NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
425511 |
2gle   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2gle
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 2082
_Distance_constraint_stats_list.Viol_count 3959
_Distance_constraint_stats_list.Viol_total 3220.834
_Distance_constraint_stats_list.Viol_max 0.306
_Distance_constraint_stats_list.Viol_rms 0.0170
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0039
_Distance_constraint_stats_list.Viol_average_violations_only 0.0407
_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 2 HIS 0.718 0.093 18 0 "[ . 1 . 2]"
1 3 MET 1.491 0.090 1 0 "[ . 1 . 2]"
1 4 VAL 8.876 0.306 19 0 "[ . 1 . 2]"
1 5 HIS 6.064 0.182 15 0 "[ . 1 . 2]"
1 6 GLU 1.112 0.066 18 0 "[ . 1 . 2]"
1 7 TRP 5.226 0.103 19 0 "[ . 1 . 2]"
1 8 SER 3.908 0.150 16 0 "[ . 1 . 2]"
1 9 VAL 5.108 0.158 7 0 "[ . 1 . 2]"
1 10 GLN 3.111 0.158 7 0 "[ . 1 . 2]"
1 11 GLN 3.944 0.155 17 0 "[ . 1 . 2]"
1 12 VAL 5.030 0.119 13 0 "[ . 1 . 2]"
1 13 SER 5.925 0.273 17 0 "[ . 1 . 2]"
1 14 HIS 1.621 0.180 13 0 "[ . 1 . 2]"
1 15 TRP 6.979 0.156 8 0 "[ . 1 . 2]"
1 16 LEU 4.459 0.113 2 0 "[ . 1 . 2]"
1 17 VAL 3.984 0.163 11 0 "[ . 1 . 2]"
1 18 GLY 2.351 0.133 11 0 "[ . 1 . 2]"
1 19 LEU 7.309 0.150 20 0 "[ . 1 . 2]"
1 20 SER 1.497 0.100 20 0 "[ . 1 . 2]"
1 21 LEU 7.086 0.167 14 0 "[ . 1 . 2]"
1 22 ASP 3.412 0.163 11 0 "[ . 1 . 2]"
1 23 GLN 6.808 0.167 14 0 "[ . 1 . 2]"
1 24 TYR 8.150 0.111 15 0 "[ . 1 . 2]"
1 25 VAL 8.810 0.273 17 0 "[ . 1 . 2]"
1 26 SER 0.905 0.104 20 0 "[ . 1 . 2]"
1 27 GLU 0.696 0.074 9 0 "[ . 1 . 2]"
1 28 PHE 3.330 0.098 15 0 "[ . 1 . 2]"
1 29 SER 1.395 0.074 9 0 "[ . 1 . 2]"
1 30 ALA 1.373 0.068 15 0 "[ . 1 . 2]"
1 31 GLN 5.125 0.129 8 0 "[ . 1 . 2]"
1 32 ASN 3.278 0.065 13 0 "[ . 1 . 2]"
1 33 ILE 4.318 0.129 8 0 "[ . 1 . 2]"
1 34 SER 1.992 0.103 19 0 "[ . 1 . 2]"
1 35 GLY 1.622 0.098 11 0 "[ . 1 . 2]"
1 36 GLU 1.219 0.111 20 0 "[ . 1 . 2]"
1 37 GLN 5.920 0.098 11 0 "[ . 1 . 2]"
1 38 LEU 4.547 0.119 13 0 "[ . 1 . 2]"
1 39 LEU 8.995 0.212 8 0 "[ . 1 . 2]"
1 40 GLN 5.575 0.170 9 0 "[ . 1 . 2]"
1 41 LEU 7.814 0.201 7 0 "[ . 1 . 2]"
1 42 ASP 0.217 0.044 1 0 "[ . 1 . 2]"
1 43 GLY 3.281 0.120 9 0 "[ . 1 . 2]"
1 44 ASN 4.125 0.141 14 0 "[ . 1 . 2]"
1 45 LYS 6.537 0.141 14 0 "[ . 1 . 2]"
1 46 LEU 1.815 0.094 20 0 "[ . 1 . 2]"
1 47 LYS 3.514 0.126 19 0 "[ . 1 . 2]"
1 48 ALA 0.541 0.081 7 0 "[ . 1 . 2]"
1 49 LEU 3.602 0.111 15 0 "[ . 1 . 2]"
1 50 GLY 0.089 0.038 15 0 "[ . 1 . 2]"
1 51 MET 4.429 0.192 10 0 "[ . 1 . 2]"
1 52 THR 5.900 0.192 10 0 "[ . 1 . 2]"
1 53 SER 3.464 0.140 19 0 "[ . 1 . 2]"
1 54 SER 0.383 0.064 8 0 "[ . 1 . 2]"
1 55 GLN 3.676 0.158 16 0 "[ . 1 . 2]"
1 56 ASP 2.235 0.114 11 0 "[ . 1 . 2]"
1 57 ARG 2.603 0.175 5 0 "[ . 1 . 2]"
1 58 ALA 1.621 0.079 11 0 "[ . 1 . 2]"
1 59 LEU 7.033 0.249 2 0 "[ . 1 . 2]"
1 60 VAL 10.206 0.175 5 0 "[ . 1 . 2]"
1 61 LYS 6.316 0.211 3 0 "[ . 1 . 2]"
1 62 LYS 4.015 0.165 8 0 "[ . 1 . 2]"
1 63 LYS 13.994 0.249 2 0 "[ . 1 . 2]"
1 64 LEU 4.121 0.103 8 0 "[ . 1 . 2]"
1 65 LYS 3.343 0.086 13 0 "[ . 1 . 2]"
1 66 GLU 3.422 0.245 4 0 "[ . 1 . 2]"
1 67 MET 4.845 0.245 4 0 "[ . 1 . 2]"
1 68 LYS 5.395 0.155 15 0 "[ . 1 . 2]"
1 69 MET 0.651 0.099 2 0 "[ . 1 . 2]"
1 70 SER 1.783 0.134 4 0 "[ . 1 . 2]"
1 71 LEU 4.232 0.212 8 0 "[ . 1 . 2]"
1 72 GLU 6.571 0.306 19 0 "[ . 1 . 2]"
1 73 LYS 3.265 0.161 10 0 "[ . 1 . 2]"
1 74 ALA 0.949 0.161 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 2 HIS HA 1 3 MET H 3.470 . 3.470 3.282 3.018 3.513 0.043 18 0 "[ . 1 . 2]" 1
2 1 2 HIS HA 1 7 TRP HD1 5.500 . 5.500 4.348 3.531 5.084 . 0 0 "[ . 1 . 2]" 1
3 1 2 HIS HA 1 7 TRP HE1 3.970 . 3.970 3.264 2.575 3.996 0.026 5 0 "[ . 1 . 2]" 1
4 1 2 HIS QB 1 2 HIS HD2 3.410 . 3.410 2.750 2.619 2.948 . 0 0 "[ . 1 . 2]" 1
5 1 2 HIS QB 1 3 MET H 4.000 . 4.000 3.794 2.358 4.043 0.043 13 0 "[ . 1 . 2]" 1
6 1 2 HIS QB 1 7 TRP HE1 4.870 . 4.870 4.008 3.190 4.640 . 0 0 "[ . 1 . 2]" 1
7 1 2 HIS QB 1 7 TRP HZ2 5.500 . 5.500 4.966 4.127 5.593 0.093 18 0 "[ . 1 . 2]" 1
8 1 2 HIS HD2 1 3 MET QG 5.340 . 5.340 4.175 2.180 5.204 . 0 0 "[ . 1 . 2]" 1
9 1 2 HIS HE1 1 3 MET HA 5.350 . 5.350 5.207 4.413 5.415 0.065 1 0 "[ . 1 . 2]" 1
10 1 2 HIS HE1 1 3 MET HG2 5.500 . 5.500 4.403 3.022 5.554 0.054 17 0 "[ . 1 . 2]" 1
11 1 2 HIS HE1 1 3 MET HG3 5.500 . 5.500 4.237 2.832 5.516 0.016 3 0 "[ . 1 . 2]" 1
12 1 3 MET H 1 3 MET HB2 3.190 . 3.190 2.465 2.326 2.604 . 0 0 "[ . 1 . 2]" 1
13 1 3 MET H 1 3 MET HB3 4.030 . 4.030 3.615 3.529 3.675 . 0 0 "[ . 1 . 2]" 1
14 1 3 MET H 1 3 MET HG2 3.790 . 3.790 3.523 2.407 3.880 0.090 1 0 "[ . 1 . 2]" 1
15 1 3 MET H 1 3 MET QG 3.250 . 3.250 2.631 2.300 3.269 0.019 1 0 "[ . 1 . 2]" 1
16 1 3 MET H 1 3 MET HG3 3.790 . 3.790 2.895 2.331 3.811 0.021 9 0 "[ . 1 . 2]" 1
17 1 3 MET H 1 4 VAL H 4.630 . 4.630 4.557 4.434 4.649 0.019 3 0 "[ . 1 . 2]" 1
18 1 3 MET H 1 6 GLU H 4.760 . 4.760 4.471 4.209 4.782 0.022 2 0 "[ . 1 . 2]" 1
19 1 3 MET H 1 6 GLU HB2 4.460 . 4.460 3.339 2.723 3.840 . 0 0 "[ . 1 . 2]" 1
20 1 3 MET H 1 6 GLU HG2 4.820 . 4.820 4.069 3.343 4.826 0.006 13 0 "[ . 1 . 2]" 1
21 1 3 MET H 1 6 GLU QG 4.190 . 4.190 3.003 2.368 3.537 . 0 0 "[ . 1 . 2]" 1
22 1 3 MET H 1 6 GLU HG3 4.820 . 4.820 3.098 2.422 3.638 . 0 0 "[ . 1 . 2]" 1
23 1 3 MET HA 1 3 MET HG2 3.900 . 3.900 2.796 2.361 3.770 . 0 0 "[ . 1 . 2]" 1
24 1 3 MET HA 1 3 MET QG 3.310 . 3.310 2.468 2.260 2.999 . 0 0 "[ . 1 . 2]" 1
25 1 3 MET HA 1 3 MET HG3 3.900 . 3.900 3.040 2.418 3.784 . 0 0 "[ . 1 . 2]" 1
26 1 3 MET HA 1 4 VAL H 2.700 . 2.700 2.449 2.284 2.612 . 0 0 "[ . 1 . 2]" 1
27 1 3 MET HA 1 4 VAL HA 5.440 . 5.440 4.107 3.991 4.188 . 0 0 "[ . 1 . 2]" 1
28 1 3 MET HA 1 4 VAL MG1 4.550 . 4.550 3.295 3.017 3.604 . 0 0 "[ . 1 . 2]" 1
29 1 3 MET HA 1 5 HIS H 4.900 . 4.900 4.450 4.256 4.573 . 0 0 "[ . 1 . 2]" 1
30 1 3 MET HA 1 5 HIS HE1 5.080 . 5.080 4.956 4.602 5.107 0.027 17 0 "[ . 1 . 2]" 1
31 1 3 MET HA 1 6 GLU QG 4.820 . 4.820 4.653 4.328 4.855 0.035 13 0 "[ . 1 . 2]" 1
32 1 3 MET HA 1 7 TRP HE1 4.910 . 4.910 4.284 3.729 4.652 . 0 0 "[ . 1 . 2]" 1
33 1 3 MET HA 1 7 TRP HZ2 5.500 . 5.500 4.568 4.229 5.060 . 0 0 "[ . 1 . 2]" 1
34 1 3 MET HA 1 71 LEU MD1 5.500 . 5.500 2.359 1.838 4.656 . 0 0 "[ . 1 . 2]" 1
35 1 3 MET HA 1 71 LEU QD 4.160 . 4.160 2.062 1.814 2.823 . 0 0 "[ . 1 . 2]" 1
36 1 3 MET HA 1 71 LEU MD2 5.500 . 5.500 3.081 1.913 3.961 . 0 0 "[ . 1 . 2]" 1
37 1 3 MET HB2 1 4 VAL H 3.610 . 3.610 3.544 3.242 3.689 0.079 9 0 "[ . 1 . 2]" 1
38 1 3 MET HB2 1 5 HIS H 3.880 . 3.880 3.659 3.349 3.887 0.007 18 0 "[ . 1 . 2]" 1
39 1 3 MET HB2 1 5 HIS HE1 3.410 . 3.410 2.996 2.420 3.421 0.011 15 0 "[ . 1 . 2]" 1
40 1 3 MET HB3 1 4 VAL H 3.030 . 3.030 2.328 2.051 2.562 . 0 0 "[ . 1 . 2]" 1
41 1 3 MET HB3 1 4 VAL MG1 4.550 . 4.550 3.860 3.409 4.214 . 0 0 "[ . 1 . 2]" 1
42 1 3 MET HB3 1 5 HIS H 3.320 . 3.320 3.134 2.794 3.326 0.006 17 0 "[ . 1 . 2]" 1
43 1 3 MET HB3 1 5 HIS HE1 3.300 . 3.300 2.560 2.398 2.841 . 0 0 "[ . 1 . 2]" 1
44 1 3 MET QG 1 4 VAL H 4.270 . 4.270 3.835 3.516 4.320 0.050 14 0 "[ . 1 . 2]" 1
45 1 3 MET QG 1 5 HIS H 5.340 . 5.340 4.995 4.786 5.183 . 0 0 "[ . 1 . 2]" 1
46 1 3 MET QG 1 5 HIS HE1 3.710 . 3.710 3.314 2.418 3.739 0.029 6 0 "[ . 1 . 2]" 1
47 1 3 MET HG2 1 4 VAL H 4.880 . 4.880 4.172 3.646 4.894 0.014 14 0 "[ . 1 . 2]" 1
48 1 3 MET HG2 1 5 HIS HE1 4.410 . 4.410 3.799 2.440 4.445 0.035 3 0 "[ . 1 . 2]" 1
49 1 3 MET HG3 1 4 VAL H 4.880 . 4.880 4.639 4.052 4.872 . 0 0 "[ . 1 . 2]" 1
50 1 3 MET HG3 1 5 HIS HE1 4.410 . 4.410 3.965 2.555 4.429 0.019 20 0 "[ . 1 . 2]" 1
51 1 4 VAL H 1 4 VAL HB 3.690 . 3.690 3.648 3.599 3.693 0.003 1 0 "[ . 1 . 2]" 1
52 1 4 VAL H 1 4 VAL MG1 2.590 . 2.590 1.887 1.788 2.059 0.012 5 0 "[ . 1 . 2]" 1
53 1 4 VAL H 1 4 VAL MG2 2.770 . 2.770 2.320 2.179 2.533 . 0 0 "[ . 1 . 2]" 1
54 1 4 VAL H 1 5 HIS H 5.500 . 5.500 2.594 2.449 2.678 . 0 0 "[ . 1 . 2]" 1
55 1 4 VAL H 1 5 HIS HB3 5.180 . 5.180 5.166 4.984 5.214 0.034 10 0 "[ . 1 . 2]" 1
56 1 4 VAL H 1 7 TRP HE1 5.500 . 5.500 5.124 4.776 5.403 . 0 0 "[ . 1 . 2]" 1
57 1 4 VAL H 1 39 LEU QD 5.080 . 5.080 4.199 3.916 4.406 . 0 0 "[ . 1 . 2]" 1
58 1 4 VAL H 1 71 LEU MD1 4.890 . 4.890 3.173 2.210 4.204 . 0 0 "[ . 1 . 2]" 1
59 1 4 VAL H 1 71 LEU QD 4.210 . 4.210 2.171 1.879 2.497 . 0 0 "[ . 1 . 2]" 1
60 1 4 VAL H 1 71 LEU MD2 4.890 . 4.890 2.253 1.888 2.761 . 0 0 "[ . 1 . 2]" 1
61 1 4 VAL HA 1 4 VAL MG1 2.620 . 2.620 2.400 2.319 2.463 . 0 0 "[ . 1 . 2]" 1
62 1 4 VAL HA 1 6 GLU H 3.950 . 3.950 3.503 3.388 3.598 . 0 0 "[ . 1 . 2]" 1
63 1 4 VAL HA 1 7 TRP H 3.510 . 3.510 3.302 3.122 3.531 0.021 19 0 "[ . 1 . 2]" 1
64 1 4 VAL HA 1 7 TRP QB 4.260 . 4.260 3.199 3.042 3.381 . 0 0 "[ . 1 . 2]" 1
65 1 4 VAL HA 1 7 TRP HD1 4.100 . 4.100 3.883 3.627 4.107 0.007 19 0 "[ . 1 . 2]" 1
66 1 4 VAL HA 1 7 TRP HE1 3.770 . 3.770 3.749 3.537 3.831 0.061 19 0 "[ . 1 . 2]" 1
67 1 4 VAL HA 1 7 TRP HH2 5.500 . 5.500 4.609 4.287 4.872 . 0 0 "[ . 1 . 2]" 1
68 1 4 VAL HA 1 7 TRP HZ2 4.510 . 4.510 4.081 3.910 4.252 . 0 0 "[ . 1 . 2]" 1
69 1 4 VAL HA 1 39 LEU QD 5.440 . 5.440 4.988 4.925 5.133 . 0 0 "[ . 1 . 2]" 1
70 1 4 VAL HA 1 71 LEU HB2 5.500 . 5.500 4.492 3.894 4.972 . 0 0 "[ . 1 . 2]" 1
71 1 4 VAL HB 1 5 HIS H 4.080 . 4.080 4.037 3.907 4.106 0.026 18 0 "[ . 1 . 2]" 1
72 1 4 VAL HB 1 7 TRP QB 4.300 . 4.300 3.908 3.751 4.112 . 0 0 "[ . 1 . 2]" 1
73 1 4 VAL HB 1 7 TRP HH2 4.640 . 4.640 4.623 4.250 4.691 0.051 4 0 "[ . 1 . 2]" 1
74 1 4 VAL HB 1 7 TRP HZ3 3.720 . 3.720 3.582 3.258 3.725 0.005 11 0 "[ . 1 . 2]" 1
75 1 4 VAL HB 1 35 GLY HA2 4.500 . 4.500 2.868 2.599 3.125 . 0 0 "[ . 1 . 2]" 1
76 1 4 VAL HB 1 38 LEU MD1 4.200 . 4.200 2.473 2.015 2.806 . 0 0 "[ . 1 . 2]" 1
77 1 4 VAL HB 1 39 LEU QD 4.310 . 4.310 3.795 3.676 3.937 . 0 0 "[ . 1 . 2]" 1
78 1 4 VAL MG1 1 5 HIS HE1 5.500 . 5.500 5.615 5.560 5.672 0.172 16 0 "[ . 1 . 2]" 1
79 1 4 VAL MG1 1 7 TRP QB 4.900 . 4.900 4.531 4.399 4.728 . 0 0 "[ . 1 . 2]" 1
80 1 4 VAL MG1 1 7 TRP HE3 4.950 . 4.950 3.700 3.559 3.937 . 0 0 "[ . 1 . 2]" 1
81 1 4 VAL MG1 1 7 TRP HH2 3.800 . 3.800 2.685 2.529 2.818 . 0 0 "[ . 1 . 2]" 1
