA 1 61 LEU MD2 4.800 . 5.280 4.689 4.375 4.911 . 0 0 "[ . 1 . 2]" 1
1134 1 60 ILE HA 1 61 LEU HG 5.050 . 5.560 4.092 3.779 4.500 . 0 0 "[ . 1 . 2]" 1
1135 1 60 ILE HA 1 62 ARG H 4.570 . 5.030 3.443 2.937 4.595 . 0 0 "[ . 1 . 2]" 1
1136 1 60 ILE HB 1 61 LEU H 5.040 . 5.540 4.335 4.169 4.469 . 0 0 "[ . 1 . 2]" 1
1137 1 60 ILE HB 1 61 LEU HA 6.200 . 6.820 4.868 4.752 5.005 . 0 0 "[ . 1 . 2]" 1
1138 1 60 ILE MD 1 60 ILE MG 3.630 . 3.990 1.995 1.967 2.043 . 0 0 "[ . 1 . 2]" 1
1139 1 60 ILE MD 1 61 LEU H 4.570 . 5.030 3.775 3.559 3.905 . 0 0 "[ . 1 . 2]" 1
1140 1 60 ILE MD 1 62 ARG H 4.950 . 5.440 4.316 3.933 5.470 0.030 6 0 "[ . 1 . 2]" 1
1141 1 60 ILE MG 1 61 LEU H 4.070 . 4.480 3.079 2.625 3.532 . 0 0 "[ . 1 . 2]" 1
1142 1 60 ILE MG 1 62 ARG H 3.730 . 4.100 2.354 1.810 2.850 . 0 0 "[ . 1 . 2]" 1
1143 1 60 ILE MG 1 62 ARG HB2 5.520 . 6.070 2.921 2.353 3.687 . 0 0 "[ . 1 . 2]" 1
1144 1 60 ILE MG 1 62 ARG HB3 5.520 . 6.070 4.191 3.697 4.781 . 0 0 "[ . 1 . 2]" 1
1145 1 61 LEU H 1 61 LEU MD2 4.420 . 4.860 3.649 3.417 3.899 . 0 0 "[ . 1 . 2]" 1
1146 1 61 LEU H 1 61 LEU HG 3.520 . 3.870 2.777 2.420 3.095 . 0 0 "[ . 1 . 2]" 1
1147 1 61 LEU H 1 62 ARG H 3.400 . 3.740 2.361 1.988 3.740 0.000 6 0 "[ . 1 . 2]" 1
1148 1 61 LEU H 1 62 ARG QB 5.440 . 5.980 4.135 3.756 4.805 . 0 0 "[ . 1 . 2]" 1
1149 1 61 LEU HA 1 61 LEU MD2 3.370 . 3.710 2.026 1.980 2.079 . 0 0 "[ . 1 . 2]" 1
1150 1 61 LEU QB 1 62 ARG H 3.750 . 4.130 3.390 2.698 3.876 . 0 0 "[ . 1 . 2]" 1
1151 1 61 LEU MD2 1 62 ARG H 5.380 . 5.920 4.573 4.072 4.698 . 0 0 "[ . 1 . 2]" 1
1152 1 61 LEU HG 1 62 ARG H 4.850 . 5.330 4.697 4.277 5.157 . 0 0 "[ . 1 . 2]" 1
1153 1 62 ARG H 1 62 ARG HB2 4.090 . 4.500 2.428 2.246 2.734 . 0 0 "[ . 1 . 2]" 1
1154 1 62 ARG H 1 62 ARG HB3 4.090 . 4.500 3.628 3.516 3.806 . 0 0 "[ . 1 . 2]" 1
1155 1 62 ARG H 1 63 GLU H 5.280 . 5.810 3.955 2.369 4.478 . 0 0 "[ . 1 . 2]" 1
1156 1 62 ARG HA 1 62 ARG QD 4.620 . 5.080 2.198 1.752 3.231 0.048 19 0 "[ . 1 . 2]" 1
1157 1 62 ARG HA 1 63 GLU H 3.530 . 3.880 2.333 2.092 3.567 . 0 0 "[ . 1 . 2]" 1
1158 1 62 ARG HA 1 64 ASP H 4.920 . 5.410 3.260 2.934 3.840 . 0 0 "[ . 1 . 2]" 1
1159 1 62 ARG QB 1 63 GLU H 4.360 . 4.800 3.477 2.245 3.878 . 0 0 "[ . 1 . 2]" 1
1160 1 62 ARG QB 1 64 ASP H 4.180 . 4.600 3.191 2.210 3.589 . 0 0 "[ . 1 . 2]" 1
1161 1 62 ARG QB 1 65 LEU H 4.470 . 4.920 3.152 2.329 3.651 . 0 0 "[ . 1 . 2]" 1
1162 1 62 ARG QB 1 65 LEU HB2 4.250 . 4.680 3.283 2.545 4.130 . 0 0 "[ . 1 . 2]" 1