82 1 4 VAL MG1 1 7 TRP HZ2 3.440 . 3.440 3.155 3.017 3.416 . 0 0 "[ . 1 . 2]" 1
83 1 4 VAL MG1 1 7 TRP HZ3 3.590 . 3.590 3.000 2.848 3.202 . 0 0 "[ . 1 . 2]" 1
84 1 4 VAL MG1 1 12 VAL HA 5.500 . 5.500 5.218 4.878 5.508 0.008 1 0 "[ . 1 . 2]" 1
85 1 4 VAL MG1 1 12 VAL MG2 5.500 . 5.500 4.908 4.710 5.178 . 0 0 "[ . 1 . 2]" 1
86 1 4 VAL MG1 1 35 GLY HA2 4.570 . 4.570 4.326 4.007 4.521 . 0 0 "[ . 1 . 2]" 1
87 1 4 VAL MG1 1 35 GLY HA3 5.500 . 5.500 4.160 3.762 4.365 . 0 0 "[ . 1 . 2]" 1
88 1 4 VAL MG1 1 38 LEU HB2 5.500 . 5.500 5.380 5.091 5.544 0.044 14 0 "[ . 1 . 2]" 1
89 1 4 VAL MG1 1 38 LEU HB3 4.700 . 4.700 4.512 4.157 4.717 0.017 1 0 "[ . 1 . 2]" 1
90 1 4 VAL MG1 1 38 LEU MD1 3.560 . 3.560 2.910 2.577 3.173 . 0 0 "[ . 1 . 2]" 1
91 1 4 VAL MG1 1 39 LEU QD 3.360 . 3.360 3.186 3.028 3.395 0.035 10 0 "[ . 1 . 2]" 1
92 1 4 VAL MG1 1 67 MET HA 5.340 . 5.340 4.813 4.216 5.400 0.060 7 0 "[ . 1 . 2]" 1
93 1 4 VAL MG1 1 67 MET QB 4.350 . 4.350 3.431 2.480 4.361 0.011 4 0 "[ . 1 . 2]" 1
94 1 4 VAL MG1 1 67 MET HG2 5.020 . 5.020 4.514 3.550 5.060 0.040 11 0 "[ . 1 . 2]" 1
95 1 4 VAL MG1 1 67 MET QG 4.350 . 4.350 3.832 3.410 4.234 . 0 0 "[ . 1 . 2]" 1
96 1 4 VAL MG1 1 67 MET HG3 5.020 . 5.020 4.330 3.540 5.086 0.066 19 0 "[ . 1 . 2]" 1
97 1 4 VAL MG1 1 68 LYS H 5.500 . 5.500 5.424 5.037 5.563 0.063 20 0 "[ . 1 . 2]" 1
98 1 4 VAL MG1 1 68 LYS HA 5.140 . 5.140 4.246 3.665 4.898 . 0 0 "[ . 1 . 2]" 1
99 1 4 VAL MG1 1 71 LEU HB2 2.690 . 2.690 2.075 1.921 2.278 . 0 0 "[ . 1 . 2]" 1
100 1 4 VAL MG1 1 71 LEU HB3 5.500 . 5.500 2.161 1.746 2.565 0.054 19 0 "[ . 1 . 2]" 1
101 1 4 VAL MG1 1 71 LEU MD1 4.290 . 4.290 2.951 2.168 3.632 . 0 0 "[ . 1 . 2]" 1
102 1 4 VAL MG1 1 71 LEU QD 3.470 . 3.470 1.900 1.753 2.077 0.047 14 0 "[ . 1 . 2]" 1
103 1 4 VAL MG1 1 71 LEU MD2 4.290 . 4.290 1.929 1.841 2.089 . 0 0 "[ . 1 . 2]" 1
104 1 4 VAL MG1 1 71 LEU HG 5.500 . 5.500 3.545 1.884 3.834 . 0 0 "[ . 1 . 2]" 1
105 1 4 VAL MG1 1 72 GLU HA 5.500 . 5.500 5.637 5.523 5.806 0.306 19 0 "[ . 1 . 2]" 1
106 1 4 VAL MG2 1 5 HIS H 2.990 . 2.990 2.421 2.263 2.514 . 0 0 "[ . 1 . 2]" 1
107 1 4 VAL MG2 1 5 HIS HA 4.450 . 4.450 3.143 3.056 3.273 . 0 0 "[ . 1 . 2]" 1
108 1 4 VAL MG2 1 6 GLU H 4.310 . 4.310 4.245 4.156 4.315 0.005 5 0 "[ . 1 . 2]" 1
109 1 4 VAL MG2 1 7 TRP QB 4.770 . 4.770 4.648 4.519 4.796 0.026 6 0 "[ . 1 . 2]" 1
110 1 4 VAL MG2 1 7 TRP HZ3 5.130 . 5.130 4.809 4.517 4.943 . 0 0 "[ . 1 . 2]" 1
111 1 4 VAL MG2 1 12 VAL MG2 5.500 . 5.500 5.140 4.910 5.338 . 0 0 "[ . 1 . 2]" 1
112 1 4 VAL MG2 1 35 GLY H 4.540 . 4.540 4.494 4.262 4.584 0.044 10 0 "[ . 1 . 2]" 1
113 1 4 VAL MG2 1 35 GLY HA2 4.280 . 4.280 3.200 2.824 3.496 . 0 0 "[ . 1 . 2]" 1
114 1 4 VAL MG2 1 35 GLY HA3 4.100 . 4.100 2.502 2.230 2.671 . 0 0 "[ . 1 . 2]" 1
115 1 4 VAL MG2 1 38 LEU H 5.020 . 5.020 4.998 4.826 5.063 0.043 3 0 "[ . 1 . 2]" 1
116 1 4 VAL MG2 1 38 LEU HB3 5.420 . 5.420 3.456 3.033 3.667 . 0 0 "[ . 1 . 2]" 1
117 1 4 VAL MG2 1 38 LEU MD1 4.120 . 4.120 3.190 2.819 3.675 . 0 0 "[ . 1 . 2]" 1
118 1 4 VAL MG2 1 38 LEU MD2 4.800 . 4.800 3.629 3.095 4.087 . 0 0 "[ . 1 . 2]" 1
119 1 4 VAL MG2 1 39 LEU H 4.150 . 4.150 3.871 3.591 4.047 . 0 0 "[ . 1 . 2]" 1
120 1 4 VAL MG2 1 39 LEU MD1 3.370 . 3.370 2.141 2.004 2.333 . 0 0 "[ . 1 . 2]" 1
121 1 4 VAL MG2 1 39 LEU QD 2.840 . 2.840 1.803 1.754 1.956 0.046 15 0 "[ . 1 . 2]" 1
122 1 4 VAL MG2 1 39 LEU MD2 3.370 . 3.370 1.951 1.820 2.230 . 0 0 "[ . 1 . 2]" 1
123 1 4 VAL MG2 1 39 LEU HG 4.090 . 4.090 2.303 2.141 2.452 . 0 0 "[ . 1 . 2]" 1
124 1 4 VAL MG2 1 67 MET QB 5.340 . 5.340 4.024 2.992 5.140 . 0 0 "[ . 1 . 2]" 1
125 1 4 VAL MG2 1 67 MET HG2 5.500 . 5.500 4.774 3.376 5.595 0.095 10 0 "[ . 1 . 2]" 1
126 1 4 VAL MG2 1 67 MET HG3 5.500 . 5.500 4.363 3.588 5.176 . 0 0 "[ . 1 . 2]" 1
127 1 4 VAL MG2 1 68 LYS H 5.500 . 5.500 5.527 5.281 5.571 0.071 13 0 "[ . 1 . 2]" 1
128 1 4 VAL MG2 1 71 LEU HB2 5.020 . 5.020 4.195 3.936 4.447 . 0 0 "[ . 1 . 2]" 1
129 1 4 VAL MG2 1 71 LEU QD 5.020 . 5.020 2.542 1.951 3.285 . 0 0 "[ . 1 . 2]" 1
130 1 5 HIS H 1 5 HIS HA 2.860 . 2.860 2.806 2.776 2.834 . 0 0 "[ . 1 . 2]" 1
131 1 5 HIS H 1 5 HIS HB2 3.710 . 3.710 3.601 3.570 3.631 . 0 0 "[ . 1 . 2]" 1
132 1 5 HIS H 1 5 HIS HB3 2.800 . 2.800 2.789 2.745 2.819 0.019 7 0 "[ . 1 . 2]" 1
133 1 5 HIS H 1 5 HIS HD2 5.500 . 5.500 4.116 3.955 4.278 . 0 0 "[ . 1 . 2]" 1
134 1 5 HIS H 1 6 GLU H 2.930 . 2.930 2.537 2.490 2.585 . 0 0 "[ . 1 . 2]" 1
135 1 5 HIS H 1 39 LEU QD 3.780 . 3.780 3.639 3.414 3.788 0.008 2 0 "[ . 1 . 2]" 1
136 1 5 HIS H 1 71 LEU QD 4.280 . 4.280 4.000 3.642 4.329 0.049 7 0 "[ . 1 . 2]" 1
137 1 5 HIS HA 1 5 HIS HD2 4.960 . 4.960 4.612 4.548 4.680 . 0 0 "[ . 1 . 2]" 1
138 1 5 HIS HA 1 6 GLU H 3.510 . 3.510 3.330 3.265 3.399 . 0 0 "[ . 1 . 2]" 1
139 1 5 HIS HA 1 7 TRP H 4.060 . 4.060 3.619 3.438 3.769 . 0 0 "[ . 1 . 2]" 1
140 1 5 HIS HA 1 35 GLY H 5.230 . 5.230 3.855 3.363 4.143 . 0 0 "[ . 1 . 2]" 1
141 1 5 HIS HA 1 35 GLY HA3 4.670 . 4.670 2.902 2.400 3.341 . 0 0 "[ . 1 . 2]" 1
142 1 5 HIS HA 1 36 GLU H 3.890 . 3.890 3.389 3.057 3.630 . 0 0 "[ . 1 . 2]" 1
143 1 5 HIS HA 1 39 LEU QD 3.580 . 3.580 3.701 3.638 3.762 0.182 15 0 "[ . 1 . 2]" 1
144 1 5 HIS HB2 1 5 HIS HD2 3.200 . 3.200 2.853 2.808 2.896 . 0 0 "[ . 1 . 2]" 1
145 1 5 HIS HB2 1 36 GLU HA 5.500 . 5.500 4.933 4.278 5.460 . 0 0 "[ . 1 . 2]" 1
146 1 5 HIS HB2 1 39 LEU QD 4.510 . 4.510 4.263 3.821 4.530 0.020 2 0 "[ . 1 . 2]" 1
147 1 5 HIS HB3 1 6 GLU H 4.350 . 4.350 4.364 4.334 4.385 0.035 13 0 "[ . 1 . 2]" 1
148 1 5 HIS HB3 1 36 GLU HA 5.500 . 5.500 4.349 3.754 4.879 . 0 0 "[ . 1 . 2]" 1
149 1 5 HIS HB3 1 39 LEU QD 3.480 . 3.480 2.889 2.440 3.178 . 0 0 "[ . 1 . 2]" 1
150 1 5 HIS HD2 1 6 GLU HA 4.940 . 4.940 3.903 3.650 4.160 . 0 0 "[ . 1 . 2]" 1
151 1 5 HIS HD2 1 6 GLU HG2 3.950 . 3.950 2.591 2.098 3.268 . 0 0 "[ . 1 . 2]" 1
152 1 5 HIS HD2 1 6 GLU QG 3.440 . 3.440 2.453 2.086 2.971 . 0 0 "[ . 1 . 2]" 1
153 1 5 HIS HD2 1 6 GLU HG3 3.950 . 3.950 3.509 2.623 3.979 0.029 16 0 "[ . 1 . 2]" 1
154 1 5 HIS HE1 1 6 GLU QG 4.460 . 4.460 4.426 4.221 4.500 0.040 15 0 "[ . 1 . 2]" 1
155 1 5 HIS HE1 1 71 LEU MD1 5.500 . 5.500 4.945 3.946 5.381 . 0 0 "[ . 1 . 2]" 1
156 1 5 HIS HE1 1 71 LEU MD2 5.500 . 5.500 4.308 3.651 4.659 . 0 0 "[ . 1 . 2]" 1
157 1 6 GLU H 1 6 GLU HB2 2.690 . 2.690 2.470 2.340 2.626 . 0 0 "[ . 1 . 2]" 1
158 1 6 GLU H 1 6 GLU HB3 3.820 . 3.820 3.608 3.557 3.665 . 0 0 "[ . 1 . 2]" 1
159 1 6 GLU H 1 6 GLU QG 3.000 . 3.000 2.413 2.224 2.627 . 0 0 "[ . 1 . 2]" 1
160 1 6 GLU H 1 7 TRP H 2.500 . 2.500 2.207 2.102 2.289 . 0 0 "[ . 1 . 2]" 1
161 1 6 GLU H 1 7 TRP HA 4.900 . 4.900 4.688 4.563 4.806 . 0 0 "[ . 1 . 2]" 1
162 1 6 GLU H 1 35 GLY HA3 5.500 . 5.500 4.709 4.417 4.910 . 0 0 "[ . 1 . 2]" 1
163 1 6 GLU HA 1 6 GLU HG2 4.000 . 4.000 2.860 2.612 3.080 . 0 0 "[ . 1 . 2]" 1
164 1 6 GLU HA 1 6 GLU QG 3.380 . 3.380 2.749 2.508 2.963 . 0 0 "[ . 1 . 2]" 1
165 1 6 GLU HA 1 6 GLU HG3 4.000 . 4.000 3.568 3.154 3.852 . 0 0 "[ . 1 . 2]" 1
166 1 6 GLU HA 1 7 TRP H 3.450 . 3.450 3.338 3.237 3.415 . 0 0 "[ . 1 . 2]" 1
167 1 6 GLU HA 1 7 TRP HD1 5.500 . 5.500 5.130 4.850 5.490 . 0 0 "[ . 1 . 2]" 1
168 1 6 GLU HB2 1 7 TRP H 3.520 . 3.520 3.329 3.069 3.498 . 0 0 "[ . 1 . 2]" 1
169 1 6 GLU HB2 1 7 TRP HD1 4.050 . 4.050 3.269 2.830 3.683 . 0 0 "[ . 1 . 2]" 1
170 1 6 GLU HB2 1 7 TRP HE1 5.180 . 5.180 4.450 3.927 4.938 . 0 0 "[ . 1 . 2]" 1
171 1 6 GLU HB2 1 11 GLN HE21 5.500 . 5.500 5.226 4.660 5.566 0.066 18 0 "[ . 1 . 2]" 1
172 1 6 GLU HB3 1 7 TRP H 4.330 . 4.330 4.204 4.090 4.336 0.006 6 0 "[ . 1 . 2]" 1
173 1 6 GLU QG 1 7 TRP H 4.740 . 4.740 4.199 4.047 4.362 . 0 0 "[ . 1 . 2]" 1
174 1 7 TRP H 1 7 TRP QB 2.460 . 2.460 2.419 2.379 2.455 . 0 0 "[ . 1 . 2]" 1
175 1 7 TRP H 1 7 TRP HE1 5.120 . 5.120 5.016 4.866 5.135 0.015 8 0 "[ . 1 . 2]" 1
176 1 7 TRP H 1 8 SER H 4.840 . 4.840 4.549 4.462 4.618 . 0 0 "[ . 1 . 2]" 1
177 1 7 TRP H 1 11 GLN HB3 5.500 . 5.500 5.333 5.029 5.514 0.014 1 0 "[ . 1 . 2]" 1
178 1 7 TRP H 1 11 GLN HE21 5.270 . 5.270 4.783 4.245 5.300 0.030 19 0 "[ . 1 . 2]" 1
179 1 7 TRP H 1 11 GLN HE22 5.500 . 5.500 5.020 4.676 5.473 . 0 0 "[ . 1 . 2]" 1
180 1 7 TRP H 1 35 GLY H 3.850 . 3.850 3.725 3.531 3.857 0.007 14 0 "[ . 1 . 2]" 1
181 1 7 TRP H 1 35 GLY HA3 4.330 . 4.330 3.977 3.799 4.183 . 0 0 "[ . 1 . 2]" 1
182 1 7 TRP HA 1 7 TRP HD1 2.420 . 2.420 2.266 2.155 2.372 . 0 0 "[ . 1 . 2]" 1
183 1 7 TRP HA 1 7 TRP HE1 4.790 . 4.790 4.744 4.628 4.815 0.025 19 0 "[ . 1 . 2]" 1
184 1 7 TRP HA 1 8 SER H 2.700 . 2.700 2.196 2.126 2.308 . 0 0 "[ . 1 . 2]" 1
185 1 7 TRP HA 1 10 GLN QE 5.340 . 5.340 4.985 4.492 5.410 0.070 19 0 "[ . 1 . 2]" 1
186 1 7 TRP HA 1 11 GLN H 5.050 . 5.050 4.702 4.297 5.106 0.056 17 0 "[ . 1 . 2]" 1
187 1 7 TRP HA 1 11 GLN HB2 4.140 . 4.140 2.613 2.351 2.986 . 0 0 "[ . 1 . 2]" 1
188 1 7 TRP HA 1 11 GLN HE22 4.050 . 4.050 2.815 2.377 3.251 . 0 0 "[ . 1 . 2]" 1
189 1 7 TRP HA 1 11 GLN QG 4.150 . 4.150 3.886 3.504 4.193 0.043 7 0 "[ . 1 . 2]" 1
190 1 7 TRP HA 1 35 GLY H 5.420 . 5.420 5.046 4.804 5.182 . 0 0 "[ . 1 . 2]" 1
191 1 7 TRP QB 1 7 TRP HD1 3.390 . 3.390 3.212 3.185 3.233 . 0 0 "[ . 1 . 2]" 1
192 1 7 TRP QB 1 7 TRP HZ2 5.470 . 5.470 5.513 5.497 5.528 0.058 15 0 "[ . 1 . 2]" 1
193 1 7 TRP QB 1 8 SER H 3.080 . 3.080 2.815 2.417 3.050 . 0 0 "[ . 1 . 2]" 1
194 1 7 TRP QB 1 11 GLN H 3.990 . 3.990 3.755 3.605 3.973 . 0 0 "[ . 1 . 2]" 1
195 1 7 TRP QB 1 11 GLN HB2 3.600 . 3.600 2.240 2.050 2.524 . 0 0 "[ . 1 . 2]" 1
196 1 7 TRP QB 1 11 GLN HB3 3.890 . 3.890 2.913 2.506 3.128 . 0 0 "[ . 1 . 2]" 1
197 1 7 TRP QB 1 12 VAL H 3.770 . 3.770 3.356 3.108 3.572 . 0 0 "[ . 1 . 2]" 1
198 1 7 TRP QB 1 12 VAL HB 3.600 . 3.600 3.406 3.263 3.614 0.014 17 0 "[ . 1 . 2]" 1
199 1 7 TRP QB 1 12 VAL MG2 3.840 . 3.840 3.506 3.386 3.642 . 0 0 "[ . 1 . 2]" 1
200 1 7 TRP QB 1 34 SER HA 5.010 . 5.010 3.557 3.428 3.663 . 0 0 "[ . 1 . 2]" 1
201 1 7 TRP QB 1 34 SER QB 3.270 . 3.270 3.281 3.060 3.373 0.103 19 0 "[ . 1 . 2]" 1
202 1 7 TRP QB 1 35 GLY H 2.970 . 2.970 2.485 2.216 2.647 . 0 0 "[ . 1 . 2]" 1