1163 1 62 ARG QB 1 65 LEU MD1 4.580 . 5.040 2.465 2.039 3.315 . 0 0 "[ . 1 . 2]" 1
1164 1 62 ARG QB 1 65 LEU HG 4.510 . 4.960 2.418 1.854 3.188 . 0 0 "[ . 1 . 2]" 1
1165 1 62 ARG HB2 1 63 GLU H 5.230 . 5.750 4.245 2.327 4.589 . 0 0 "[ . 1 . 2]" 1
1166 1 62 ARG HB2 1 65 LEU HB2 4.950 . 5.440 3.886 3.317 5.003 . 0 0 "[ . 1 . 2]" 1
1167 1 62 ARG HB2 1 65 LEU HG 5.360 . 5.900 3.489 2.342 4.797 . 0 0 "[ . 1 . 2]" 1
1168 1 62 ARG HB3 1 63 GLU H 5.230 . 5.750 3.748 2.953 4.197 . 0 0 "[ . 1 . 2]" 1
1169 1 62 ARG HB3 1 65 LEU HB2 4.950 . 5.440 3.640 2.591 4.683 . 0 0 "[ . 1 . 2]" 1
1170 1 62 ARG HB3 1 65 LEU HG 5.360 . 5.900 2.490 1.893 3.237 . 0 0 "[ . 1 . 2]" 1
1171 1 63 GLU H 1 63 GLU QG 4.350 . 4.790 2.401 1.929 3.641 . 0 0 "[ . 1 . 2]" 1
1172 1 63 GLU H 1 64 ASP H 3.730 . 4.100 2.361 1.780 3.058 0.020 4 0 "[ . 1 . 2]" 1
1173 1 63 GLU H 1 65 LEU H 5.280 . 5.810 4.141 3.578 4.424 . 0 0 "[ . 1 . 2]" 1
1174 1 63 GLU HA 1 65 LEU H 4.960 . 5.460 3.666 3.193 4.578 . 0 0 "[ . 1 . 2]" 1
1175 1 63 GLU HG2 1 64 ASP H 6.200 . 6.820 5.071 4.157 5.878 . 0 0 "[ . 1 . 2]" 1
1176 1 63 GLU HG3 1 64 ASP H 6.200 . 6.820 4.554 4.038 5.290 . 0 0 "[ . 1 . 2]" 1
1177 1 64 ASP H 1 65 LEU H 3.560 . 3.920 2.475 2.123 2.728 . 0 0 "[ . 1 . 2]" 1
1178 1 64 ASP H 1 65 LEU HB2 4.910 . 5.400 4.635 4.087 4.948 . 0 0 "[ . 1 . 2]" 1
1179 1 64 ASP H 1 65 LEU HG 6.180 . 6.800 3.955 3.307 4.457 . 0 0 "[ . 1 . 2]" 1
1180 1 65 LEU H 1 65 LEU HB2 3.270 . 3.600 2.452 2.374 2.540 . 0 0 "[ . 1 . 2]" 1
1181 1 65 LEU H 1 65 LEU MD1 4.880 . 5.370 3.808 3.636 3.996 . 0 0 "[ . 1 . 2]" 1
1182 1 65 LEU H 1 65 LEU MD2 5.400 . 5.940 3.505 3.207 3.717 . 0 0 "[ . 1 . 2]" 1
1183 1 65 LEU H 1 65 LEU HG 4.310 . 4.740 2.613 2.240 2.932 . 0 0 "[ . 1 . 2]" 1
1184 1 65 LEU H 1 66 THR H 5.210 . 5.730 4.534 4.317 4.617 . 0 0 "[ . 1 . 2]" 1
1185 1 65 LEU HA 1 65 LEU MD2 3.540 . 3.890 1.968 1.914 2.039 . 0 0 "[ . 1 . 2]" 1
1186 1 65 LEU HA 1 66 THR H 3.360 . 3.700 2.288 2.110 2.530 . 0 0 "[ . 1 . 2]" 1
1187 1 65 LEU HA 1 69 GLN QB 4.900 . 5.390 3.776 3.108 4.489 . 0 0 "[ . 1 . 2]" 1
1188 1 65 LEU HA 1 69 GLN HE21 6.200 . 6.820 4.906 3.477 6.581 . 0 0 "[ . 1 . 2]" 1
1189 1 65 LEU HA 1 69 GLN QE 5.390 . 5.930 4.497 3.043 5.624 . 0 0 "[ . 1 . 2]" 1
1190 1 65 LEU HA 1 69 GLN HE22 6.200 . 6.820 5.523 3.361 6.904 0.084 15 0 "[ . 1 . 2]" 1
1191 1 65 LEU HA 1 69 GLN QG 5.620 . 6.180 4.545 2.981 6.194 0.014 3 0 "[ . 1 . 2]" 1
1192 1 65 LEU HA 1 70 CYS H 6.120 . 6.730 5.910 4.733 6.740 0.010 3 0 "[ . 1 . 2]" 1
1193 1 65 LEU HB2 1 66 THR H 6.200 . 6.820 3.851 3.346 4.342 . 0 0 "[ . 1 . 2]" 1
1194 1 65 LEU HB2 1 69 GLN QB 5.170 . 5.690 4.519 3.415 5.433 . 0 0 "[ . 1 . 2]" 1
1195 1 65 LEU HB2 1 70 CYS H 5.520 . 6.070 5.264 4.576 5.794 . 0 0 "[ . 1 . 2]" 1
1196 1 65 LEU HB2 1 70 CYS QB 6.000 . 6.600 3.932 2.662 5.377 . 0 0 "[ . 1 . 2]" 1
1197 1 65 LEU HB3 1 66 THR H 4.150 . 4.570 2.743 2.095 3.596 . 0 0 "[ . 1 . 2]" 1
1198 1 65 LEU HB3 1 69 GLN HB2 5.310 . 5.840 3.327 2.004 5.711 . 0 0 "[ . 1 . 2]" 1
1199 1 65 LEU HB3 1 69 GLN HB3 5.310 . 5.840 3.755 2.486 4.767 . 0 0 "[ . 1 . 2]" 1
1200 1 65 LEU HB3 1 69 GLN HG2 6.200 . 6.820 5.541 3.503 6.831 0.011 17 0 "[ . 1 . 2]" 1
1201 1 65 LEU HB3 1 69 GLN HG3 6.200 . 6.820 4.940 3.192 6.343 . 0 0 "[ . 1 . 2]" 1
1202 1 65 LEU MD1 1 70 CYS HA 5.080 . 5.590 3.728 2.832 4.638 . 0 0 "[ . 1 . 2]" 1
1203 1 65 LEU MD2 1 66 THR H 4.310 . 4.740 3.387 3.192 3.683 . 0 0 "[ . 1 . 2]" 1
1204 1 65 LEU MD2 1 69 GLN H 6.200 . 6.820 5.471 4.967 6.251 . 0 0 "[ . 1 . 2]" 1
1205 1 65 LEU MD2 1 69 GLN HA 5.940 . 6.530 5.336 4.615 6.337 . 0 0 "[ . 1 . 2]" 1
1206 1 65 LEU MD2 1 69 GLN HB2 4.870 . 5.360 3.581 2.969 5.303 . 0 0 "[ . 1 . 2]" 1
1207 1 65 LEU MD2 1 69 GLN HB3 4.870 . 5.360 3.227 2.450 4.169 . 0 0 "[ . 1 . 2]" 1
1208 1 65 LEU MD2 1 69 GLN HE21 5.160 . 5.680 3.956 2.298 5.143 . 0 0 "[ . 1 . 2]" 1
1209 1 65 LEU MD2 1 69 GLN QE 4.430 . 4.870 3.540 2.046 4.493 . 0 0 "[ . 1 . 2]" 1
1210 1 65 LEU MD2 1 69 GLN HE22 5.160 . 5.680 4.299 2.295 5.570 . 0 0 "[ . 1 . 2]" 1
1211 1 65 LEU MD2 1 69 GLN QG 5.180 . 5.700 3.819 2.050 5.141 . 0 0 "[ . 1 . 2]" 1
1212 1 65 LEU MD2 1 70 CYS HA 5.790 . 6.370 4.995 3.994 5.744 . 0 0 "[ . 1 . 2]" 1
1213 1 66 THR H 1 69 GLN H 4.560 . 5.020 3.760 3.291 4.195 . 0 0 "[ . 1 . 2]" 1
1214 1 66 THR H 1 69 GLN QB 3.530 . 3.880 2.470 1.942 3.020 . 0 0 "[ . 1 . 2]" 1
1215 1 66 THR H 1 69 GLN QE 5.980 . 6.580 3.883 2.045 5.382 . 0 0 "[ . 1 . 2]" 1
1216 1 66 THR H 1 69 GLN QG 4.210 . 4.630 3.358 2.228 4.489 . 0 0 "[ . 1 . 2]" 1
1217 1 66 THR HB 1 67 VAL H 3.740 . 4.110 2.923 2.139 3.872 . 0 0 "[ . 1 . 2]" 1
1218 1 66 THR HB 1 68 GLU H 4.190 . 4.610 3.090 2.481 4.626 0.016 19 0 "[ . 1 . 2]" 1
1219 1 66 THR HB 1 69 GLN H 5.040 . 5.540 3.308 2.175 4.863 . 0 0 "[ . 1 . 2]" 1
1220 1 67 VAL H 1 67 VAL HB 3.630 . 3.990 2.767 2.449 3.646 . 0 0 "[ . 1 . 2]" 1
1221 1 67 VAL H 1 67 VAL MG1 4.330 . 4.760 3.451 2.171 3.785 . 0 0 "[ . 1 . 2]" 1
1222 1 67 VAL H 1 67 VAL QG 3.400 . 3.740 1.991 1.855 2.116 . 0 0 "[ . 1 . 2]" 1