203 1 7 TRP QB 1 35 GLY HA2 4.390 . 4.390 3.986 3.786 4.254 . 0 0 "[ . 1 . 2]" 1
204 1 7 TRP QB 1 35 GLY HA3 3.620 . 3.620 3.308 2.909 3.602 . 0 0 "[ . 1 . 2]" 1
205 1 7 TRP QB 1 36 GLU H 5.120 . 5.120 4.756 4.340 4.961 . 0 0 "[ . 1 . 2]" 1
206 1 7 TRP QB 1 38 LEU MD1 4.730 . 4.730 4.042 3.907 4.156 . 0 0 "[ . 1 . 2]" 1
207 1 7 TRP HD1 1 11 GLN HA 5.500 . 5.500 5.535 5.458 5.572 0.072 3 0 "[ . 1 . 2]" 1
208 1 7 TRP HD1 1 11 GLN HB2 4.140 . 4.140 3.548 3.392 4.179 0.039 17 0 "[ . 1 . 2]" 1
209 1 7 TRP HD1 1 11 GLN HB3 5.500 . 5.500 3.013 2.899 3.109 . 0 0 "[ . 1 . 2]" 1
210 1 7 TRP HD1 1 11 GLN QG 5.360 . 5.360 4.221 4.058 4.432 . 0 0 "[ . 1 . 2]" 1
211 1 7 TRP HE1 1 11 GLN HB3 4.420 . 4.420 3.805 3.598 4.284 . 0 0 "[ . 1 . 2]" 1
212 1 7 TRP HE1 1 71 LEU QD 5.020 . 5.020 4.844 4.315 5.064 0.044 16 0 "[ . 1 . 2]" 1
213 1 7 TRP HE3 1 12 VAL HA 5.500 . 5.500 2.148 1.901 2.332 . 0 0 "[ . 1 . 2]" 1
214 1 7 TRP HE3 1 15 TRP HB2 5.500 . 5.500 4.608 4.433 4.860 . 0 0 "[ . 1 . 2]" 1
215 1 7 TRP HE3 1 38 LEU MD1 4.600 . 4.600 2.514 2.415 2.631 . 0 0 "[ . 1 . 2]" 1
216 1 7 TRP HH2 1 15 TRP HA 4.850 . 4.850 3.969 3.543 4.479 . 0 0 "[ . 1 . 2]" 1
217 1 7 TRP HH2 1 15 TRP HB2 3.650 . 3.650 2.318 2.051 2.679 . 0 0 "[ . 1 . 2]" 1
218 1 7 TRP HH2 1 15 TRP HD1 4.960 . 4.960 4.170 3.902 4.564 . 0 0 "[ . 1 . 2]" 1
219 1 7 TRP HH2 1 38 LEU MD1 4.020 . 4.020 3.929 3.814 4.040 0.020 17 0 "[ . 1 . 2]" 1
220 1 7 TRP HH2 1 71 LEU HB2 3.480 . 3.480 3.511 3.322 3.570 0.090 1 0 "[ . 1 . 2]" 1
221 1 7 TRP HH2 1 71 LEU QD 5.440 . 5.440 4.577 4.292 4.681 . 0 0 "[ . 1 . 2]" 1
222 1 7 TRP HZ2 1 15 TRP HB2 5.500 . 5.500 4.604 4.411 4.887 . 0 0 "[ . 1 . 2]" 1
223 1 7 TRP HZ2 1 71 LEU HB2 4.150 . 4.150 3.434 3.036 3.814 . 0 0 "[ . 1 . 2]" 1
224 1 7 TRP HZ2 1 71 LEU QD 5.440 . 5.440 4.085 3.594 4.358 . 0 0 "[ . 1 . 2]" 1
225 1 7 TRP HZ3 1 12 VAL HA 3.310 . 3.310 3.109 2.876 3.272 . 0 0 "[ . 1 . 2]" 1
226 1 7 TRP HZ3 1 12 VAL MG1 5.420 . 5.420 5.423 5.238 5.486 0.066 2 0 "[ . 1 . 2]" 1
227 1 7 TRP HZ3 1 15 TRP H 4.900 . 4.900 3.780 3.154 4.312 . 0 0 "[ . 1 . 2]" 1
228 1 7 TRP HZ3 1 15 TRP HA 5.500 . 5.500 4.607 4.369 4.911 . 0 0 "[ . 1 . 2]" 1
229 1 7 TRP HZ3 1 15 TRP HB2 5.500 . 5.500 2.323 2.111 2.569 . 0 0 "[ . 1 . 2]" 1
230 1 7 TRP HZ3 1 15 TRP HB3 4.940 . 4.940 2.593 2.201 3.011 . 0 0 "[ . 1 . 2]" 1
231 1 7 TRP HZ3 1 16 LEU H 5.500 . 5.500 4.899 4.463 5.244 . 0 0 "[ . 1 . 2]" 1
232 1 7 TRP HZ3 1 35 GLY HA2 5.050 . 5.050 4.787 4.314 5.075 0.025 3 0 "[ . 1 . 2]" 1
233 1 7 TRP HZ3 1 38 LEU HB3 5.500 . 5.500 5.193 4.798 5.368 . 0 0 "[ . 1 . 2]" 1
234 1 7 TRP HZ3 1 38 LEU MD1 3.420 . 3.420 2.133 2.033 2.251 . 0 0 "[ . 1 . 2]" 1
235 1 8 SER H 1 8 SER HB2 3.530 . 3.530 2.585 2.397 3.246 . 0 0 "[ . 1 . 2]" 1
236 1 8 SER H 1 8 SER QB 2.800 . 2.800 2.496 2.364 2.781 . 0 0 "[ . 1 . 2]" 1
237 1 8 SER H 1 8 SER HB3 3.530 . 3.530 3.515 2.991 3.616 0.086 2 0 "[ . 1 . 2]" 1
238 1 8 SER H 1 9 VAL H 4.390 . 4.390 2.732 2.427 3.508 . 0 0 "[ . 1 . 2]" 1
239 1 8 SER H 1 9 VAL MG2 4.960 . 4.960 4.876 4.640 5.032 0.072 17 0 "[ . 1 . 2]" 1
240 1 8 SER H 1 10 GLN H 4.650 . 4.650 4.594 4.243 4.719 0.069 17 0 "[ . 1 . 2]" 1
241 1 8 SER H 1 11 GLN H 3.370 . 3.370 3.380 3.327 3.443 0.073 6 0 "[ . 1 . 2]" 1
242 1 8 SER H 1 11 GLN HA 5.400 . 5.400 5.224 4.737 5.410 0.010 15 0 "[ . 1 . 2]" 1
243 1 8 SER H 1 11 GLN HB2 2.880 . 2.880 2.425 1.783 2.644 0.017 17 0 "[ . 1 . 2]" 1
244 1 8 SER H 1 11 GLN HB3 4.150 . 4.150 3.997 3.021 4.198 0.048 19 0 "[ . 1 . 2]" 1
245 1 8 SER H 1 11 GLN HE22 4.810 . 4.810 3.844 3.176 4.430 . 0 0 "[ . 1 . 2]" 1
246 1 8 SER H 1 11 GLN QG 4.540 . 4.540 3.453 2.828 4.223 . 0 0 "[ . 1 . 2]" 1
247 1 8 SER H 1 12 VAL H 4.600 . 4.600 4.595 4.318 4.674 0.074 1 0 "[ . 1 . 2]" 1
248 1 8 SER H 1 35 GLY H 5.500 . 5.500 5.391 5.111 5.535 0.035 20 0 "[ . 1 . 2]" 1
249 1 8 SER HA 1 9 VAL HA 5.500 . 5.500 4.628 4.409 4.708 . 0 0 "[ . 1 . 2]" 1
250 1 8 SER HA 1 11 GLN HE21 5.500 . 5.500 5.127 3.997 5.560 0.060 12 0 "[ . 1 . 2]" 1
251 1 8 SER HA 1 34 SER QB 5.340 . 5.340 2.974 2.342 3.368 . 0 0 "[ . 1 . 2]" 1
252 1 8 SER QB 1 9 VAL H 2.490 . 2.490 1.837 1.752 2.091 0.048 9 0 "[ . 1 . 2]" 1
253 1 8 SER QB 1 9 VAL HA 5.340 . 5.340 4.172 4.072 4.242 . 0 0 "[ . 1 . 2]" 1
254 1 8 SER QB 1 9 VAL HB 4.280 . 4.280 3.548 3.196 3.759 . 0 0 "[ . 1 . 2]" 1
255 1 8 SER QB 1 10 GLN H 3.460 . 3.460 3.388 3.197 3.492 0.032 10 0 "[ . 1 . 2]" 1
256 1 8 SER QB 1 10 GLN HB3 5.340 . 5.340 5.327 4.982 5.447 0.107 15 0 "[ . 1 . 2]" 1
257 1 8 SER QB 1 10 GLN QE 4.260 . 4.260 2.424 1.844 3.193 . 0 0 "[ . 1 . 2]" 1
258 1 8 SER QB 1 11 GLN H 4.260 . 4.260 3.846 3.335 4.301 0.041 2 0 "[ . 1 . 2]" 1
259 1 8 SER QB 1 34 SER QB 5.180 . 5.180 4.421 3.957 4.738 . 0 0 "[ . 1 . 2]" 1
260 1 8 SER HB2 1 9 VAL H 3.100 . 3.100 1.857 1.761 2.133 0.039 9 0 "[ . 1 . 2]" 1
261 1 8 SER HB2 1 9 VAL HB 5.010 . 5.010 3.782 3.234 4.158 . 0 0 "[ . 1 . 2]" 1
262 1 8 SER HB3 1 9 VAL H 3.100 . 3.100 3.043 2.203 3.250 0.150 16 0 "[ . 1 . 2]" 1
263 1 8 SER HB3 1 9 VAL HB 5.010 . 5.010 4.391 3.955 5.026 0.016 5 0 "[ . 1 . 2]" 1
264 1 9 VAL H 1 9 VAL HB 2.930 . 2.930 2.785 2.467 2.909 . 0 0 "[ . 1 . 2]" 1
265 1 9 VAL H 1 9 VAL MG1 3.980 . 3.980 3.862 3.750 3.956 . 0 0 "[ . 1 . 2]" 1
266 1 9 VAL H 1 9 VAL MG2 3.200 . 3.200 3.019 2.314 3.149 . 0 0 "[ . 1 . 2]" 1
267 1 9 VAL H 1 10 GLN H 3.000 . 3.000 2.209 1.945 2.338 . 0 0 "[ . 1 . 2]" 1
268 1 9 VAL H 1 11 GLN H 4.170 . 4.170 2.664 2.454 3.158 . 0 0 "[ . 1 . 2]" 1
269 1 9 VAL H 1 11 GLN HB2 4.060 . 4.060 3.802 3.619 3.929 . 0 0 "[ . 1 . 2]" 1
270 1 9 VAL H 1 11 GLN HB3 5.500 . 5.500 5.499 5.313 5.655 0.155 17 0 "[ . 1 . 2]" 1
271 1 9 VAL H 1 12 VAL HB 4.890 . 4.890 4.913 4.846 5.004 0.114 17 0 "[ . 1 . 2]" 1
272 1 9 VAL H 1 12 VAL MG1 5.110 . 5.110 4.971 4.783 5.095 . 0 0 "[ . 1 . 2]" 1
273 1 9 VAL HA 1 9 VAL MG1 2.570 . 2.570 2.426 2.347 2.507 . 0 0 "[ . 1 . 2]" 1
274 1 9 VAL HA 1 9 VAL MG2 2.670 . 2.670 2.418 2.375 2.492 . 0 0 "[ . 1 . 2]" 1
275 1 9 VAL HA 1 11 GLN H 5.500 . 5.500 4.097 3.750 4.290 . 0 0 "[ . 1 . 2]" 1
276 1 9 VAL HA 1 12 VAL H 3.930 . 3.930 3.787 3.555 3.918 . 0 0 "[ . 1 . 2]" 1
277 1 9 VAL HA 1 12 VAL HB 3.420 . 3.420 3.429 3.146 3.481 0.061 1 0 "[ . 1 . 2]" 1
278 1 9 VAL HA 1 12 VAL MG1 3.440 . 3.440 3.234 2.927 3.465 0.025 1 0 "[ . 1 . 2]" 1
279 1 9 VAL HA 1 12 VAL MG2 4.590 . 4.590 4.592 4.359 4.623 0.033 3 0 "[ . 1 . 2]" 1
280 1 9 VAL HA 1 32 ASN H 5.500 . 5.500 5.515 5.379 5.563 0.063 11 0 "[ . 1 . 2]" 1
281 1 9 VAL HA 1 32 ASN HA 5.500 . 5.500 3.697 3.583 3.778 . 0 0 "[ . 1 . 2]" 1
282 1 9 VAL HA 1 32 ASN QB 5.280 . 5.280 4.732 4.153 4.935 . 0 0 "[ . 1 . 2]" 1
283 1 9 VAL HA 1 34 SER HA 4.070 . 4.070 3.693 3.470 3.928 . 0 0 "[ . 1 . 2]" 1
284 1 9 VAL HB 1 10 GLN H 2.760 . 2.760 2.119 1.981 2.320 . 0 0 "[ . 1 . 2]" 1
285 1 9 VAL HB 1 10 GLN QE 5.340 . 5.340 4.463 3.825 4.752 . 0 0 "[ . 1 . 2]" 1
286 1 9 VAL MG1 1 10 GLN H 3.550 . 3.550 2.968 2.769 3.211 . 0 0 "[ . 1 . 2]" 1
287 1 9 VAL MG1 1 10 GLN HA 4.320 . 4.320 3.181 2.963 3.391 . 0 0 "[ . 1 . 2]" 1
288 1 9 VAL MG1 1 10 GLN QE 5.340 . 5.340 5.348 4.941 5.498 0.158 7 0 "[ . 1 . 2]" 1
289 1 9 VAL MG1 1 10 GLN QG 5.320 . 5.320 5.047 4.834 5.325 0.005 19 0 "[ . 1 . 2]" 1
290 1 9 VAL MG1 1 12 VAL HB 5.000 . 5.000 4.789 4.653 5.001 0.001 7 0 "[ . 1 . 2]" 1
291 1 9 VAL MG1 1 29 SER H 4.490 . 4.490 4.316 4.150 4.480 . 0 0 "[ . 1 . 2]" 1
292 1 9 VAL MG1 1 29 SER HA 2.840 . 2.840 1.973 1.833 2.114 . 0 0 "[ . 1 . 2]" 1
293 1 9 VAL MG1 1 29 SER QB 3.110 . 3.110 2.589 2.149 3.124 0.014 8 0 "[ . 1 . 2]" 1
294 1 9 VAL MG1 1 32 ASN H 4.430 . 4.430 3.482 3.283 3.651 . 0 0 "[ . 1 . 2]" 1
295 1 9 VAL MG1 1 32 ASN HA 3.270 . 3.270 2.439 2.160 2.678 . 0 0 "[ . 1 . 2]" 1
296 1 9 VAL MG1 1 32 ASN QB 5.230 . 5.230 3.950 3.069 4.263 . 0 0 "[ . 1 . 2]" 1
297 1 9 VAL MG1 1 32 ASN HD21 5.500 . 5.500 5.238 4.277 5.529 0.029 18 0 "[ . 1 . 2]" 1
298 1 9 VAL MG1 1 33 ILE H 4.030 . 4.030 3.808 3.367 4.051 0.021 10 0 "[ . 1 . 2]" 1
299 1 9 VAL MG1 1 33 ILE HB 5.500 . 5.500 5.105 4.564 5.400 . 0 0 "[ . 1 . 2]" 1
300 1 9 VAL MG1 1 34 SER HA 5.500 . 5.500 5.335 5.128 5.518 0.018 7 0 "[ . 1 . 2]" 1
301 1 9 VAL MG2 1 10 GLN H 4.170 . 4.170 3.638 3.498 3.782 . 0 0 "[ . 1 . 2]" 1
302 1 9 VAL MG2 1 29 SER HA 4.240 . 4.240 3.984 3.804 4.134 . 0 0 "[ . 1 . 2]" 1
303 1 9 VAL MG2 1 29 SER QB 5.340 . 5.340 4.816 4.442 5.291 . 0 0 "[ . 1 . 2]" 1
304 1 9 VAL MG2 1 32 ASN H 3.920 . 3.920 3.956 3.932 3.985 0.065 13 0 "[ . 1 . 2]" 1
305 1 9 VAL MG2 1 32 ASN HA 2.880 . 2.880 2.061 1.983 2.310 . 0 0 "[ . 1 . 2]" 1
306 1 9 VAL MG2 1 32 ASN HB2 4.000 . 4.000 3.723 2.216 3.973 . 0 0 "[ . 1 . 2]" 1
307 1 9 VAL MG2 1 32 ASN QB 3.330 . 3.330 2.466 2.000 2.733 . 0 0 "[ . 1 . 2]" 1
308 1 9 VAL MG2 1 32 ASN HB3 4.000 . 4.000 2.513 2.186 2.784 . 0 0 "[ . 1 . 2]" 1
309 1 9 VAL MG2 1 32 ASN HD21 5.500 . 5.500 4.580 3.979 4.774 . 0 0 "[ . 1 . 2]" 1
310 1 9 VAL MG2 1 32 ASN HD22 5.130 . 5.130 4.515 4.101 5.112 . 0 0 "[ . 1 . 2]" 1
311 1 9 VAL MG2 1 34 SER HA 4.740 . 4.740 4.699 4.501 4.778 0.038 3 0 "[ . 1 . 2]" 1
312 1 9 VAL MG2 1 34 SER QB 4.780 . 4.780 3.924 3.599 4.146 . 0 0 "[ . 1 . 2]" 1
313 1 10 GLN H 1 10 GLN HB2 3.800 . 3.800 3.594 3.526 3.645 . 0 0 "[ . 1 . 2]" 1
314 1 10 GLN H 1 10 GLN HB3 2.910 . 2.910 2.483 2.371 2.647 . 0 0 "[ . 1 . 2]" 1
315 1 10 GLN H 1 10 GLN QE 4.470 . 4.470 3.325 2.654 3.619 . 0 0 "[ . 1 . 2]" 1
316 1 10 GLN H 1 10 GLN QG 3.300 . 3.300 3.194 3.066 3.333 0.033 6 0 "[ . 1 . 2]" 1
317 1 10 GLN H 1 11 GLN H 2.880 . 2.880 2.635 2.392 2.836 . 0 0 "[ . 1 . 2]" 1
318 1 10 GLN H 1 11 GLN HA 5.500 . 5.500 5.197 5.006 5.382 . 0 0 "[ . 1 . 2]" 1
319 1 10 GLN H 1 11 GLN HB2 5.500 . 5.500 4.763 4.234 4.941 . 0 0 "[ . 1 . 2]" 1
320 1 10 GLN H 1 12 VAL MG1 5.500 . 5.500 4.823 4.725 4.887 . 0 0 "[ . 1 . 2]" 1
321 1 10 GLN HA 1 10 GLN HB2 2.450 . 2.450 2.416 2.331 2.454 0.004 17 0 "[ . 1 . 2]" 1
322 1 10 GLN HA 1 10 GLN HB3 2.610 . 2.610 2.452 2.372 2.497 . 0 0 "[ . 1 . 2]" 1
323 1 10 GLN HA 1 10 GLN QE 5.340 . 5.340 5.028 4.110 5.355 0.015 7 0 "[ . 1 . 2]" 1