1223 1 67 VAL H 1 67 VAL MG2 4.330 . 4.760 2.032 1.874 2.128 . 0 0 "[ . 1 . 2]" 1
1224 1 67 VAL H 1 68 GLU H 4.110 . 4.520 2.725 2.568 2.909 . 0 0 "[ . 1 . 2]" 1
1225 1 67 VAL H 1 69 GLN H 5.170 . 5.690 4.215 3.911 4.552 . 0 0 "[ . 1 . 2]" 1
1226 1 67 VAL H 1 70 CYS H 6.150 . 6.770 4.891 4.676 5.187 . 0 0 "[ . 1 . 2]" 1
1227 1 67 VAL H 1 72 ILE MD 6.200 . 6.820 5.207 4.243 6.376 . 0 0 "[ . 1 . 2]" 1
1228 1 67 VAL HA 1 70 CYS H 4.660 . 5.130 3.557 3.129 3.933 . 0 0 "[ . 1 . 2]" 1
1229 1 67 VAL HA 1 70 CYS HB2 5.180 . 5.700 3.705 2.792 4.657 . 0 0 "[ . 1 . 2]" 1
1230 1 67 VAL HA 1 70 CYS QB 4.430 . 4.870 2.990 2.410 3.765 . 0 0 "[ . 1 . 2]" 1
1231 1 67 VAL HA 1 70 CYS HB3 5.180 . 5.700 3.651 2.464 5.562 . 0 0 "[ . 1 . 2]" 1
1232 1 67 VAL HA 1 72 ILE H 6.050 . 6.660 3.879 3.040 4.950 . 0 0 "[ . 1 . 2]" 1
1233 1 67 VAL HA 1 72 ILE HB 5.110 . 5.620 3.841 2.945 5.155 . 0 0 "[ . 1 . 2]" 1
1234 1 67 VAL HA 1 72 ILE MD 4.120 . 4.530 3.075 1.920 4.207 . 0 0 "[ . 1 . 2]" 1
1235 1 67 VAL HA 1 72 ILE QG 4.250 . 4.680 2.915 2.070 3.779 . 0 0 "[ . 1 . 2]" 1
1236 1 67 VAL HB 1 68 GLU H 3.840 . 4.220 2.894 2.448 4.047 . 0 0 "[ . 1 . 2]" 1
1237 1 67 VAL QG 1 68 GLU H 3.930 . 4.320 3.032 2.232 3.331 . 0 0 "[ . 1 . 2]" 1
1238 1 67 VAL QG 1 71 GLN H 5.740 . 6.310 4.435 3.923 5.131 . 0 0 "[ . 1 . 2]" 1
1239 1 67 VAL QG 1 72 ILE H 4.760 . 5.240 3.209 2.389 4.314 . 0 0 "[ . 1 . 2]" 1
1240 1 67 VAL QG 1 72 ILE HB 3.440 . 3.780 2.323 1.750 3.613 0.050 14 0 "[ . 1 . 2]" 1
1241 1 67 VAL QG 1 72 ILE MD 4.050 . 4.460 2.682 1.756 3.975 0.044 16 0 "[ . 1 . 2]" 1
1242 1 67 VAL MG1 1 68 GLU H 4.520 . 4.970 3.559 3.305 4.025 . 0 0 "[ . 1 . 2]" 1
1243 1 67 VAL MG1 1 72 ILE H 6.200 . 6.820 3.347 2.405 4.958 . 0 0 "[ . 1 . 2]" 1
1244 1 67 VAL MG2 1 68 GLU H 4.520 . 4.970 3.536 2.244 3.934 . 0 0 "[ . 1 . 2]" 1
1245 1 67 VAL MG2 1 72 ILE H 6.200 . 6.820 4.932 4.089 6.073 . 0 0 "[ . 1 . 2]" 1
1246 1 68 GLU H 1 68 GLU HB2 3.650 . 4.020 2.499 2.357 2.623 . 0 0 "[ . 1 . 2]" 1
1247 1 68 GLU H 1 68 GLU HB3 3.730 . 4.100 2.534 2.400 2.768 . 0 0 "[ . 1 . 2]" 1
1248 1 68 GLU HA 1 71 GLN H 5.120 . 5.630 3.575 3.197 4.032 . 0 0 "[ . 1 . 2]" 1
1249 1 68 GLU HA 1 71 GLN HA 5.270 . 5.800 3.749 3.266 4.550 . 0 0 "[ . 1 . 2]" 1
1250 1 68 GLU HB3 1 69 GLN H 3.970 . 4.370 2.679 2.377 3.098 . 0 0 "[ . 1 . 2]" 1
1251 1 68 GLU HB3 1 69 GLN HA 6.130 . 6.740 4.248 4.006 4.472 . 0 0 "[ . 1 . 2]" 1
1252 1 68 GLU HB3 1 69 GLN QB 6.000 . 6.600 4.428 3.639 4.800 . 0 0 "[ . 1 . 2]" 1
1253 1 68 GLU HB3 1 69 GLN HG2 6.200 . 6.820 4.246 3.233 6.540 . 0 0 "[ . 1 . 2]" 1
1254 1 68 GLU HB3 1 69 GLN HG3 6.200 . 6.820 4.424 2.958 6.464 . 0 0 "[ . 1 . 2]" 1
1255 1 68 GLU HG2 1 69 GLN H 5.460 . 6.010 3.903 3.552 4.325 . 0 0 "[ . 1 . 2]" 1
1256 1 68 GLU HG2 1 69 GLN HA 5.120 . 5.630 3.779 3.362 4.188 . 0 0 "[ . 1 . 2]" 1
1257 1 69 GLN H 1 69 GLN HB2 4.120 . 4.530 2.402 2.227 2.568 . 0 0 "[ . 1 . 2]" 1
1258 1 69 GLN H 1 69 GLN QB 3.310 . 3.640 2.347 2.155 2.515 . 0 0 "[ . 1 . 2]" 1
1259 1 69 GLN H 1 69 GLN HB3 4.120 . 4.530 3.458 2.571 3.637 . 0 0 "[ . 1 . 2]" 1
1260 1 69 GLN H 1 69 GLN HE21 6.200 . 6.820 4.663 3.577 5.611 . 0 0 "[ . 1 . 2]" 1
1261 1 69 GLN H 1 69 GLN HE22 6.200 . 6.820 5.748 5.147 6.244 . 0 0 "[ . 1 . 2]" 1
1262 1 69 GLN H 1 69 GLN HG2 5.400 . 5.940 3.290 2.229 4.542 . 0 0 "[ . 1 . 2]" 1
1263 1 69 GLN H 1 69 GLN QG 4.560 . 5.020 2.678 2.034 3.985 . 0 0 "[ . 1 . 2]" 1
1264 1 69 GLN H 1 69 GLN HG3 5.400 . 5.940 3.291 2.052 4.539 . 0 0 "[ . 1 . 2]" 1
1265 1 69 GLN HA 1 69 GLN HE22 6.200 . 6.820 5.040 3.401 5.970 . 0 0 "[ . 1 . 2]" 1
1266 1 69 GLN HA 1 69 GLN QG 3.580 . 3.940 2.545 2.304 2.929 . 0 0 "[ . 1 . 2]" 1
1267 1 69 GLN HA 1 71 GLN H 4.840 . 5.320 3.896 3.569 4.232 . 0 0 "[ . 1 . 2]" 1
1268 1 70 CYS H 1 70 CYS QB 3.370 . 3.710 2.375 2.252 2.557 . 0 0 "[ . 1 . 2]" 1
1269 1 70 CYS H 1 72 ILE H 4.830 . 5.310 4.229 3.573 4.828 . 0 0 "[ . 1 . 2]" 1
1270 1 70 CYS HA 1 71 GLN QG 5.190 . 5.710 4.135 3.810 4.555 . 0 0 "[ . 1 . 2]" 1
1271 1 70 CYS QB 1 71 GLN H 4.430 . 4.870 3.165 2.860 3.390 . 0 0 "[ . 1 . 2]" 1
1272 1 70 CYS QB 1 72 ILE H 4.690 . 5.160 3.375 2.934 4.191 . 0 0 "[ . 1 . 2]" 1
1273 1 70 CYS QB 1 72 ILE MD 4.410 . 4.850 2.690 2.294 3.222 . 0 0 "[ . 1 . 2]" 1
1274 1 70 CYS QB 1 72 ILE QG 3.900 . 4.290 2.168 1.804 3.006 . 0 0 "[ . 1 . 2]" 1
1275 1 70 CYS HB2 1 71 GLN H 5.120 . 5.630 3.870 2.928 4.308 . 0 0 "[ . 1 . 2]" 1
1276 1 70 CYS HB2 1 72 ILE H 5.360 . 5.900 4.525 3.012 5.920 0.020 18 0 "[ . 1 . 2]" 1
1277 1 70 CYS HB2 1 72 ILE MD 5.030 . 5.530 3.463 2.566 4.280 . 0 0 "[ . 1 . 2]" 1
1278 1 70 CYS HB3 1 71 GLN H 5.120 . 5.630 3.592 2.934 4.361 . 0 0 "[ . 1 . 2]" 1
1279 1 70 CYS HB3 1 72 ILE H 5.360 . 5.900 3.830 2.991 4.954 . 0 0 "[ . 1 . 2]" 1
1280 1 70 CYS HB3 1 72 ILE MD 5.030 . 5.530 2.922 2.485 4.003 . 0 0 "[ . 1 . 2]" 1
1281 1 71 GLN H 1 71 GLN QE 4.520 . 4.970 3.602 2.612 4.941 . 0 0 "[ . 1 . 2]" 1
1282 1 71 GLN H 1 71 GLN QG 3.660 . 4.030 2.848 2.700 3.046 . 0 0 "[ . 1 . 2]" 1
1283 1 71 GLN H 1 72 ILE H 3.790 . 4.170 2.843 2.626 3.109 . 0 0 "[ . 1 . 2]" 1