324 1 10 GLN HA 1 10 GLN QG 3.600 . 3.600 3.556 3.490 3.587 . 0 0 "[ . 1 . 2]" 1
325 1 10 GLN HA 1 11 GLN HA 4.730 . 4.730 4.601 4.363 4.703 . 0 0 "[ . 1 . 2]" 1
326 1 10 GLN HB2 1 10 GLN QG 2.460 . 2.460 2.162 2.152 2.173 . 0 0 "[ . 1 . 2]" 1
327 1 10 GLN HB2 1 11 GLN H 4.310 . 4.310 4.145 3.863 4.388 0.078 6 0 "[ . 1 . 2]" 1
328 1 10 GLN HB2 1 14 HIS HE1 5.500 . 5.500 5.254 4.240 5.538 0.038 3 0 "[ . 1 . 2]" 1
329 1 10 GLN HB3 1 11 GLN H 4.260 . 4.260 4.135 3.905 4.319 0.059 2 0 "[ . 1 . 2]" 1
330 1 10 GLN QE 1 10 GLN QG 3.020 . 3.020 2.125 2.051 2.206 . 0 0 "[ . 1 . 2]" 1
331 1 10 GLN QE 1 11 GLN HB2 4.860 . 4.860 3.991 3.201 4.867 0.007 19 0 "[ . 1 . 2]" 1
332 1 10 GLN QE 1 11 GLN HE21 4.050 . 4.050 3.726 2.852 4.175 0.125 17 0 "[ . 1 . 2]" 1
333 1 10 GLN QE 1 11 GLN QG 3.890 . 3.890 2.333 1.759 3.810 0.041 6 0 "[ . 1 . 2]" 1
334 1 10 GLN QG 1 11 GLN H 4.070 . 4.070 3.078 2.493 3.643 . 0 0 "[ . 1 . 2]" 1
335 1 10 GLN QG 1 14 HIS HE1 5.500 . 5.500 4.905 4.430 5.524 0.024 2 0 "[ . 1 . 2]" 1
336 1 11 GLN H 1 11 GLN HB2 2.660 . 2.660 2.398 2.178 2.516 . 0 0 "[ . 1 . 2]" 1
337 1 11 GLN H 1 11 GLN HB3 3.790 . 3.790 3.620 3.467 3.706 . 0 0 "[ . 1 . 2]" 1
338 1 11 GLN H 1 11 GLN HE21 4.930 . 4.930 4.278 3.889 4.570 . 0 0 "[ . 1 . 2]" 1
339 1 11 GLN H 1 11 GLN QG 3.780 . 3.780 2.669 2.416 3.332 . 0 0 "[ . 1 . 2]" 1
340 1 11 GLN H 1 12 VAL H 2.710 . 2.710 2.429 2.017 2.586 . 0 0 "[ . 1 . 2]" 1
341 1 11 GLN H 1 12 VAL HB 4.520 . 4.520 4.366 3.993 4.551 0.031 19 0 "[ . 1 . 2]" 1
342 1 11 GLN HA 1 11 GLN HE21 5.500 . 5.500 4.787 4.134 5.261 . 0 0 "[ . 1 . 2]" 1
343 1 11 GLN HA 1 11 GLN QG 3.250 . 3.250 2.317 2.213 2.416 . 0 0 "[ . 1 . 2]" 1
344 1 11 GLN HA 1 12 VAL H 3.550 . 3.550 3.404 3.319 3.459 . 0 0 "[ . 1 . 2]" 1
345 1 11 GLN HA 1 12 VAL MG1 5.330 . 5.330 5.193 5.013 5.327 . 0 0 "[ . 1 . 2]" 1
346 1 11 GLN HA 1 14 HIS H 3.790 . 3.790 3.477 3.217 3.739 . 0 0 "[ . 1 . 2]" 1
347 1 11 GLN HA 1 14 HIS QB 4.080 . 4.080 3.990 3.689 4.117 0.037 9 0 "[ . 1 . 2]" 1
348 1 11 GLN HA 1 14 HIS HD2 3.880 . 3.880 2.263 1.935 2.806 . 0 0 "[ . 1 . 2]" 1
349 1 11 GLN HA 1 14 HIS HE1 5.330 . 5.330 4.385 3.804 5.034 . 0 0 "[ . 1 . 2]" 1
350 1 11 GLN HB2 1 12 VAL H 3.440 . 3.440 3.348 3.145 3.486 0.046 2 0 "[ . 1 . 2]" 1
351 1 11 GLN HB2 1 13 SER H 5.500 . 5.500 5.202 5.005 5.349 . 0 0 "[ . 1 . 2]" 1
352 1 11 GLN HB3 1 11 GLN HE22 4.340 . 4.340 3.943 3.514 4.295 . 0 0 "[ . 1 . 2]" 1
353 1 11 GLN HB3 1 12 VAL H 4.580 . 4.580 4.060 3.928 4.164 . 0 0 "[ . 1 . 2]" 1
354 1 11 GLN HB3 1 14 HIS H 5.500 . 5.500 5.081 4.791 5.522 0.022 13 0 "[ . 1 . 2]" 1
355 1 11 GLN HB3 1 14 HIS QB 5.500 . 5.500 4.628 4.364 4.933 . 0 0 "[ . 1 . 2]" 1
356 1 11 GLN HB3 1 14 HIS HD2 5.060 . 5.060 2.934 2.670 3.298 . 0 0 "[ . 1 . 2]" 1
357 1 11 GLN HE21 1 11 GLN QG 2.870 . 2.870 2.553 2.259 2.824 . 0 0 "[ . 1 . 2]" 1
358 1 11 GLN HE22 1 11 GLN QG 3.420 . 3.420 3.384 3.293 3.463 0.043 4 0 "[ . 1 . 2]" 1
359 1 11 GLN QG 1 12 VAL H 4.630 . 4.630 4.414 4.249 4.568 . 0 0 "[ . 1 . 2]" 1
360 1 11 GLN QG 1 14 HIS QB 5.420 . 5.420 5.058 4.341 5.427 0.007 11 0 "[ . 1 . 2]" 1
361 1 11 GLN QG 1 14 HIS HD2 4.510 . 4.510 2.992 2.153 3.605 . 0 0 "[ . 1 . 2]" 1
362 1 11 GLN QG 1 14 HIS HE1 5.500 . 5.500 4.764 4.236 5.510 0.010 13 0 "[ . 1 . 2]" 1
363 1 12 VAL H 1 12 VAL HB 2.520 . 2.520 2.341 2.281 2.415 . 0 0 "[ . 1 . 2]" 1
364 1 12 VAL H 1 12 VAL MG1 3.950 . 3.950 2.482 2.350 2.562 . 0 0 "[ . 1 . 2]" 1
365 1 12 VAL H 1 12 VAL MG2 3.790 . 3.790 3.708 3.678 3.756 . 0 0 "[ . 1 . 2]" 1
366 1 12 VAL H 1 13 SER H 2.510 . 2.510 2.379 2.274 2.453 . 0 0 "[ . 1 . 2]" 1
367 1 12 VAL H 1 34 SER HA 4.880 . 4.880 4.682 4.390 4.911 0.031 6 0 "[ . 1 . 2]" 1
368 1 12 VAL HA 1 12 VAL MG1 3.200 . 3.200 3.213 3.193 3.224 0.024 10 0 "[ . 1 . 2]" 1
369 1 12 VAL HA 1 12 VAL MG2 2.690 . 2.690 2.254 2.239 2.302 . 0 0 "[ . 1 . 2]" 1
370 1 12 VAL HA 1 14 HIS QB 5.500 . 5.500 4.774 4.630 4.919 . 0 0 "[ . 1 . 2]" 1
371 1 12 VAL HA 1 15 TRP H 3.950 . 3.950 3.765 3.571 3.844 . 0 0 "[ . 1 . 2]" 1
372 1 12 VAL HA 1 15 TRP HB2 5.230 . 5.230 4.497 4.143 4.836 . 0 0 "[ . 1 . 2]" 1
373 1 12 VAL HA 1 16 LEU MD1 4.870 . 4.870 4.775 4.608 4.898 0.028 17 0 "[ . 1 . 2]" 1
374 1 12 VAL HA 1 35 GLY H 5.500 . 5.500 5.301 4.932 5.545 0.045 11 0 "[ . 1 . 2]" 1
375 1 12 VAL HA 1 38 LEU MD1 4.150 . 4.150 3.115 2.967 3.235 . 0 0 "[ . 1 . 2]" 1
376 1 12 VAL HA 1 38 LEU MD2 5.500 . 5.500 5.582 5.536 5.619 0.119 13 0 "[ . 1 . 2]" 1
377 1 12 VAL HB 1 13 SER H 4.040 . 4.040 3.854 3.740 3.963 . 0 0 "[ . 1 . 2]" 1
378 1 12 VAL HB 1 28 PHE QD 5.060 . 5.060 4.219 4.013 4.350 . 0 0 "[ . 1 . 2]" 1
379 1 12 VAL HB 1 34 SER HA 3.260 . 3.260 2.749 2.436 2.911 . 0 0 "[ . 1 . 2]" 1
380 1 12 VAL HB 1 38 LEU MD1 5.500 . 5.500 4.063 3.965 4.144 . 0 0 "[ . 1 . 2]" 1
381 1 12 VAL MG1 1 13 SER H 3.070 . 3.070 2.541 2.430 2.726 . 0 0 "[ . 1 . 2]" 1
382 1 12 VAL MG1 1 16 LEU H 5.500 . 5.500 4.580 4.353 4.835 . 0 0 "[ . 1 . 2]" 1
383 1 12 VAL MG1 1 16 LEU MD1 3.430 . 3.430 2.369 2.194 2.624 . 0 0 "[ . 1 . 2]" 1
384 1 12 VAL MG1 1 16 LEU MD2 4.660 . 4.660 4.239 3.973 4.463 . 0 0 "[ . 1 . 2]" 1
385 1 12 VAL MG1 1 16 LEU HG 4.150 . 4.150 3.725 3.404 4.012 . 0 0 "[ . 1 . 2]" 1
386 1 12 VAL MG1 1 25 VAL QG 4.060 . 4.060 3.272 3.077 3.437 . 0 0 "[ . 1 . 2]" 1
387 1 12 VAL MG1 1 28 PHE HB2 4.220 . 4.220 3.544 3.283 3.647 . 0 0 "[ . 1 . 2]" 1
388 1 12 VAL MG1 1 28 PHE HB3 4.500 . 4.500 2.315 2.079 2.427 . 0 0 "[ . 1 . 2]" 1
389 1 12 VAL MG1 1 28 PHE QE 4.400 . 4.400 4.008 3.761 4.244 . 0 0 "[ . 1 . 2]" 1
390 1 12 VAL MG1 1 32 ASN HA 5.500 . 5.500 5.003 4.769 5.155 . 0 0 "[ . 1 . 2]" 1
391 1 12 VAL MG1 1 33 ILE HB 4.160 . 4.160 3.007 2.546 3.226 . 0 0 "[ . 1 . 2]" 1
392 1 12 VAL MG1 1 33 ILE MD 5.500 . 5.500 5.296 4.952 5.465 . 0 0 "[ . 1 . 2]" 1
393 1 12 VAL MG1 1 34 SER HA 3.750 . 3.750 3.734 3.550 3.802 0.052 9 0 "[ . 1 . 2]" 1
394 1 12 VAL MG1 1 34 SER QB 5.340 . 5.340 4.980 4.773 5.096 . 0 0 "[ . 1 . 2]" 1
395 1 12 VAL MG1 1 38 LEU MD1 4.180 . 4.180 4.135 3.996 4.199 0.019 6 0 "[ . 1 . 2]" 1
396 1 12 VAL MG2 1 13 SER H 4.300 . 4.300 4.196 4.132 4.297 . 0 0 "[ . 1 . 2]" 1
397 1 12 VAL MG2 1 15 TRP H 4.730 . 4.730 4.682 4.572 4.738 0.008 13 0 "[ . 1 . 2]" 1
398 1 12 VAL MG2 1 15 TRP HB2 5.500 . 5.500 4.787 4.629 4.987 . 0 0 "[ . 1 . 2]" 1
399 1 12 VAL MG2 1 15 TRP HB3 5.220 . 5.220 3.676 3.508 3.832 . 0 0 "[ . 1 . 2]" 1
400 1 12 VAL MG2 1 28 PHE QE 4.830 . 4.830 2.921 2.789 3.143 . 0 0 "[ . 1 . 2]" 1
401 1 12 VAL MG2 1 33 ILE MG 3.360 . 3.360 2.459 2.066 2.694 . 0 0 "[ . 1 . 2]" 1
402 1 12 VAL MG2 1 34 SER H 5.500 . 5.500 4.278 3.870 4.463 . 0 0 "[ . 1 . 2]" 1
403 1 12 VAL MG2 1 34 SER HA 3.270 . 3.270 2.854 2.544 3.150 . 0 0 "[ . 1 . 2]" 1
404 1 12 VAL MG2 1 34 SER QB 5.120 . 5.120 4.199 3.935 4.336 . 0 0 "[ . 1 . 2]" 1
405 1 12 VAL MG2 1 35 GLY H 3.760 . 3.760 3.647 3.363 3.803 0.043 2 0 "[ . 1 . 2]" 1
406 1 12 VAL MG2 1 35 GLY HA2 3.830 . 3.830 3.220 2.780 3.464 . 0 0 "[ . 1 . 2]" 1
407 1 12 VAL MG2 1 35 GLY HA3 4.960 . 4.960 4.234 3.792 4.432 . 0 0 "[ . 1 . 2]" 1
408 1 12 VAL MG2 1 38 LEU H 5.500 . 5.500 4.247 3.988 4.524 . 0 0 "[ . 1 . 2]" 1
409 1 12 VAL MG2 1 38 LEU MD1 3.450 . 3.450 1.843 1.791 1.908 0.009 15 0 "[ . 1 . 2]" 1
410 1 13 SER H 1 13 SER HB2 3.720 . 3.720 2.888 2.602 3.613 . 0 0 "[ . 1 . 2]" 1
411 1 13 SER H 1 13 SER QB 2.870 . 2.870 2.619 2.405 2.771 . 0 0 "[ . 1 . 2]" 1
412 1 13 SER H 1 13 SER HB3 3.720 . 3.720 3.275 2.443 3.555 . 0 0 "[ . 1 . 2]" 1
413 1 13 SER H 1 14 HIS H 2.800 . 2.800 2.540 2.400 2.660 . 0 0 "[ . 1 . 2]" 1
414 1 13 SER H 1 14 HIS HA 5.500 . 5.500 5.127 5.039 5.236 . 0 0 "[ . 1 . 2]" 1
415 1 13 SER H 1 14 HIS QB 5.300 . 5.300 4.762 4.542 4.890 . 0 0 "[ . 1 . 2]" 1
416 1 13 SER H 1 16 LEU MD1 4.370 . 4.370 3.945 3.815 4.080 . 0 0 "[ . 1 . 2]" 1
417 1 13 SER H 1 16 LEU HG 5.500 . 5.500 5.441 5.234 5.520 0.020 17 0 "[ . 1 . 2]" 1
418 1 13 SER H 1 25 VAL QG 5.440 . 5.440 3.720 3.545 4.025 . 0 0 "[ . 1 . 2]" 1
419 1 13 SER HA 1 16 LEU H 5.500 . 5.500 3.313 3.177 3.568 . 0 0 "[ . 1 . 2]" 1
420 1 13 SER HA 1 16 LEU HB2 4.930 . 4.930 2.480 2.299 2.660 . 0 0 "[ . 1 . 2]" 1
421 1 13 SER HA 1 16 LEU MD1 5.500 . 5.500 1.937 1.834 2.019 . 0 0 "[ . 1 . 2]" 1
422 1 13 SER HA 1 17 VAL H 4.540 . 4.540 3.847 3.574 4.095 . 0 0 "[ . 1 . 2]" 1
423 1 13 SER HA 1 17 VAL QG 5.440 . 5.440 3.575 3.287 3.805 . 0 0 "[ . 1 . 2]" 1
424 1 13 SER HA 1 25 VAL HA 5.500 . 5.500 4.067 3.879 4.512 . 0 0 "[ . 1 . 2]" 1
425 1 13 SER HA 1 25 VAL MG1 3.950 . 3.950 3.213 2.976 3.557 . 0 0 "[ . 1 . 2]" 1
426 1 13 SER HA 1 25 VAL QG 3.450 . 3.450 2.096 1.900 2.942 . 0 0 "[ . 1 . 2]" 1
427 1 13 SER HA 1 25 VAL MG2 3.950 . 3.950 2.132 1.915 3.137 . 0 0 "[ . 1 . 2]" 1
428 1 13 SER HA 1 28 PHE QD 5.500 . 5.500 5.156 4.867 5.465 . 0 0 "[ . 1 . 2]" 1
429 1 13 SER QB 1 14 HIS H 3.120 . 3.120 3.011 2.703 3.300 0.180 13 0 "[ . 1 . 2]" 1
430 1 13 SER QB 1 16 LEU HB2 4.100 . 4.100 3.803 3.693 4.105 0.005 2 0 "[ . 1 . 2]" 1
431 1 13 SER QB 1 16 LEU HB3 5.340 . 5.340 5.068 4.918 5.339 . 0 0 "[ . 1 . 2]" 1
432 1 13 SER QB 1 16 LEU MD1 3.420 . 3.420 3.370 3.225 3.483 0.063 11 0 "[ . 1 . 2]" 1
433 1 13 SER QB 1 17 VAL QG 4.010 . 4.010 2.999 2.671 3.277 . 0 0 "[ . 1 . 2]" 1
434 1 13 SER QB 1 25 VAL HA 5.090 . 5.090 4.104 3.898 4.944 . 0 0 "[ . 1 . 2]" 1
435 1 13 SER QB 1 25 VAL HB 3.420 . 3.420 3.606 3.051 3.693 0.273 17 0 "[ . 1 . 2]" 1
436 1 13 SER QB 1 25 VAL QG 3.000 . 3.000 1.767 1.714 1.985 0.086 6 0 "[ . 1 . 2]" 1
437 1 13 SER HB2 1 25 VAL MG1 4.540 . 4.540 3.122 2.065 4.517 . 0 0 "[ . 1 . 2]" 1
438 1 13 SER HB2 1 25 VAL MG2 4.540 . 4.540 3.205 2.155 3.482 . 0 0 "[ . 1 . 2]" 1
439 1 13 SER HB3 1 25 VAL MG1 4.540 . 4.540 2.103 1.799 3.766 0.001 6 0 "[ . 1 . 2]" 1
440 1 13 SER HB3 1 25 VAL MG2 4.540 . 4.540 2.133 1.930 3.036 . 0 0 "[ . 1 . 2]" 1
441 1 14 HIS H 1 14 HIS HA 2.900 . 2.900 2.818 2.768 2.851 . 0 0 "[ . 1 . 2]" 1
442 1 14 HIS H 1 14 HIS QB 2.700 . 2.700 2.592 2.535 2.687 . 0 0 "[ . 1 . 2]" 1
443 1 14 HIS H 1 17 VAL QG 4.640 . 4.640 4.490 4.245 4.642 0.002 15 0 "[ . 1 . 2]" 1
444 1 14 HIS H 1 25 VAL QG 5.440 . 5.440 4.522 4.285 5.036 . 0 0 "[ . 1 . 2]" 1
445 1 14 HIS HA 1 14 HIS QB 2.720 . 2.720 2.357 2.329 2.379 . 0 0 "[ . 1 . 2]" 1
446 1 14 HIS HA 1 14 HIS HE1 4.950 . 4.950 4.912 4.839 4.975 0.025 2 0 "[ . 1 . 2]" 1
447 1 14 HIS HA 1 16 LEU H 5.500 . 5.500 4.844 4.713 4.946 . 0 0 "[ . 1 . 2]" 1
448 1 14 HIS HA 1 17 VAL H 4.540 . 4.540 3.885 3.757 3.989 . 0 0 "[ . 1 . 2]" 1
449 1 14 HIS HA 1 17 VAL HB 3.180 . 3.180 3.212 3.130 3.260 0.080 2 0 "[ . 1 . 2]" 1
450 1 14 HIS HA 1 17 VAL QG 4.360 . 4.360 3.405 3.202 3.550 . 0 0 "[ . 1 . 2]" 1
451 1 14 HIS QB 1 14 HIS HD2 3.400 . 3.400 2.574 2.537 2.600 . 0 0 "[ . 1 . 2]" 1
452 1 14 HIS QB 1 14 HIS HE1 4.650 . 4.650 4.560 4.506 4.599 . 0 0 "[ . 1 . 2]" 1
453 1 14 HIS QB 1 16 LEU H 5.500 . 5.500 4.952 4.878 5.024 . 0 0 "[ . 1 . 2]" 1
454 1 14 HIS QB 1 17 VAL H 5.500 . 5.500 5.256 5.167 5.341 . 0 0 "[ . 1 . 2]" 1
455 1 14 HIS QB 1 17 VAL HB 5.500 . 5.500 4.932 4.799 5.011 . 0 0 "[ . 1 . 2]" 1
456 1 14 HIS QB 1 17 VAL QG 5.120 . 5.120 4.748 4.586 4.859 . 0 0 "[ . 1 . 2]" 1
457 1 14 HIS QB 1 18 GLY H 5.460 . 5.460 5.419 5.306 5.496 0.036 1 0 "[ . 1 . 2]" 1
458 1 15 TRP H 1 15 TRP HA 2.870 . 2.870 2.821 2.791 2.845 . 0 0 "[ . 1 . 2]" 1
459 1 15 TRP H 1 15 TRP HB2 3.010 . 3.010 2.795 2.715 2.874 . 0 0 "[ . 1 . 2]" 1
460 1 15 TRP H 1 15 TRP HB3 2.520 . 2.520 2.307 2.265 2.365 . 0 0 "[ . 1 . 2]" 1
461 1 15 TRP H 1 16 LEU H 2.800 . 2.800 2.704 2.592 2.780 . 0 0 "[ . 1 . 2]" 1
462 1 15 TRP H 1 16 LEU HB2 4.900 . 4.900 4.594 4.508 4.707 . 0 0 "[ . 1 . 2]" 1
463 1 15 TRP H 1 16 LEU HG 4.630 . 4.630 4.608 4.472 4.650 0.020 15 0 "[ . 1 . 2]" 1
464 1 15 TRP H 1 17 VAL QG 5.280 . 5.280 4.899 4.762 4.999 . 0 0 "[ . 1 . 2]" 1
465 1 15 TRP HA 1 15 TRP HD1 3.110 . 3.110 2.958 2.759 3.087 . 0 0 "[ . 1 . 2]" 1
466 1 15 TRP HA 1 15 TRP HE3 5.480 . 5.480 4.961 4.904 5.034 . 0 0 "[ . 1 . 2]" 1
467 1 15 TRP HA 1 16 LEU HA 4.940 . 4.940 4.904 4.881 4.932 . 0 0 "[ . 1 . 2]" 1
468 1 15 TRP HA 1 17 VAL H 4.970 . 4.970 4.633 4.531 4.706 . 0 0 "[ . 1 . 2]" 1
469 1 15 TRP HA 1 17 VAL QG 5.440 . 5.440 5.430 5.307 5.492 0.052 14 0 "[ . 1 . 2]" 1
470 1 15 TRP HA 1 18 GLY H 3.680 . 3.680 3.640 3.574 3.692 0.012 4 0 "[ . 1 . 2]" 1
471 1 15 TRP HA 1 18 GLY HA2 5.500 . 5.500 5.498 5.377 5.537 0.037 1 0 "[ . 1 . 2]" 1
472 1 15 TRP HA 1 18 GLY HA3 5.500 . 5.500 3.961 3.794 4.030 . 0 0 "[ . 1 . 2]" 1
473 1 15 TRP HA 1 19 LEU H 5.500 . 5.500 4.940 4.490 5.169 . 0 0 "[ . 1 . 2]" 1
474 1 15 TRP HA 1 19 LEU QD 5.440 . 5.440 3.668 3.524 3.779 . 0 0 "[ . 1 . 2]" 1
475 1 15 TRP HB2 1 15 TRP HD1 3.160 . 3.160 2.881 2.848 2.912 . 0 0 "[ . 1 . 2]" 1
476 1 15 TRP HB2 1 15 TRP HE1 4.920 . 4.920 4.868 4.841 4.890 . 0 0 "[ . 1 . 2]" 1
477 1 15 TRP HB2 1 15 TRP HE3 4.170 . 4.170 3.887 3.857 3.915 . 0 0 "[ . 1 . 2]" 1
478 1 15 TRP HB2 1 16 LEU H 4.040 . 4.040 3.802 3.727 3.860 . 0 0 "[ . 1 . 2]" 1
479 1 15 TRP HB2 1 38 LEU MD1 5.500 . 5.500 3.292 3.017 3.586 . 0 0 "[ . 1 . 2]" 1
480 1 15 TRP HB3 1 15 TRP HZ3 5.500 . 5.500 4.809 4.753 4.846 . 0 0 "[ . 1 . 2]" 1
481 1 15 TRP HB3 1 16 LEU H 2.930 . 2.930 2.386 2.278 2.461 . 0 0 "[ . 1 . 2]" 1
482 1 15 TRP HB3 1 16 LEU MD2 5.170 . 5.170 4.706 4.607 4.816 . 0 0 "[ . 1 . 2]" 1
483 1 15 TRP HB3 1 17 VAL H 5.360 . 5.360 5.114 4.992 5.205 . 0 0 "[ . 1 . 2]" 1
484 1 15 TRP HB3 1 19 LEU QD 5.440 . 5.440 4.142 4.048 4.229 . 0 0 "[ . 1 . 2]" 1
485 1 15 TRP HB3 1 38 LEU HG 5.070 . 5.070 4.772 4.483 5.080 0.010 13 0 "[ . 1 . 2]" 1
486 1 15 TRP HD1 1 19 LEU QD 4.930 . 4.930 3.174 3.084 3.265 . 0 0 "[ . 1 . 2]" 1
487 1 15 TRP HD1 1 63 LYS HB3 5.330 . 5.330 5.289 4.909 5.386 0.056 9 0 "[ . 1 . 2]" 1
488 1 15 TRP HE1 1 19 LEU MD1 4.700 . 4.700 3.546 3.254 3.710 . 0 0 "[ . 1 . 2]" 1
489 1 15 TRP HE1 1 19 LEU QD 3.320 . 3.320 2.588 2.501 2.656 . 0 0 "[ . 1 . 2]" 1
490 1 15 TRP HE1 1 19 LEU MD2 4.700 . 4.700 2.662 2.570 2.800 . 0 0 "[ . 1 . 2]" 1
491 1 15 TRP HE1 1 19 LEU HG 5.500 . 5.500 5.534 5.429 5.598 0.098 3 0 "[ . 1 . 2]" 1
492 1 15 TRP HE1 1 60 VAL MG2 5.500 . 5.500 4.831 4.697 5.055 . 0 0 "[ . 1 . 2]" 1
493 1 15 TRP HE1 1 63 LYS HA 5.500 . 5.500 4.373 4.081 4.559 . 0 0 "[ . 1 . 2]" 1
494 1 15 TRP HE1 1 63 LYS HB2 5.500 . 5.500 4.264 3.991 4.513 . 0 0 "[ . 1 . 2]" 1
495 1 15 TRP HE1 1 63 LYS HB3 3.740 . 3.740 2.803 2.487 2.936 . 0 0 "[ . 1 . 2]" 1
496 1 15 TRP HE1 1 63 LYS HD2 5.190 . 5.190 4.587 4.099 5.174 . 0 0 "[ . 1 . 2]" 1
497 1 15 TRP HE1 1 63 LYS HG3 5.500 . 5.500 2.472 2.091 2.864 . 0 0 "[ . 1 . 2]" 1
498 1 15 TRP HE1 1 64 LEU HB3 5.500 . 5.500 5.367 4.963 5.553 0.053 20 0 "[ . 1 . 2]" 1
499 1 15 TRP HE1 1 67 MET HA 4.420 . 4.420 3.979 3.002 4.550 0.130 20 0 "[ . 1 . 2]" 1
500 1 15 TRP HE1 1 67 MET QB 5.340 . 5.340 3.808 2.262 5.382 0.042 13 0 "[ . 1 . 2]" 1
501 1 15 TRP HE1 1 67 MET QG 4.920 . 4.920 3.883 2.274 4.993 0.073 19 0 "[ . 1 . 2]" 1
502 1 15 TRP HE3 1 16 LEU HA 4.060 . 4.060 3.736 3.540 3.852 . 0 0 "[ . 1 . 2]" 1
503 1 15 TRP HE3 1 16 LEU HB3 5.500 . 5.500 4.888 4.758 4.941 . 0 0 "[ . 1 . 2]" 1
504 1 15 TRP HE3 1 16 LEU MD1 3.950 . 3.950 3.497 3.422 3.568 . 0 0 "[ . 1 . 2]" 1
505 1 15 TRP HE3 1 16 LEU MD2 3.250 . 3.250 3.069 3.009 3.163 . 0 0 "[ . 1 . 2]" 1
506 1 15 TRP HE3 1 16 LEU HG 3.110 . 3.110 2.043 1.968 2.111 . 0 0 "[ . 1 . 2]" 1
507 1 15 TRP HE3 1 19 LEU QD 5.400 . 5.400 3.856 3.692 3.937 . 0 0 "[ . 1 . 2]" 1
508 1 15 TRP HE3 1 38 LEU MD1 3.930 . 3.930 2.657 2.458 2.900 . 0 0 "[ . 1 . 2]" 1
509 1 15 TRP HE3 1 38 LEU MD2 5.500 . 5.500 3.436 3.179 3.683 . 0 0 "[ . 1 . 2]" 1
510 1 15 TRP HE3 1 38 LEU HG 3.610 . 3.610 3.204 3.009 3.366 . 0 0 "[ . 1 . 2]" 1
511 1 15 TRP HE3 1 60 VAL MG2 5.500 . 5.500 4.991 4.821 5.221 . 0 0 "[ . 1 . 2]" 1
512 1 15 TRP HH2 1 16 LEU MD1 5.500 . 5.500 5.477 5.315 5.537 0.037 2 0 "[ . 1 . 2]" 1
513 1 15 TRP HH2 1 19 LEU QD 3.960 . 3.960 3.485 3.333 3.654 . 0 0 "[ . 1 . 2]" 1
514 1 15 TRP HH2 1 38 LEU MD2 3.220 . 3.220 3.129 2.891 3.281 0.061 8 0 "[ . 1 . 2]" 1
515 1 15 TRP HH2 1 41 LEU QD 3.590 . 3.590 2.564 2.402 2.686 . 0 0 "[ . 1 . 2]" 1
516 1 15 TRP HH2 1 41 LEU HG 5.260 . 5.260 5.220 4.979 5.326 0.066 12 0 "[ . 1 . 2]" 1
517 1 15 TRP HH2 1 60 VAL HB 4.340 . 4.340 4.141 3.965 4.261 . 0 0 "[ . 1 . 2]" 1
518 1 15 TRP HH2 1 63 LYS HB3 5.500 . 5.500 4.371 4.246 4.491 . 0 0 "[ . 1 . 2]" 1
519 1 15 TRP HH2 1 64 LEU H 4.760 . 4.760 4.612 4.337 4.794 0.034 18 0 "[ . 1 . 2]" 1
520 1 15 TRP HH2 1 64 LEU HB3 5.240 . 5.240 3.079 2.557 3.465 . 0 0 "[ . 1 . 2]" 1
521 1 15 TRP HZ2 1 16 LEU MD2 5.500 . 5.500 4.622 4.499 4.758 . 0 0 "[ . 1 . 2]" 1
522 1 15 TRP HZ2 1 19 LEU QD 3.400 . 3.400 2.781 2.698 2.967 . 0 0 "[ . 1 . 2]" 1
523 1 15 TRP HZ2 1 21 LEU MD1 5.500 . 5.500 5.598 5.540 5.656 0.156 8 0 "[ . 1 . 2]" 1
524 1 15 TRP HZ2 1 21 LEU HG 5.280 . 5.280 5.024 4.916 5.177 . 0 0 "[ . 1 . 2]" 1
525 1 15 TRP HZ2 1 38 LEU MD1 5.460 . 5.460 5.011 4.687 5.229 . 0 0 "[ . 1 . 2]" 1
526 1 15 TRP HZ2 1 38 LEU MD2 5.500 . 5.500 3.270 3.059 3.432 . 0 0 "[ . 1 . 2]" 1
527 1 15 TRP HZ2 1 60 VAL HA 4.700 . 4.700 3.635 3.295 3.893 . 0 0 "[ . 1 . 2]" 1
528 1 15 TRP HZ2 1 63 LYS H 4.660 . 4.660 4.609 4.362 4.695 0.035 2 0 "[ . 1 . 2]" 1
529 1 15 TRP HZ2 1 63 LYS HA 4.930 . 4.930 4.762 4.540 4.860 . 0 0 "[ . 1 . 2]" 1
530 1 15 TRP HZ2 1 63 LYS HG2 4.700 . 4.700 3.911 3.589 4.397 . 0 0 "[ . 1 . 2]" 1
531 1 15 TRP HZ2 1 64 LEU HA 3.830 . 3.830 2.964 2.535 3.437 . 0 0 "[ . 1 . 2]" 1
532 1 15 TRP HZ2 1 67 MET QG 5.340 . 5.340 4.080 3.221 5.219 . 0 0 "[ . 1 . 2]" 1
533 1 15 TRP HZ3 1 16 LEU H 5.320 . 5.320 4.793 4.676 4.913 . 0 0 "[ . 1 . 2]" 1
534 1 15 TRP HZ3 1 16 LEU HA 5.080 . 5.080 4.442 4.194 4.622 . 0 0 "[ . 1 . 2]" 1
535 1 15 TRP HZ3 1 16 LEU MD1 4.610 . 4.610 3.634 3.477 3.699 . 0 0 "[ . 1 . 2]" 1
536 1 15 TRP HZ3 1 16 LEU MD2 3.170 . 3.170 2.240 2.163 2.319 . 0 0 "[ . 1 . 2]" 1
537 1 15 TRP HZ3 1 16 LEU HG 4.290 . 4.290 3.040 2.867 3.182 . 0 0 "[ . 1 . 2]" 1
538 1 15 TRP HZ3 1 19 LEU QD 4.930 . 4.930 4.068 3.904 4.198 . 0 0 "[ . 1 . 2]" 1
539 1 15 TRP HZ3 1 21 LEU MD1 5.240 . 5.240 5.026 4.855 5.246 0.006 18 0 "[ . 1 . 2]" 1
540 1 15 TRP HZ3 1 21 LEU HG 5.500 . 5.500 5.500 5.366 5.576 0.076 12 0 "[ . 1 . 2]" 1
541 1 15 TRP HZ3 1 38 LEU MD1 4.080 . 4.080 3.779 3.535 3.996 . 0 0 "[ . 1 . 2]" 1
542 1 15 TRP HZ3 1 38 LEU MD2 5.500 . 5.500 3.299 3.084 3.504 . 0 0 "[ . 1 . 2]" 1
543 1 15 TRP HZ3 1 38 LEU HG 4.190 . 4.190 2.866 2.662 3.060 . 0 0 "[ . 1 . 2]" 1
544 1 15 TRP HZ3 1 41 LEU QD 5.440 . 5.440 2.881 2.682 3.051 . 0 0 "[ . 1 . 2]" 1
545 1 15 TRP HZ3 1 60 VAL HB 5.500 . 5.500 5.553 5.522 5.587 0.087 6 0 "[ . 1 . 2]" 1
546 1 15 TRP HZ3 1 60 VAL MG2 5.500 . 5.500 3.382 3.246 3.557 . 0 0 "[ . 1 . 2]" 1
547 1 16 LEU H 1 16 LEU HA 2.940 . 2.940 2.746 2.714 2.776 . 0 0 "[ . 1 . 2]" 1
548 1 16 LEU H 1 16 LEU HB2 2.640 . 2.640 2.440 2.391 2.480 . 0 0 "[ . 1 . 2]" 1
549 1 16 LEU H 1 16 LEU HB3 3.620 . 3.620 3.578 3.568 3.609 . 0 0 "[ . 1 . 2]" 1
550 1 16 LEU H 1 16 LEU MD1 3.340 . 3.340 3.316 3.249 3.353 0.013 15 0 "[ . 1 . 2]" 1
551 1 16 LEU H 1 16 LEU MD2 3.820 . 3.820 3.607 3.570 3.669 . 0 0 "[ . 1 . 2]" 1
552 1 16 LEU H 1 16 LEU HG 2.610 . 2.610 2.272 2.220 2.322 . 0 0 "[ . 1 . 2]" 1
553 1 16 LEU H 1 17 VAL H 3.040 . 3.040 2.975 2.932 3.010 . 0 0 "[ . 1 . 2]" 1
554 1 16 LEU H 1 17 VAL HA 5.500 . 5.500 5.507 5.491 5.523 0.023 2 0 "[ . 1 . 2]" 1
555 1 16 LEU H 1 19 LEU H 5.500 . 5.500 5.172 4.968 5.276 . 0 0 "[ . 1 . 2]" 1
556 1 16 LEU H 1 19 LEU QD 4.860 . 4.860 3.603 3.477 3.682 . 0 0 "[ . 1 . 2]" 1
557 1 16 LEU H 1 21 LEU HB2 5.500 . 5.500 5.155 5.039 5.319 . 0 0 "[ . 1 . 2]" 1
558 1 16 LEU H 1 25 VAL QG 5.440 . 5.440 4.108 3.941 4.835 . 0 0 "[ . 1 . 2]" 1
559 1 16 LEU HA 1 16 LEU HB3 2.660 . 2.660 2.516 2.490 2.600 . 0 0 "[ . 1 . 2]" 1
560 1 16 LEU HA 1 16 LEU MD1 4.120 . 4.120 3.864 3.836 3.881 . 0 0 "[ . 1 . 2]" 1
561 1 16 LEU HA 1 16 LEU MD2 2.850 . 2.850 2.238 2.178 2.307 . 0 0 "[ . 1 . 2]" 1
562 1 16 LEU HA 1 16 LEU HG 3.830 . 3.830 2.837 2.773 2.872 . 0 0 "[ . 1 . 2]" 1