1284 1 71 GLN H 1 72 ILE QG 6.000 . 6.600 3.823 3.653 4.098 . 0 0 "[ . 1 . 2]" 1
1285 1 71 GLN HA 1 71 GLN HE22 6.200 . 6.820 4.156 3.128 6.008 . 0 0 "[ . 1 . 2]" 1
1286 1 71 GLN QG 1 72 ILE H 5.460 . 6.010 4.713 4.482 4.916 . 0 0 "[ . 1 . 2]" 1
1287 1 72 ILE H 1 72 ILE HB 3.250 . 3.580 2.527 2.468 2.574 . 0 0 "[ . 1 . 2]" 1
1288 1 72 ILE H 1 72 ILE MD 4.710 . 5.180 3.524 3.233 3.726 . 0 0 "[ . 1 . 2]" 1
1289 1 72 ILE H 1 72 ILE QG 3.800 . 4.180 2.212 2.068 2.389 . 0 0 "[ . 1 . 2]" 1
1290 1 72 ILE H 1 72 ILE MG 3.880 . 4.270 3.781 3.767 3.796 . 0 0 "[ . 1 . 2]" 1
1291 1 72 ILE H 1 73 VAL H 5.020 . 5.520 4.331 4.146 4.515 . 0 0 "[ . 1 . 2]" 1
1292 1 72 ILE HA 1 72 ILE QG 3.650 . 4.020 2.599 2.362 2.984 . 0 0 "[ . 1 . 2]" 1
1293 1 72 ILE HA 1 73 VAL H 3.290 . 3.620 2.149 2.090 2.220 . 0 0 "[ . 1 . 2]" 1
1294 1 72 ILE HA 1 73 VAL HA 4.830 . 5.310 4.401 4.370 4.452 . 0 0 "[ . 1 . 2]" 1
1295 1 72 ILE HB 1 73 VAL H 5.070 . 5.580 4.349 4.172 4.433 . 0 0 "[ . 1 . 2]" 1
1296 1 72 ILE MD 1 72 ILE MG 3.600 . 3.960 1.954 1.903 2.033 . 0 0 "[ . 1 . 2]" 1
1297 1 72 ILE MD 1 73 VAL H 5.640 . 6.200 4.763 3.557 5.528 . 0 0 "[ . 1 . 2]" 1
1298 1 72 ILE MG 1 73 VAL H 4.070 . 4.480 3.080 2.632 3.416 . 0 0 "[ . 1 . 2]" 1
1299 1 72 ILE MG 1 73 VAL MG1 4.570 . 5.030 4.594 4.359 4.876 . 0 0 "[ . 1 . 2]" 1
1300 1 72 ILE MG 1 74 PRO QD 5.240 . 5.760 4.418 4.174 4.810 . 0 0 "[ . 1 . 2]" 1
1301 1 72 ILE MG 1 76 SER H 5.800 . 6.380 5.228 4.562 6.225 . 0 0 "[ . 1 . 2]" 1
1302 1 72 ILE MG 1 76 SER QB 5.540 . 6.090 4.238 3.209 5.199 . 0 0 "[ . 1 . 2]" 1
1303 1 73 VAL H 1 73 VAL MG2 3.500 . 3.850 1.968 1.839 2.160 . 0 0 "[ . 1 . 2]" 1
1304 1 73 VAL H 1 76 SER QB 4.940 . 5.430 3.847 2.775 4.954 . 0 0 "[ . 1 . 2]" 1
1305 1 73 VAL HA 1 75 THR H 4.040 . 4.440 3.953 3.701 4.421 . 0 0 "[ . 1 . 2]" 1
1306 1 73 VAL HA 1 76 SER QB 6.000 . 6.600 5.567 4.703 6.583 . 0 0 "[ . 1 . 2]" 1
1307 1 73 VAL HB 1 74 PRO HD2 4.280 . 4.710 2.418 1.788 3.140 0.012 14 0 "[ . 1 . 2]" 1
1308 1 73 VAL HB 1 74 PRO QD 3.650 . 4.020 2.349 1.781 2.946 0.019 14 0 "[ . 1 . 2]" 1
1309 1 73 VAL HB 1 74 PRO HD3 4.280 . 4.710 3.434 2.847 3.845 . 0 0 "[ . 1 . 2]" 1
1310 1 73 VAL HB 1 75 THR H 4.560 . 5.020 2.660 2.500 3.270 . 0 0 "[ . 1 . 2]" 1
1311 1 73 VAL HB 1 75 THR MG 6.200 . 6.820 3.242 1.863 5.062 . 0 0 "[ . 1 . 2]" 1
1312 1 73 VAL HB 1 76 SER H 6.200 . 6.820 4.488 3.834 5.894 . 0 0 "[ . 1 . 2]" 1
1313 1 73 VAL MG1 1 74 PRO HD2 5.110 . 5.620 3.310 2.928 3.720 . 0 0 "[ . 1 . 2]" 1