563 1 16 LEU HA 1 18 GLY H 4.840 . 4.840 3.995 3.856 4.127 . 0 0 "[ . 1 . 2]" 1
564 1 16 LEU HA 1 19 LEU H 4.160 . 4.160 3.663 3.581 3.727 . 0 0 "[ . 1 . 2]" 1
565 1 16 LEU HA 1 19 LEU HB2 5.500 . 5.500 5.517 5.462 5.577 0.077 11 0 "[ . 1 . 2]" 1
566 1 16 LEU HA 1 19 LEU HB3 5.500 . 5.500 5.242 5.130 5.384 . 0 0 "[ . 1 . 2]" 1
567 1 16 LEU HA 1 19 LEU MD1 4.490 . 4.490 3.498 3.296 3.796 . 0 0 "[ . 1 . 2]" 1
568 1 16 LEU HA 1 19 LEU QD 3.710 . 3.710 2.126 1.958 2.346 . 0 0 "[ . 1 . 2]" 1
569 1 16 LEU HA 1 19 LEU MD2 4.490 . 4.490 2.147 1.964 2.393 . 0 0 "[ . 1 . 2]" 1
570 1 16 LEU HA 1 19 LEU HG 5.500 . 5.500 3.037 2.883 3.392 . 0 0 "[ . 1 . 2]" 1
571 1 16 LEU HA 1 21 LEU HB2 3.900 . 3.900 2.465 2.377 2.626 . 0 0 "[ . 1 . 2]" 1
572 1 16 LEU HA 1 21 LEU HB3 5.140 . 5.140 3.109 3.006 3.265 . 0 0 "[ . 1 . 2]" 1
573 1 16 LEU HA 1 21 LEU HG 4.340 . 4.340 3.983 3.809 4.162 . 0 0 "[ . 1 . 2]" 1
574 1 16 LEU HB2 1 16 LEU MD1 3.310 . 3.310 2.276 2.250 2.300 . 0 0 "[ . 1 . 2]" 1
575 1 16 LEU HB2 1 17 VAL H 3.860 . 3.860 2.378 2.308 2.449 . 0 0 "[ . 1 . 2]" 1
576 1 16 LEU HB2 1 19 LEU H 5.500 . 5.500 5.575 5.553 5.604 0.104 2 0 "[ . 1 . 2]" 1
577 1 16 LEU HB2 1 22 ASP H 5.500 . 5.500 5.017 4.808 5.262 . 0 0 "[ . 1 . 2]" 1
578 1 16 LEU HB2 1 24 TYR H 5.500 . 5.500 5.339 5.194 5.466 . 0 0 "[ . 1 . 2]" 1
579 1 16 LEU HB2 1 24 TYR HB2 5.500 . 5.500 5.230 5.121 5.425 . 0 0 "[ . 1 . 2]" 1
580 1 16 LEU HB2 1 25 VAL HA 5.500 . 5.500 4.545 4.420 4.797 . 0 0 "[ . 1 . 2]" 1
581 1 16 LEU HB2 1 25 VAL QG 3.510 . 3.510 2.340 2.163 3.094 . 0 0 "[ . 1 . 2]" 1
582 1 16 LEU HB3 1 16 LEU MD1 3.270 . 3.270 2.493 2.466 2.529 . 0 0 "[ . 1 . 2]" 1
583 1 16 LEU HB3 1 17 VAL H 4.110 . 4.110 3.324 3.229 3.433 . 0 0 "[ . 1 . 2]" 1
584 1 16 LEU HB3 1 21 LEU HB2 4.920 . 4.920 3.213 3.020 3.703 . 0 0 "[ . 1 . 2]" 1
585 1 16 LEU HB3 1 21 LEU HG 5.500 . 5.500 5.013 4.826 5.465 . 0 0 "[ . 1 . 2]" 1
586 1 16 LEU HB3 1 22 ASP H 4.720 . 4.720 3.925 3.755 4.151 . 0 0 "[ . 1 . 2]" 1
587 1 16 LEU HB3 1 22 ASP HA 5.120 . 5.120 2.968 2.635 3.195 . 0 0 "[ . 1 . 2]" 1
588 1 16 LEU HB3 1 23 GLN H 5.500 . 5.500 4.959 4.721 5.260 . 0 0 "[ . 1 . 2]" 1
589 1 16 LEU HB3 1 24 TYR H 4.650 . 4.650 3.924 3.822 4.055 . 0 0 "[ . 1 . 2]" 1
590 1 16 LEU HB3 1 24 TYR HB2 4.290 . 4.290 3.730 3.645 3.856 . 0 0 "[ . 1 . 2]" 1
591 1 16 LEU HB3 1 24 TYR QD 5.500 . 5.500 5.498 5.327 5.592 0.092 2 0 "[ . 1 . 2]" 1
592 1 16 LEU HB3 1 25 VAL H 3.850 . 3.850 3.721 3.299 3.860 0.010 19 0 "[ . 1 . 2]" 1
593 1 16 LEU HB3 1 25 VAL QG 2.750 . 2.750 2.616 2.492 2.863 0.113 2 0 "[ . 1 . 2]" 1
594 1 16 LEU MD1 1 17 VAL H 4.810 . 4.810 4.233 4.188 4.296 . 0 0 "[ . 1 . 2]" 1
595 1 16 LEU MD1 1 24 TYR H 4.520 . 4.520 3.944 3.799 4.173 . 0 0 "[ . 1 . 2]" 1
596 1 16 LEU MD1 1 24 TYR HA 4.850 . 4.850 4.588 4.510 4.707 . 0 0 "[ . 1 . 2]" 1
597 1 16 LEU MD1 1 24 TYR HB2 4.290 . 4.290 3.421 3.267 3.780 . 0 0 "[ . 1 . 2]" 1
598 1 16 LEU MD1 1 24 TYR HB3 3.830 . 3.830 3.000 2.801 3.175 . 0 0 "[ . 1 . 2]" 1
599 1 16 LEU MD1 1 24 TYR QD 4.600 . 4.600 4.466 4.253 4.645 0.045 11 0 "[ . 1 . 2]" 1
600 1 16 LEU MD1 1 25 VAL H 3.640 . 3.640 2.794 2.615 2.918 . 0 0 "[ . 1 . 2]" 1
601 1 16 LEU MD1 1 25 VAL HA 2.820 . 2.820 2.221 2.074 2.306 . 0 0 "[ . 1 . 2]" 1
602 1 16 LEU MD1 1 25 VAL HB 4.300 . 4.300 3.739 1.855 3.985 . 0 0 "[ . 1 . 2]" 1
603 1 16 LEU MD1 1 25 VAL MG1 4.230 . 4.230 3.133 2.827 3.282 . 0 0 "[ . 1 . 2]" 1
604 1 16 LEU MD1 1 25 VAL QG 3.030 . 3.030 1.935 1.813 2.592 . 0 0 "[ . 1 . 2]" 1
605 1 16 LEU MD1 1 25 VAL MG2 4.230 . 4.230 1.988 1.830 3.012 . 0 0 "[ . 1 . 2]" 1
606 1 16 LEU MD1 1 26 SER H 5.000 . 5.000 4.666 4.472 4.739 . 0 0 "[ . 1 . 2]" 1
607 1 16 LEU MD1 1 28 PHE H 4.200 . 4.200 4.048 3.985 4.106 . 0 0 "[ . 1 . 2]" 1
608 1 16 LEU MD1 1 28 PHE HA 5.500 . 5.500 4.451 4.385 4.579 . 0 0 "[ . 1 . 2]" 1
609 1 16 LEU MD1 1 28 PHE HB2 3.530 . 3.530 2.469 2.421 2.537 . 0 0 "[ . 1 . 2]" 1
610 1 16 LEU MD1 1 28 PHE HB3 4.010 . 4.010 2.704 2.632 2.835 . 0 0 "[ . 1 . 2]" 1
611 1 16 LEU MD1 1 28 PHE QD 3.300 . 3.300 2.542 2.270 2.649 . 0 0 "[ . 1 . 2]" 1
612 1 16 LEU MD1 1 28 PHE QE 3.880 . 3.880 3.430 3.314 3.555 . 0 0 "[ . 1 . 2]" 1
613 1 16 LEU MD1 1 28 PHE HZ 4.700 . 4.700 4.345 4.074 4.592 . 0 0 "[ . 1 . 2]" 1
614 1 16 LEU MD1 1 29 SER H 5.090 . 5.090 4.532 4.377 4.742 . 0 0 "[ . 1 . 2]" 1
615 1 16 LEU MD1 1 38 LEU HG 5.070 . 5.070 5.036 4.930 5.104 0.034 11 0 "[ . 1 . 2]" 1
616 1 16 LEU MD2 1 17 VAL H 5.170 . 5.170 4.706 4.656 4.756 . 0 0 "[ . 1 . 2]" 1
617 1 16 LEU MD2 1 19 LEU QD 3.850 . 3.850 2.913 2.748 3.063 . 0 0 "[ . 1 . 2]" 1
618 1 16 LEU MD2 1 21 LEU H 4.770 . 4.770 4.524 4.378 4.592 . 0 0 "[ . 1 . 2]" 1
619 1 16 LEU MD2 1 21 LEU HB2 4.130 . 4.130 2.891 2.772 3.021 . 0 0 "[ . 1 . 2]" 1
620 1 16 LEU MD2 1 21 LEU HB3 4.210 . 4.210 2.075 1.947 2.211 . 0 0 "[ . 1 . 2]" 1
621 1 16 LEU MD2 1 21 LEU MD1 3.190 . 3.190 2.829 2.688 3.028 . 0 0 "[ . 1 . 2]" 1
622 1 16 LEU MD2 1 24 TYR H 3.940 . 3.940 3.618 3.370 3.748 . 0 0 "[ . 1 . 2]" 1
623 1 16 LEU MD2 1 24 TYR HB2 4.150 . 4.150 2.224 2.047 2.401 . 0 0 "[ . 1 . 2]" 1
624 1 16 LEU MD2 1 24 TYR HB3 3.940 . 3.940 2.461 2.235 2.743 . 0 0 "[ . 1 . 2]" 1
625 1 16 LEU MD2 1 24 TYR QD 3.860 . 3.860 3.669 3.481 3.800 . 0 0 "[ . 1 . 2]" 1
626 1 16 LEU MD2 1 25 VAL H 4.680 . 4.680 3.790 3.381 3.918 . 0 0 "[ . 1 . 2]" 1
627 1 16 LEU MD2 1 25 VAL HA 4.250 . 4.250 4.196 3.904 4.268 0.018 16 0 "[ . 1 . 2]" 1
628 1 16 LEU MD2 1 25 VAL QG 4.390 . 4.390 3.472 3.367 3.788 . 0 0 "[ . 1 . 2]" 1
629 1 16 LEU MD2 1 28 PHE HA 5.500 . 5.500 5.551 5.527 5.573 0.073 17 0 "[ . 1 . 2]" 1
630 1 16 LEU MD2 1 28 PHE HB2 4.850 . 4.850 4.018 3.895 4.165 . 0 0 "[ . 1 . 2]" 1
631 1 16 LEU MD2 1 28 PHE QD 4.770 . 4.770 3.346 3.268 3.377 . 0 0 "[ . 1 . 2]" 1
632 1 16 LEU MD2 1 28 PHE QE 3.950 . 3.950 2.985 2.768 3.093 . 0 0 "[ . 1 . 2]" 1
633 1 16 LEU MD2 1 28 PHE HZ 4.070 . 4.070 3.147 2.787 3.347 . 0 0 "[ . 1 . 2]" 1
634 1 16 LEU MD2 1 38 LEU MD2 5.500 . 5.500 4.610 4.419 4.747 . 0 0 "[ . 1 . 2]" 1
635 1 16 LEU MD2 1 38 LEU HG 5.500 . 5.500 4.537 4.462 4.674 . 0 0 "[ . 1 . 2]" 1
636 1 16 LEU MD2 1 41 LEU QD 5.440 . 5.440 3.771 3.646 3.891 . 0 0 "[ . 1 . 2]" 1
637 1 16 LEU MD2 1 60 VAL MG2 5.500 . 5.500 3.210 2.998 3.438 . 0 0 "[ . 1 . 2]" 1
638 1 16 LEU HG 1 28 PHE QD 5.500 . 5.500 4.121 3.856 4.265 . 0 0 "[ . 1 . 2]" 1
639 1 17 VAL H 1 17 VAL HB 2.400 . 2.400 2.420 2.388 2.445 0.045 18 0 "[ . 1 . 2]" 1
640 1 17 VAL H 1 17 VAL MG1 3.810 . 3.810 3.746 3.725 3.761 . 0 0 "[ . 1 . 2]" 1
641 1 17 VAL H 1 17 VAL QG 2.700 . 2.700 2.053 1.991 2.137 . 0 0 "[ . 1 . 2]" 1
642 1 17 VAL H 1 17 VAL MG2 3.810 . 3.810 2.063 1.999 2.150 . 0 0 "[ . 1 . 2]" 1
643 1 17 VAL H 1 19 LEU H 4.490 . 4.490 4.315 4.279 4.406 . 0 0 "[ . 1 . 2]" 1
644 1 17 VAL H 1 19 LEU QD 4.810 . 4.810 4.197 4.085 4.337 . 0 0 "[ . 1 . 2]" 1
645 1 17 VAL H 1 22 ASP HA 5.500 . 5.500 3.860 3.753 4.029 . 0 0 "[ . 1 . 2]" 1
646 1 17 VAL H 1 22 ASP QB 5.030 . 5.030 4.197 3.904 4.461 . 0 0 "[ . 1 . 2]" 1
647 1 17 VAL H 1 25 VAL QG 4.170 . 4.170 3.459 3.286 3.940 . 0 0 "[ . 1 . 2]" 1
648 1 17 VAL HA 1 17 VAL MG1 3.240 . 3.240 2.466 2.407 2.502 . 0 0 "[ . 1 . 2]" 1
649 1 17 VAL HA 1 17 VAL QG 2.680 . 2.680 2.163 2.123 2.189 . 0 0 "[ . 1 . 2]" 1
650 1 17 VAL HA 1 17 VAL MG2 3.240 . 3.240 2.395 2.338 2.454 . 0 0 "[ . 1 . 2]" 1
651 1 17 VAL HA 1 18 GLY H 3.460 . 3.460 3.462 3.438 3.478 0.018 16 0 "[ . 1 . 2]" 1
652 1 17 VAL HA 1 18 GLY QA 5.340 . 5.340 4.446 4.392 4.472 . 0 0 "[ . 1 . 2]" 1
653 1 17 VAL HA 1 19 LEU H 4.520 . 4.520 4.129 3.993 4.369 . 0 0 "[ . 1 . 2]" 1
654 1 17 VAL HA 1 20 SER H 4.020 . 4.020 3.578 3.433 3.783 . 0 0 "[ . 1 . 2]" 1
655 1 17 VAL HA 1 20 SER HA 4.540 . 4.540 3.641 3.336 4.019 . 0 0 "[ . 1 . 2]" 1
656 1 17 VAL HA 1 21 LEU H 3.430 . 3.430 3.340 3.089 3.488 0.058 10 0 "[ . 1 . 2]" 1
657 1 17 VAL HA 1 22 ASP H 3.310 . 3.310 2.659 2.601 2.725 . 0 0 "[ . 1 . 2]" 1
658 1 17 VAL HA 1 22 ASP HA 3.990 . 3.990 3.108 2.844 3.279 . 0 0 "[ . 1 . 2]" 1
659 1 17 VAL HA 1 22 ASP QB 2.840 . 2.840 2.134 1.962 2.454 . 0 0 "[ . 1 . 2]" 1
660 1 17 VAL HA 1 25 VAL QG 4.700 . 4.700 4.065 3.903 4.246 . 0 0 "[ . 1 . 2]" 1
661 1 17 VAL HB 1 18 GLY HA2 5.500 . 5.500 4.361 4.289 4.467 . 0 0 "[ . 1 . 2]" 1
662 1 17 VAL HB 1 18 GLY QA 4.720 . 4.720 4.015 3.945 4.095 . 0 0 "[ . 1 . 2]" 1
663 1 17 VAL HB 1 18 GLY HA3 5.500 . 5.500 4.695 4.605 4.778 . 0 0 "[ . 1 . 2]" 1
664 1 17 VAL HB 1 19 LEU H 5.500 . 5.500 5.180 5.077 5.320 . 0 0 "[ . 1 . 2]" 1
665 1 17 VAL HB 1 22 ASP H 5.500 . 5.500 5.608 5.571 5.663 0.163 11 0 "[ . 1 . 2]" 1
666 1 17 VAL QG 1 18 GLY H 3.800 . 3.800 3.465 3.366 3.575 . 0 0 "[ . 1 . 2]" 1
667 1 17 VAL QG 1 18 GLY QA 3.670 . 3.670 3.422 3.331 3.575 . 0 0 "[ . 1 . 2]" 1
668 1 17 VAL QG 1 19 LEU H 5.440 . 5.440 4.600 4.502 4.776 . 0 0 "[ . 1 . 2]" 1
669 1 17 VAL QG 1 20 SER H 5.400 . 5.400 4.175 4.032 4.424 . 0 0 "[ . 1 . 2]" 1
670 1 17 VAL QG 1 22 ASP H 4.890 . 4.890 3.578 3.479 3.674 . 0 0 "[ . 1 . 2]" 1
671 1 17 VAL QG 1 22 ASP HA 3.140 . 3.140 2.504 2.286 2.747 . 0 0 "[ . 1 . 2]" 1
672 1 17 VAL QG 1 22 ASP QB 3.450 . 3.450 1.899 1.798 2.075 0.002 2 0 "[ . 1 . 2]" 1
673 1 17 VAL QG 1 23 GLN H 5.440 . 5.440 4.893 4.770 5.024 . 0 0 "[ . 1 . 2]" 1
674 1 17 VAL MG1 1 22 ASP QB 4.370 . 4.370 2.497 2.168 2.738 . 0 0 "[ . 1 . 2]" 1
675 1 17 VAL MG2 1 22 ASP QB 4.370 . 4.370 1.978 1.848 2.337 . 0 0 "[ . 1 . 2]" 1
676 1 18 GLY H 1 18 GLY QA 2.440 . 2.440 2.192 2.161 2.216 . 0 0 "[ . 1 . 2]" 1
677 1 18 GLY H 1 19 LEU H 2.650 . 2.650 2.435 2.231 2.523 . 0 0 "[ . 1 . 2]" 1
678 1 18 GLY H 1 19 LEU HA 5.500 . 5.500 5.079 4.894 5.169 . 0 0 "[ . 1 . 2]" 1
679 1 18 GLY H 1 19 LEU HB3 5.500 . 5.500 5.295 5.134 5.443 . 0 0 "[ . 1 . 2]" 1
680 1 18 GLY H 1 19 LEU MD1 5.500 . 5.500 5.589 5.549 5.633 0.133 11 0 "[ . 1 . 2]" 1
681 1 18 GLY H 1 19 LEU QD 4.500 . 4.500 3.049 2.939 3.158 . 0 0 "[ . 1 . 2]" 1
682 1 18 GLY H 1 19 LEU MD2 5.500 . 5.500 3.063 2.950 3.176 . 0 0 "[ . 1 . 2]" 1
683 1 18 GLY H 1 21 LEU HB2 5.370 . 5.370 5.106 4.945 5.260 . 0 0 "[ . 1 . 2]" 1
684 1 18 GLY QA 1 19 LEU H 3.040 . 3.040 2.788 2.720 2.869 . 0 0 "[ . 1 . 2]" 1
685 1 18 GLY QA 1 19 LEU HB3 5.100 . 5.100 4.548 4.404 4.676 . 0 0 "[ . 1 . 2]" 1
686 1 18 GLY QA 1 19 LEU QD 5.280 . 5.280 3.375 3.223 3.732 . 0 0 "[ . 1 . 2]" 1
687 1 18 GLY QA 1 20 SER H 4.570 . 4.570 3.558 3.388 3.758 . 0 0 "[ . 1 . 2]" 1
688 1 18 GLY HA2 1 19 LEU H 3.540 . 3.540 3.484 3.443 3.508 . 0 0 "[ . 1 . 2]" 1
689 1 18 GLY HA3 1 19 LEU H 3.540 . 3.540 2.935 2.835 3.057 . 0 0 "[ . 1 . 2]" 1
690 1 19 LEU H 1 19 LEU HB2 3.980 . 3.980 3.744 3.703 3.782 . 0 0 "[ . 1 . 2]" 1
691 1 19 LEU H 1 19 LEU HB3 3.120 . 3.120 3.158 3.129 3.184 0.064 9 0 "[ . 1 . 2]" 1
692 1 19 LEU H 1 19 LEU MD1 4.190 . 4.190 3.988 3.898 4.094 . 0 0 "[ . 1 . 2]" 1
693 1 19 LEU H 1 19 LEU QD 3.170 . 3.170 1.834 1.778 1.923 0.022 15 0 "[ . 1 . 2]" 1
694 1 19 LEU H 1 19 LEU MD2 4.190 . 4.190 1.837 1.780 1.927 0.020 15 0 "[ . 1 . 2]" 1
695 1 19 LEU H 1 19 LEU HG 3.250 . 3.250 2.678 2.457 3.089 . 0 0 "[ . 1 . 2]" 1
696 1 19 LEU H 1 20 SER H 2.880 . 2.880 2.486 2.399 2.610 . 0 0 "[ . 1 . 2]" 1
697 1 19 LEU H 1 21 LEU H 3.670 . 3.670 3.145 3.011 3.370 . 0 0 "[ . 1 . 2]" 1
698 1 19 LEU H 1 21 LEU HB2 5.160 . 5.160 3.747 3.637 3.854 . 0 0 "[ . 1 . 2]" 1
699 1 19 LEU HA 1 19 LEU QD 4.130 . 4.130 3.359 3.309 3.401 . 0 0 "[ . 1 . 2]" 1
700 1 19 LEU HA 1 19 LEU HG 4.220 . 4.220 3.760 3.714 3.810 . 0 0 "[ . 1 . 2]" 1
701 1 19 LEU HA 1 21 LEU H 5.500 . 5.500 4.516 4.396 4.758 . 0 0 "[ . 1 . 2]" 1
702 1 19 LEU HA 1 59 LEU QD 4.470 . 4.470 3.721 3.458 4.032 . 0 0 "[ . 1 . 2]" 1
703 1 19 LEU HB2 1 20 SER H 4.990 . 4.990 4.377 4.348 4.407 . 0 0 "[ . 1 . 2]" 1
704 1 19 LEU HB2 1 21 LEU H 5.470 . 5.470 4.473 4.283 4.794 . 0 0 "[ . 1 . 2]" 1
705 1 19 LEU HB2 1 63 LYS HE2 3.890 . 3.890 3.431 3.262 3.744 . 0 0 "[ . 1 . 2]" 1
706 1 19 LEU HB3 1 19 LEU QD 3.000 . 3.000 2.060 2.045 2.076 . 0 0 "[ . 1 . 2]" 1
707 1 19 LEU HB3 1 20 SER H 4.680 . 4.680 4.601 4.528 4.683 0.003 20 0 "[ . 1 . 2]" 1
708 1 19 LEU HB3 1 21 LEU H 5.500 . 5.500 5.077 4.957 5.308 . 0 0 "[ . 1 . 2]" 1
709 1 19 LEU HB3 1 21 LEU HB2 5.460 . 5.460 4.886 4.760 4.967 . 0 0 "[ . 1 . 2]" 1
710 1 19 LEU HB3 1 21 LEU HG 5.500 . 5.500 5.067 4.948 5.153 . 0 0 "[ . 1 . 2]" 1
711 1 19 LEU HB3 1 63 LYS HA 5.500 . 5.500 5.573 5.513 5.650 0.150 20 0 "[ . 1 . 2]" 1
712 1 19 LEU QD 1 20 SER H 4.010 . 4.010 3.853 3.695 3.952 . 0 0 "[ . 1 . 2]" 1
713 1 19 LEU QD 1 20 SER QB 5.280 . 5.280 4.781 4.686 4.920 . 0 0 "[ . 1 . 2]" 1
714 1 19 LEU QD 1 21 LEU H 4.460 . 4.460 3.481 3.344 3.612 . 0 0 "[ . 1 . 2]" 1
715 1 19 LEU QD 1 21 LEU HB2 3.630 . 3.630 2.603 2.366 2.723 . 0 0 "[ . 1 . 2]" 1
716 1 19 LEU QD 1 21 LEU MD1 3.990 . 3.990 3.145 3.067 3.235 . 0 0 "[ . 1 . 2]" 1
717 1 19 LEU QD 1 21 LEU MD2 3.840 . 3.840 2.188 2.079 2.336 . 0 0 "[ . 1 . 2]" 1
718 1 19 LEU QD 1 21 LEU HG 2.650 . 2.650 1.911 1.855 2.016 . 0 0 "[ . 1 . 2]" 1
719 1 19 LEU QD 1 38 LEU MD2 5.440 . 5.440 4.268 4.107 4.375 . 0 0 "[ . 1 . 2]" 1
720 1 19 LEU QD 1 59 LEU HB2 5.440 . 5.440 4.895 4.583 5.268 . 0 0 "[ . 1 . 2]" 1
721 1 19 LEU QD 1 59 LEU QD 3.490 . 3.490 2.625 1.876 3.031 . 0 0 "[ . 1 . 2]" 1
722 1 19 LEU QD 1 59 LEU HG 4.850 . 4.850 2.893 2.309 4.152 . 0 0 "[ . 1 . 2]" 1
723 1 19 LEU QD 1 60 VAL H 4.950 . 4.950 3.697 3.504 3.925 . 0 0 "[ . 1 . 2]" 1
724 1 19 LEU QD 1 60 VAL HA 3.590 . 3.590 2.238 2.066 2.364 . 0 0 "[ . 1 . 2]" 1
725 1 19 LEU QD 1 60 VAL MG1 4.400 . 4.400 3.862 3.755 4.084 . 0 0 "[ . 1 . 2]" 1
726 1 19 LEU QD 1 60 VAL MG2 3.490 . 3.490 2.473 2.314 2.788 . 0 0 "[ . 1 . 2]" 1
727 1 19 LEU QD 1 63 LYS H 5.440 . 5.440 3.767 3.653 3.910 . 0 0 "[ . 1 . 2]" 1
728 1 19 LEU QD 1 63 LYS HA 5.040 . 5.040 4.040 3.952 4.113 . 0 0 "[ . 1 . 2]" 1
729 1 19 LEU QD 1 63 LYS HB2 4.610 . 4.610 2.113 2.020 2.230 . 0 0 "[ . 1 . 2]" 1
730 1 19 LEU QD 1 63 LYS HB3 4.040 . 4.040 2.262 2.086 2.451 . 0 0 "[ . 1 . 2]" 1
731 1 19 LEU QD 1 63 LYS HE2 4.650 . 4.650 2.874 2.753 3.097 . 0 0 "[ . 1 . 2]" 1
732 1 19 LEU QD 1 63 LYS HE3 4.210 . 4.210 2.521 2.317 2.760 . 0 0 "[ . 1 . 2]" 1
733 1 19 LEU QD 1 63 LYS HG2 3.420 . 3.420 1.782 1.748 1.847 0.052 19 0 "[ . 1 . 2]" 1
734 1 19 LEU QD 1 63 LYS HG3 4.220 . 4.220 2.940 2.802 3.130 . 0 0 "[ . 1 . 2]" 1
735 1 19 LEU MD1 1 20 SER H 5.240 . 5.240 5.036 4.956 5.132 . 0 0 "[ . 1 . 2]" 1
736 1 19 LEU MD1 1 21 LEU H 5.500 . 5.500 4.160 4.017 4.499 . 0 0 "[ . 1 . 2]" 1
737 1 19 LEU MD1 1 21 LEU MD1 4.720 . 4.720 3.214 3.124 3.317 . 0 0 "[ . 1 . 2]" 1
738 1 19 LEU MD1 1 63 LYS HB3 4.600 . 4.600 2.305 2.133 2.510 . 0 0 "[ . 1 . 2]" 1
739 1 19 LEU MD1 1 63 LYS HE3 4.840 . 4.840 2.575 2.359 2.835 . 0 0 "[ . 1 . 2]" 1
740 1 19 LEU MD1 1 63 LYS HG2 4.110 . 4.110 1.958 1.902 2.053 . 0 0 "[ . 1 . 2]" 1
741 1 19 LEU MD1 1 63 LYS HG3 5.150 . 5.150 3.346 3.283 3.416 . 0 0 "[ . 1 . 2]" 1
742 1 19 LEU MD2 1 20 SER H 5.240 . 5.240 4.001 3.795 4.131 . 0 0 "[ . 1 . 2]" 1
743 1 19 LEU MD2 1 21 LEU H 5.500 . 5.500 3.747 3.462 3.972 . 0 0 "[ . 1 . 2]" 1
744 1 19 LEU MD2 1 21 LEU MD1 4.720 . 4.720 4.486 4.122 4.724 0.004 4 0 "[ . 1 . 2]" 1
745 1 19 LEU MD2 1 63 LYS HB3 4.600 . 4.600 3.292 2.866 3.610 . 0 0 "[ . 1 . 2]" 1
746 1 19 LEU MD2 1 63 LYS HE3 4.840 . 4.840 3.606 3.388 4.047 . 0 0 "[ . 1 . 2]" 1
747 1 19 LEU MD2 1 63 LYS HG2 4.110 . 4.110 2.067 1.940 2.504 . 0 0 "[ . 1 . 2]" 1
748 1 19 LEU MD2 1 63 LYS HG3 5.150 . 5.150 3.270 3.010 3.805 . 0 0 "[ . 1 . 2]" 1
749 1 19 LEU HG 1 21 LEU H 5.320 . 5.320 2.719 2.592 2.997 . 0 0 "[ . 1 . 2]" 1
750 1 20 SER H 1 20 SER HA 2.400 . 2.400 2.275 2.228 2.317 . 0 0 "[ . 1 . 2]" 1
751 1 20 SER H 1 20 SER HB2 4.200 . 4.200 3.606 3.205 3.731 . 0 0 "[ . 1 . 2]" 1
752 1 20 SER H 1 20 SER QB 3.670 . 3.670 3.368 3.011 3.458 . 0 0 "[ . 1 . 2]" 1
753 1 20 SER H 1 20 SER HB3 4.200 . 4.200 4.043 3.653 4.130 . 0 0 "[ . 1 . 2]" 1
754 1 20 SER H 1 21 LEU H 2.940 . 2.940 2.530 2.436 2.618 . 0 0 "[ . 1 . 2]" 1
755 1 20 SER H 1 21 LEU MD2 4.900 . 4.900 4.208 4.063 4.377 . 0 0 "[ . 1 . 2]" 1
756 1 20 SER H 1 22 ASP H 4.600 . 4.600 3.994 3.857 4.149 . 0 0 "[ . 1 . 2]" 1
757 1 20 SER H 1 22 ASP QB 5.490 . 5.490 4.889 4.617 5.121 . 0 0 "[ . 1 . 2]" 1
758 1 20 SER HA 1 21 LEU H 2.850 . 2.850 2.863 2.684 2.926 0.076 6 0 "[ . 1 . 2]" 1
759 1 20 SER HA 1 21 LEU HB2 5.340 . 5.340 5.042 4.899 5.171 . 0 0 "[ . 1 . 2]" 1
760 1 20 SER HA 1 21 LEU MD2 5.500 . 5.500 4.401 4.319 4.498 . 0 0 "[ . 1 . 2]" 1
761 1 20 SER HA 1 22 ASP H 3.390 . 3.390 2.985 2.834 3.131 . 0 0 "[ . 1 . 2]" 1
762 1 20 SER HA 1 23 GLN H 5.500 . 5.500 5.150 4.989 5.440 . 0 0 "[ . 1 . 2]" 1
763 1 20 SER HA 1 23 GLN HE22 5.500 . 5.500 5.296 4.285 5.600 0.100 20 0 "[ . 1 . 2]" 1
764 1 20 SER QB 1 21 LEU MD2 3.680 . 3.680 3.320 3.081 3.594 . 0 0 "[ . 1 . 2]" 1
765 1 20 SER QB 1 23 GLN HE22 4.590 . 4.590 4.072 3.770 4.622 0.032 16 0 "[ . 1 . 2]" 1
766 1 20 SER QB 1 59 LEU QD 5.280 . 5.280 3.466 3.072 4.257 . 0 0 "[ . 1 . 2]" 1
767 1 21 LEU H 1 21 LEU HB2 2.690 . 2.690 2.202 2.112 2.303 . 0 0 "[ . 1 . 2]" 1
768 1 21 LEU H 1 21 LEU HB3 3.700 . 3.700 3.439 3.381 3.499 . 0 0 "[ . 1 . 2]" 1
769 1 21 LEU H 1 21 LEU MD1 4.590 . 4.590 4.336 4.265 4.416 . 0 0 "[ . 1 . 2]" 1
770 1 21 LEU H 1 21 LEU MD2 4.130 . 4.130 2.909 2.763 3.148 . 0 0 "[ . 1 . 2]" 1
771 1 21 LEU H 1 21 LEU HG 4.720 . 4.720 4.137 4.014 4.360 . 0 0 "[ . 1 . 2]" 1
772 1 21 LEU H 1 22 ASP H 2.660 . 2.660 2.442 2.266 2.529 . 0 0 "[ . 1 . 2]" 1
773 1 21 LEU H 1 22 ASP HA 4.580 . 4.580 4.520 4.297 4.624 0.044 1 0 "[ . 1 . 2]" 1
774 1 21 LEU H 1 22 ASP QB 4.720 . 4.720 4.282 4.124 4.504 . 0 0 "[ . 1 . 2]" 1
775 1 21 LEU H 1 23 GLN H 4.710 . 4.710 4.691 4.452 4.826 0.116 3 0 "[ . 1 . 2]" 1
776 1 21 LEU H 1 23 GLN HE21 4.520 . 4.520 4.390 4.218 4.687 0.167 14 0 "[ . 1 . 2]" 1
777 1 21 LEU H 1 25 VAL QG 5.440 . 5.440 5.288 5.048 5.452 0.012 11 0 "[ . 1 . 2]" 1
778 1 21 LEU HA 1 21 LEU MD1 2.820 . 2.820 2.415 2.344 2.555 . 0 0 "[ . 1 . 2]" 1
779 1 21 LEU HA 1 23 GLN H 3.700 . 3.700 3.209 3.066 3.385 . 0 0 "[ . 1 . 2]" 1
780 1 21 LEU HA 1 24 TYR QD 5.500 . 5.500 3.636 3.208 3.825 . 0 0 "[ . 1 . 2]" 1
781 1 21 LEU HA 1 24 TYR QE 5.500 . 5.500 5.394 4.867 5.547 0.047 5 0 "[ . 1 . 2]" 1
782 1 21 LEU HA 1 55 GLN QE 4.810 . 4.810 4.332 3.503 4.827 0.017 17 0 "[ . 1 . 2]" 1
783 1 21 LEU HB2 1 22 ASP H 4.200 . 4.200 3.870 3.758 3.969 . 0 0 "[ . 1 . 2]" 1
784 1 21 LEU HB2 1 23 GLN HE21 4.770 . 4.770 4.791 4.587 4.872 0.102 18 0 "[ . 1 . 2]" 1
785 1 21 LEU HB2 1 60 VAL HA 5.500 . 5.500 5.477 5.333 5.541 0.041 2 0 "[ . 1 . 2]" 1
786 1 21 LEU HB3 1 21 LEU MD1 3.550 . 3.550 2.212 2.182 2.240 . 0 0 "[ . 1 . 2]" 1
787 1 21 LEU HB3 1 22 ASP H 4.510 . 4.510 4.169 4.137 4.217 . 0 0 "[ . 1 . 2]" 1
788 1 21 LEU HB3 1 23 GLN H 4.870 . 4.870 4.736 4.528 4.875 0.005 19 0 "[ . 1 . 2]" 1
789 1 21 LEU HB3 1 23 GLN HE21 4.700 . 4.700 4.364 3.700 4.692 . 0 0 "[ . 1 . 2]" 1
790 1 21 LEU HB3 1 24 TYR H 5.500 . 5.500 3.700 3.626 3.845 . 0 0 "[ . 1 . 2]" 1
791 1 21 LEU HB3 1 24 TYR QD 4.980 . 4.980 3.850 3.587 4.047 . 0 0 "[ . 1 . 2]" 1
792 1 21 LEU MD1 1 22 ASP H 5.030 . 5.030 4.963 4.903 5.038 0.008 3 0 "[ . 1 . 2]" 1
793 1 21 LEU MD1 1 23 GLN H 5.500 . 5.500 4.682 4.457 4.837 . 0 0 "[ . 1 . 2]" 1
794 1 21 LEU MD1 1 23 GLN HE21 4.020 . 4.020 3.155 2.607 3.554 . 0 0 "[ . 1 . 2]" 1
795 1 21 LEU MD1 1 23 GLN HE22 3.970 . 3.970 3.931 3.437 4.068 0.098 6 0 "[ . 1 . 2]" 1
796 1 21 LEU MD1 1 24 TYR H 4.690 . 4.690 3.885 3.770 4.026 . 0 0 "[ . 1 . 2]" 1
797 1 21 LEU MD1 1 24 TYR QD 3.390 . 3.390 2.217 2.052 2.464 . 0 0 "[ . 1 . 2]" 1
798 1 21 LEU MD1 1 56 ASP H 5.390 . 5.390 4.729 4.203 4.951 . 0 0 "[ . 1 . 2]" 1
799 1 21 LEU MD1 1 56 ASP HA 3.750 . 3.750 3.059 2.559 3.502 . 0 0 "[ . 1 . 2]" 1
800 1 21 LEU MD1 1 56 ASP QB 3.500 . 3.500 2.011 1.875 2.136 . 0 0 "[ . 1 . 2]" 1
801 1 21 LEU MD2 1 23 GLN HE21 5.300 . 5.300 2.948 2.374 3.408 . 0 0 "[ . 1 . 2]" 1
802 1 21 LEU MD2 1 24 TYR QD 4.560 . 4.560 4.183 3.942 4.466 . 0 0 "[ . 1 . 2]" 1
803 1 21 LEU MD2 1 55 GLN QE 4.500 . 4.500 2.864 1.937 3.605 . 0 0 "[ . 1 . 2]" 1