1314 1 73 VAL MG1 1 74 PRO HD3 5.110 . 5.620 3.593 3.060 3.965 . 0 0 "[ . 1 . 2]" 1
1315 1 73 VAL MG2 1 74 PRO HA 5.630 . 6.190 4.640 4.382 4.811 . 0 0 "[ . 1 . 2]" 1
1316 1 73 VAL MG2 1 74 PRO QD 5.410 . 5.950 3.653 3.355 3.947 . 0 0 "[ . 1 . 2]" 1
1317 1 73 VAL MG2 1 75 THR H 3.590 . 3.950 2.680 2.337 3.196 . 0 0 "[ . 1 . 2]" 1
1318 1 73 VAL MG2 1 76 SER H 3.750 . 4.130 2.877 1.970 4.153 0.023 4 0 "[ . 1 . 2]" 1
1319 1 73 VAL MG2 1 76 SER HB2 5.680 . 6.250 3.264 1.807 4.632 . 0 0 "[ . 1 . 2]" 1
1320 1 73 VAL MG2 1 76 SER QB 4.920 . 5.410 2.722 1.791 3.541 0.009 12 0 "[ . 1 . 2]" 1
1321 1 73 VAL MG2 1 76 SER HB3 5.680 . 6.250 3.358 2.360 4.386 . 0 0 "[ . 1 . 2]" 1
1322 1 74 PRO HA 1 76 SER H 5.610 . 6.170 3.677 3.281 4.272 . 0 0 "[ . 1 . 2]" 1
1323 1 74 PRO QB 1 75 THR MG 4.850 . 5.330 4.327 3.204 5.348 0.018 3 0 "[ . 1 . 2]" 1
1324 1 74 PRO QD 1 75 THR H 4.500 . 4.950 2.839 2.571 3.679 . 0 0 "[ . 1 . 2]" 1
1325 1 75 THR H 1 75 THR MG 3.840 . 4.220 2.525 1.882 3.779 . 0 0 "[ . 1 . 2]" 1
1326 1 75 THR H 1 76 SER H 3.640 . 4.000 2.579 1.795 3.787 0.005 2 0 "[ . 1 . 2]" 1
1327 1 75 THR HA 1 75 THR MG 3.400 . 3.740 2.726 2.181 3.219 . 0 0 "[ . 1 . 2]" 1
1328 1 75 THR MG 1 76 SER H 3.910 . 4.300 3.660 2.507 4.366 0.066 5 0 "[ . 1 . 2]" 1
1329 1 76 SER H 1 78 ILE QG 6.000 . 6.600 4.334 3.448 5.668 . 0 0 "[ . 1 . 2]" 1
1330 1 76 SER HA 1 77 ASP H 3.380 . 3.720 2.347 2.130 2.736 . 0 0 "[ . 1 . 2]" 1
1331 1 76 SER QB 1 77 ASP H 3.870 . 4.260 2.914 2.350 3.737 . 0 0 "[ . 1 . 2]" 1
1332 1 76 SER QB 1 77 ASP HA 6.000 . 6.600 4.581 4.288 4.872 . 0 0 "[ . 1 . 2]" 1
1333 1 76 SER QB 1 78 ILE QG 5.320 . 5.850 3.155 2.501 3.884 . 0 0 "[ . 1 . 2]" 1
1334 1 76 SER HB2 1 77 ASP H 4.660 . 5.130 3.489 2.375 4.328 . 0 0 "[ . 1 . 2]" 1
1335 1 76 SER HB3 1 77 ASP H 4.660 . 5.130 3.433 2.440 4.318 . 0 0 "[ . 1 . 2]" 1
1336 1 77 ASP H 1 77 ASP QB 3.620 . 3.980 2.309 2.229 2.697 . 0 0 "[ . 1 . 2]" 1
1337 1 77 ASP HA 1 78 ILE H 3.200 . 3.520 2.172 2.124 2.321 . 0 0 "[ . 1 . 2]" 1
1338 1 77 ASP HB2 1 78 ILE H 5.310 . 5.840 4.429 4.133 4.586 . 0 0 "[ . 1 . 2]" 1
1339 1 77 ASP HB3 1 78 ILE H 5.310 . 5.840 4.380 4.188 4.476 . 0 0 "[ . 1 . 2]" 1
1340 1 78 ILE H 1 78 ILE HB 3.760 . 4.140 2.629 2.533 2.833 . 0 0 "[ . 1 . 2]" 1
1341 1 78 ILE H 1 78 ILE MD 4.980 . 5.480 3.798 2.176 4.187 . 0 0 "[ . 1 . 2]" 1
1342 1 78 ILE H 1 78 ILE HG12 4.730 . 5.200 3.804 3.532 4.237 . 0 0 "[ . 1 . 2]" 1
1343 1 78 ILE H 1 78 ILE QG 4.030 . 4.430 2.596 2.256 3.412 . 0 0 "[ . 1 . 2]" 1
1344 1 78 ILE H 1 78 ILE HG13 4.730 . 5.200 2.647 2.282 3.598 . 0 0 "[ . 1 . 2]" 1
1345 1 78 ILE H 1 79 GLN H 4.840 . 5.320 4.193 3.950 4.434 . 0 0 "[ . 1 . 2]" 1
1346 1 78 ILE HA 1 79 GLN H 3.210 . 3.530 2.150 2.115 2.179 . 0 0 "[ . 1 . 2]" 1
1347 1 78 ILE QG 1 79 GLN H 4.510 . 4.960 4.290 4.107 4.373 . 0 0 "[ . 1 . 2]" 1
1348 1 78 ILE MG 1 79 GLN H 3.770 . 4.150 3.069 2.488 3.317 . 0 0 "[ . 1 . 2]" 1
1349 1 78 ILE MG 1 79 GLN HA 5.390 . 5.930 3.743 3.334 4.022 . 0 0 "[ . 1 . 2]" 1
1350 1 79 GLN HA 1 80 LEU H 3.340 . 3.670 2.217 2.134 2.366 . 0 0 "[ . 1 . 2]" 1
1351 1 79 GLN HA 1 80 LEU HG 5.480 . 6.030 4.012 3.769 4.283 . 0 0 "[ . 1 . 2]" 1
1352 1 79 GLN QB 1 80 LEU H 4.190 . 4.610 3.205 2.449 3.851 . 0 0 "[ . 1 . 2]" 1
1353 1 80 LEU H 1 80 LEU QB 3.600 . 3.960 2.429 2.355 2.522 . 0 0 "[ . 1 . 2]" 1
1354 1 80 LEU H 1 80 LEU HG 4.480 . 4.930 2.881 2.436 3.431 . 0 0 "[ . 1 . 2]" 1
1355 1 80 LEU HA 1 80 LEU MD2 3.760 . 4.140 1.959 1.833 2.105 . 0 0 "[ . 1 . 2]" 1
1356 1 80 LEU HA 1 81 GLU H 3.320 . 3.650 2.155 2.116 2.266 . 0 0 "[ . 1 . 2]" 1
1357 1 80 LEU MD2 1 81 GLU H 3.900 . 4.290 3.587 3.097 3.880 . 0 0 "[ . 1 . 2]" 1
1358 1 81 GLU HA 1 82 VAL H 3.250 . 3.580 2.181 2.123 2.695 . 0 0 "[ . 1 . 2]" 1
1359 1 81 GLU QG 1 82 VAL H 4.210 . 4.630 3.108 2.491 3.473 . 0 0 "[ . 1 . 2]" 1
1360 1 81 GLU HG2 1 82 VAL H 4.920 . 5.410 3.434 2.642 3.881 . 0 0 "[ . 1 . 2]" 1
1361 1 81 GLU HG3 1 82 VAL H 4.920 . 5.410 3.593 3.001 4.514 . 0 0 "[ . 1 . 2]" 1
1362 1 82 VAL H 1 82 VAL HB 3.550 . 3.900 2.681 2.519 3.089 . 0 0 "[ . 1 . 2]" 1
1363 1 82 VAL H 1 83 SER H 4.920 . 5.410 4.373 4.224 4.519 . 0 0 "[ . 1 . 2]" 1
1364 1 82 VAL HA 1 83 SER H 3.090 . 3.400 2.126 2.081 2.163 . 0 0 "[ . 1 . 2]" 1
1365 1 82 VAL HA 1 83 SER QB 4.110 . 4.520 4.190 4.026 4.571 0.051 14 0 "[ . 1 . 2]" 1
1366 1 82 VAL HB 1 83 SER H 4.900 . 5.390 4.289 4.148 4.391 . 0 0 "[ . 1 . 2]" 1
1367 1 82 VAL QG 1 83 SER H 3.730 . 4.100 2.919 2.511 3.125 . 0 0 "[ . 1 . 2]" 1
1368 1 82 VAL QG 1 83 SER HA 5.520 . 6.070 3.813 3.181 4.131 . 0 0 "[ . 1 . 2]" 1
1369 1 83 SER H 1 83 SER QB 3.650 . 4.020 2.402 2.207 2.816 . 0 0 "[ . 1 . 2]" 1
1370 1 83 SER H 1 84 SER H 5.290 . 5.820 4.354 3.955 4.591 . 0 0 "[ . 1 . 2]" 1
1371 1 83 SER HA 1 84 SER H 3.000 . 3.300 2.286 2.119 2.697 . 0 0 "[ . 1 . 2]" 1
1372 1 83 SER QB 1 84 SER H 4.160 . 4.580 3.465 2.008 4.044 . 0 0 "[ . 1 . 2]" 1
1373 1 84 SER H 1 84 SER QB 3.630 . 3.990 2.634 2.436 3.330 . 0 0 "[ . 1 . 2]" 1
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