804 1 21 LEU MD2 1 59 LEU HA 5.500 . 5.500 4.994 4.719 5.249 . 0 0 "[ . 1 . 2]" 1
805 1 21 LEU MD2 1 59 LEU QD 3.170 . 3.170 2.089 1.866 2.338 . 0 0 "[ . 1 . 2]" 1
806 1 21 LEU MD2 1 60 VAL H 4.740 . 4.740 3.282 3.029 3.474 . 0 0 "[ . 1 . 2]" 1
807 1 21 LEU MD2 1 60 VAL HA 4.470 . 4.470 3.765 3.621 3.895 . 0 0 "[ . 1 . 2]" 1
808 1 21 LEU MD2 1 60 VAL MG1 4.070 . 4.070 3.764 3.444 4.117 0.047 16 0 "[ . 1 . 2]" 1
809 1 21 LEU HG 1 24 TYR HB2 4.890 . 4.890 4.777 4.623 4.920 0.030 4 0 "[ . 1 . 2]" 1
810 1 21 LEU HG 1 24 TYR QD 5.100 . 5.100 4.944 4.745 5.115 0.015 19 0 "[ . 1 . 2]" 1
811 1 21 LEU HG 1 56 ASP HA 5.390 . 5.390 4.966 4.410 5.319 . 0 0 "[ . 1 . 2]" 1
812 1 21 LEU HG 1 56 ASP QB 4.720 . 4.720 4.383 4.158 4.559 . 0 0 "[ . 1 . 2]" 1
813 1 21 LEU HG 1 59 LEU QD 5.440 . 5.440 3.867 3.077 4.338 . 0 0 "[ . 1 . 2]" 1
814 1 21 LEU HG 1 60 VAL H 4.270 . 4.270 4.208 4.044 4.289 0.019 12 0 "[ . 1 . 2]" 1
815 1 21 LEU HG 1 60 VAL HA 4.660 . 4.660 3.444 3.319 3.560 . 0 0 "[ . 1 . 2]" 1
816 1 21 LEU HG 1 60 VAL HB 4.680 . 4.680 2.276 2.085 2.597 . 0 0 "[ . 1 . 2]" 1
817 1 21 LEU HG 1 60 VAL MG2 5.500 . 5.500 3.123 2.989 3.432 . 0 0 "[ . 1 . 2]" 1
818 1 21 LEU HG 1 63 LYS HE3 5.500 . 5.500 5.521 5.458 5.564 0.064 2 0 "[ . 1 . 2]" 1
819 1 22 ASP H 1 22 ASP HA 2.880 . 2.880 2.743 2.728 2.769 . 0 0 "[ . 1 . 2]" 1
820 1 22 ASP H 1 22 ASP QB 2.680 . 2.680 2.388 2.180 2.589 . 0 0 "[ . 1 . 2]" 1
821 1 22 ASP H 1 23 GLN H 2.870 . 2.870 2.759 2.644 2.877 0.007 3 0 "[ . 1 . 2]" 1
822 1 22 ASP H 1 23 GLN HE21 4.790 . 4.790 3.878 3.548 4.573 . 0 0 "[ . 1 . 2]" 1
823 1 22 ASP H 1 24 TYR H 4.470 . 4.470 4.239 4.124 4.315 . 0 0 "[ . 1 . 2]" 1
824 1 22 ASP H 1 25 VAL QG 4.350 . 4.350 4.186 4.083 4.246 . 0 0 "[ . 1 . 2]" 1
825 1 22 ASP HA 1 23 GLN HA 4.860 . 4.860 4.807 4.525 4.889 0.029 20 0 "[ . 1 . 2]" 1
826 1 22 ASP HA 1 24 TYR H 3.630 . 3.630 3.663 3.534 3.727 0.097 15 0 "[ . 1 . 2]" 1
827 1 22 ASP HA 1 25 VAL H 3.510 . 3.510 3.231 3.055 3.347 . 0 0 "[ . 1 . 2]" 1
828 1 22 ASP HA 1 25 VAL HA 5.500 . 5.500 5.058 4.888 5.392 . 0 0 "[ . 1 . 2]" 1
829 1 22 ASP HA 1 25 VAL HB 4.340 . 4.340 3.695 3.547 3.941 . 0 0 "[ . 1 . 2]" 1
830 1 22 ASP HA 1 25 VAL QG 2.810 . 2.810 1.949 1.849 2.068 . 0 0 "[ . 1 . 2]" 1
831 1 22 ASP QB 1 23 GLN H 3.730 . 3.730 3.311 2.609 3.775 0.045 2 0 "[ . 1 . 2]" 1
832 1 22 ASP QB 1 23 GLN HA 4.470 . 4.470 4.406 4.194 4.541 0.071 11 0 "[ . 1 . 2]" 1
833 1 22 ASP QB 1 24 TYR H 5.500 . 5.500 4.740 4.545 4.861 . 0 0 "[ . 1 . 2]" 1
834 1 22 ASP QB 1 25 VAL QG 3.910 . 3.910 3.231 2.707 3.737 . 0 0 "[ . 1 . 2]" 1
835 1 23 GLN H 1 23 GLN HB2 3.900 . 3.900 3.564 3.502 3.707 . 0 0 "[ . 1 . 2]" 1
836 1 23 GLN H 1 23 GLN HB3 2.600 . 2.600 2.474 2.323 2.692 0.092 3 0 "[ . 1 . 2]" 1
837 1 23 GLN H 1 23 GLN HE21 3.840 . 3.840 2.900 2.063 3.632 . 0 0 "[ . 1 . 2]" 1
838 1 23 GLN H 1 23 GLN HE22 4.780 . 4.780 4.052 2.733 4.732 . 0 0 "[ . 1 . 2]" 1
839 1 23 GLN H 1 23 GLN HG2 2.880 . 2.880 2.370 1.995 2.916 0.036 19 0 "[ . 1 . 2]" 1
840 1 23 GLN H 1 23 GLN HG3 4.610 . 4.610 3.695 3.468 3.970 . 0 0 "[ . 1 . 2]" 1
841 1 23 GLN H 1 24 TYR H 2.790 . 2.790 2.646 2.459 2.742 . 0 0 "[ . 1 . 2]" 1
842 1 23 GLN H 1 25 VAL H 4.560 . 4.560 4.100 3.997 4.186 . 0 0 "[ . 1 . 2]" 1
843 1 23 GLN HA 1 23 GLN HB2 2.880 . 2.880 2.442 2.381 2.554 . 0 0 "[ . 1 . 2]" 1
844 1 23 GLN HA 1 23 GLN HB3 2.960 . 2.960 2.445 2.332 2.512 . 0 0 "[ . 1 . 2]" 1
845 1 23 GLN HA 1 23 GLN HG2 4.040 . 4.040 3.663 3.608 3.771 . 0 0 "[ . 1 . 2]" 1
846 1 23 GLN HA 1 23 GLN HG3 4.230 . 4.230 3.990 3.846 4.260 0.030 5 0 "[ . 1 . 2]" 1
847 1 23 GLN HA 1 24 TYR HA 5.430 . 5.430 4.630 4.540 4.705 . 0 0 "[ . 1 . 2]" 1
848 1 23 GLN HA 1 24 TYR QD 5.500 . 5.500 5.448 5.303 5.581 0.081 17 0 "[ . 1 . 2]" 1
849 1 23 GLN HA 1 25 VAL H 4.870 . 4.870 4.075 3.806 4.404 . 0 0 "[ . 1 . 2]" 1
850 1 23 GLN HA 1 25 VAL QG 4.910 . 4.910 4.679 3.793 4.901 . 0 0 "[ . 1 . 2]" 1
851 1 23 GLN HA 1 26 SER H 4.290 . 4.290 4.169 3.784 4.394 0.104 20 0 "[ . 1 . 2]" 1
852 1 23 GLN HB2 1 23 GLN HE21 4.350 . 4.350 4.294 4.177 4.475 0.125 3 0 "[ . 1 . 2]" 1
853 1 23 GLN HB2 1 23 GLN HE22 5.180 . 5.180 4.868 4.659 5.214 0.034 14 0 "[ . 1 . 2]" 1
854 1 23 GLN HB2 1 24 TYR H 4.690 . 4.690 4.083 3.998 4.243 . 0 0 "[ . 1 . 2]" 1
855 1 23 GLN HB2 1 24 TYR QD 5.500 . 5.500 4.564 4.349 4.935 . 0 0 "[ . 1 . 2]" 1
856 1 23 GLN HE21 1 23 GLN HG2 2.950 . 2.950 2.150 1.992 2.236 . 0 0 "[ . 1 . 2]" 1
857 1 23 GLN HE22 1 23 GLN HG2 3.560 . 3.560 3.401 3.297 3.468 . 0 0 "[ . 1 . 2]" 1
858 1 23 GLN HG2 1 24 TYR H 3.200 . 3.200 2.517 2.308 2.899 . 0 0 "[ . 1 . 2]" 1
859 1 23 GLN HG2 1 24 TYR HB2 3.680 . 3.680 3.609 3.397 3.755 0.075 19 0 "[ . 1 . 2]" 1
860 1 23 GLN HG2 1 24 TYR HB3 5.500 . 5.500 5.135 4.941 5.269 . 0 0 "[ . 1 . 2]" 1
861 1 23 GLN HG2 1 24 TYR QD 4.260 . 4.260 2.577 2.228 2.878 . 0 0 "[ . 1 . 2]" 1
862 1 23 GLN HG2 1 24 TYR QE 4.790 . 4.790 4.437 3.800 4.834 0.044 10 0 "[ . 1 . 2]" 1
863 1 23 GLN HG2 1 55 GLN QE 5.340 . 5.340 5.036 4.178 5.460 0.120 5 0 "[ . 1 . 2]" 1
864 1 23 GLN HG3 1 24 TYR H 5.200 . 5.200 3.580 2.961 4.554 . 0 0 "[ . 1 . 2]" 1
865 1 23 GLN HG3 1 24 TYR QD 3.680 . 3.680 2.710 2.115 3.715 0.035 5 0 "[ . 1 . 2]" 1
866 1 23 GLN HG3 1 24 TYR QE 5.010 . 5.010 3.866 3.303 4.646 . 0 0 "[ . 1 . 2]" 1
867 1 23 GLN HG3 1 55 GLN QE 5.340 . 5.340 5.146 4.112 5.498 0.158 16 0 "[ . 1 . 2]" 1
868 1 24 TYR H 1 24 TYR HB2 3.140 . 3.140 2.195 2.126 2.311 . 0 0 "[ . 1 . 2]" 1
869 1 24 TYR H 1 24 TYR HB3 3.540 . 3.540 3.417 3.358 3.514 . 0 0 "[ . 1 . 2]" 1
870 1 24 TYR H 1 25 VAL HB 5.070 . 5.070 4.842 4.710 5.095 0.025 11 0 "[ . 1 . 2]" 1
871 1 24 TYR H 1 25 VAL QG 3.510 . 3.510 3.475 3.311 3.521 0.011 19 0 "[ . 1 . 2]" 1
872 1 24 TYR H 1 26 SER H 4.550 . 4.550 4.298 4.087 4.455 . 0 0 "[ . 1 . 2]" 1
873 1 24 TYR HA 1 24 TYR QE 5.500 . 5.500 4.489 4.398 4.552 . 0 0 "[ . 1 . 2]" 1
874 1 24 TYR HA 1 25 VAL HA 4.920 . 4.920 4.839 4.615 4.911 . 0 0 "[ . 1 . 2]" 1
875 1 24 TYR HA 1 26 SER H 3.920 . 3.920 3.886 3.761 3.955 0.035 9 0 "[ . 1 . 2]" 1
876 1 24 TYR HA 1 27 GLU H 3.820 . 3.820 3.607 3.464 3.723 . 0 0 "[ . 1 . 2]" 1
877 1 24 TYR HA 1 28 PHE H 4.400 . 4.400 4.183 4.040 4.315 . 0 0 "[ . 1 . 2]" 1
878 1 24 TYR HA 1 28 PHE QD 5.500 . 5.500 3.883 3.692 4.192 . 0 0 "[ . 1 . 2]" 1
879 1 24 TYR HA 1 28 PHE QE 5.500 . 5.500 4.970 4.716 5.361 . 0 0 "[ . 1 . 2]" 1
880 1 24 TYR HA 1 51 MET HB2 5.500 . 5.500 4.290 3.610 5.492 . 0 0 "[ . 1 . 2]" 1
881 1 24 TYR HB2 1 25 VAL H 3.280 . 3.280 3.344 3.283 3.374 0.094 4 0 "[ . 1 . 2]" 1
882 1 24 TYR HB2 1 60 VAL HB 5.500 . 5.500 5.564 5.466 5.611 0.111 20 0 "[ . 1 . 2]" 1
883 1 24 TYR HB3 1 25 VAL H 3.660 . 3.660 3.607 3.442 3.706 0.046 1 0 "[ . 1 . 2]" 1
884 1 24 TYR HB3 1 28 PHE QD 3.400 . 3.400 2.434 2.018 2.960 . 0 0 "[ . 1 . 2]" 1
885 1 24 TYR HB3 1 49 LEU QD 5.440 . 5.440 4.005 3.043 4.351 . 0 0 "[ . 1 . 2]" 1
886 1 24 TYR QD 1 28 PHE H 4.570 . 4.570 4.466 4.245 4.604 0.034 15 0 "[ . 1 . 2]" 1
887 1 24 TYR QD 1 28 PHE HA 5.140 . 5.140 5.094 4.913 5.238 0.098 15 0 "[ . 1 . 2]" 1
888 1 24 TYR QD 1 28 PHE QD 3.560 . 3.560 2.371 2.174 2.803 . 0 0 "[ . 1 . 2]" 1
889 1 24 TYR QD 1 28 PHE QE 5.500 . 5.500 2.032 1.888 2.498 . 0 0 "[ . 1 . 2]" 1
890 1 24 TYR QD 1 41 LEU QD 5.050 . 5.050 4.753 4.525 4.996 . 0 0 "[ . 1 . 2]" 1
891 1 24 TYR QD 1 49 LEU HB2 4.280 . 4.280 3.544 3.003 4.026 . 0 0 "[ . 1 . 2]" 1
892 1 24 TYR QD 1 49 LEU HG 3.970 . 3.970 2.303 1.976 4.081 0.111 15 0 "[ . 1 . 2]" 1
893 1 24 TYR QD 1 51 MET HB2 4.620 . 4.620 4.071 3.730 4.477 . 0 0 "[ . 1 . 2]" 1
894 1 24 TYR QD 1 56 ASP HA 5.500 . 5.500 5.520 5.367 5.606 0.106 17 0 "[ . 1 . 2]" 1
895 1 24 TYR QD 1 56 ASP HB2 5.500 . 5.500 4.157 3.553 4.526 . 0 0 "[ . 1 . 2]" 1
896 1 24 TYR QD 1 56 ASP HB3 5.500 . 5.500 3.520 3.205 3.852 . 0 0 "[ . 1 . 2]" 1
897 1 24 TYR QE 1 49 LEU HB2 4.050 . 4.050 2.273 2.006 2.661 . 0 0 "[ . 1 . 2]" 1
898 1 24 TYR QE 1 49 LEU QD 3.850 . 3.850 3.203 2.214 3.493 . 0 0 "[ . 1 . 2]" 1
899 1 24 TYR QE 1 49 LEU HG 5.230 . 5.230 2.901 2.375 4.108 . 0 0 "[ . 1 . 2]" 1
900 1 24 TYR QE 1 51 MET HA 5.100 . 5.100 5.159 5.112 5.211 0.111 5 0 "[ . 1 . 2]" 1
901 1 24 TYR QE 1 51 MET HB3 4.660 . 4.660 2.920 2.586 3.339 . 0 0 "[ . 1 . 2]" 1
902 1 24 TYR QE 1 52 THR HA 5.190 . 5.190 4.859 4.401 5.227 0.037 8 0 "[ . 1 . 2]" 1
903 1 24 TYR QE 1 53 SER QB 3.350 . 3.350 2.569 2.058 3.391 0.041 4 0 "[ . 1 . 2]" 1
904 1 24 TYR QE 1 56 ASP HA 5.500 . 5.500 4.666 4.485 4.974 . 0 0 "[ . 1 . 2]" 1
905 1 24 TYR QE 1 56 ASP HB2 4.260 . 4.260 2.355 2.096 2.815 . 0 0 "[ . 1 . 2]" 1
906 1 24 TYR QE 1 56 ASP QB 3.620 . 3.620 2.130 1.967 2.268 . 0 0 "[ . 1 . 2]" 1
907 1 24 TYR QE 1 56 ASP HB3 4.260 . 4.260 2.502 2.212 2.928 . 0 0 "[ . 1 . 2]" 1
908 1 24 TYR QE 1 57 ARG HD3 5.500 . 5.500 5.335 4.422 5.562 0.062 2 0 "[ . 1 . 2]" 1
909 1 25 VAL H 1 25 VAL HB 3.120 . 3.120 2.804 2.729 2.968 . 0 0 "[ . 1 . 2]" 1
910 1 25 VAL H 1 25 VAL MG1 3.820 . 3.820 3.640 1.851 3.843 0.023 6 0 "[ . 1 . 2]" 1
911 1 25 VAL H 1 25 VAL QG 2.380 . 2.380 2.050 1.847 2.105 . 0 0 "[ . 1 . 2]" 1
912 1 25 VAL H 1 25 VAL MG2 3.820 . 3.820 2.248 2.024 3.841 0.021 11 0 "[ . 1 . 2]" 1
913 1 25 VAL H 1 26 SER H 2.940 . 2.940 2.767 2.679 2.887 . 0 0 "[ . 1 . 2]" 1
914 1 25 VAL H 1 26 SER QB 5.500 . 5.500 4.668 4.217 4.884 . 0 0 "[ . 1 . 2]" 1
915 1 25 VAL H 1 28 PHE H 4.690 . 4.690 4.617 4.570 4.690 . 17 0 "[ . 1 . 2]" 1
916 1 25 VAL H 1 28 PHE HB2 4.140 . 4.140 4.152 4.082 4.190 0.050 15 0 "[ . 1 . 2]" 1
917 1 25 VAL HA 1 25 VAL MG1 3.200 . 3.200 2.512 2.353 3.157 . 0 0 "[ . 1 . 2]" 1
918 1 25 VAL HA 1 25 VAL QG 2.720 . 2.720 2.196 2.147 2.531 . 0 0 "[ . 1 . 2]" 1
919 1 25 VAL HA 1 25 VAL MG2 3.200 . 3.200 2.436 2.373 2.668 . 0 0 "[ . 1 . 2]" 1
920 1 25 VAL HA 1 26 SER H 3.520 . 3.520 3.482 3.392 3.524 0.004 4 0 "[ . 1 . 2]" 1
921 1 25 VAL HA 1 27 GLU H 4.460 . 4.460 4.000 3.591 4.125 . 0 0 "[ . 1 . 2]" 1
922 1 25 VAL HA 1 28 PHE H 3.210 . 3.210 3.195 2.881 3.259 0.049 15 0 "[ . 1 . 2]" 1
923 1 25 VAL HA 1 28 PHE HB2 5.500 . 5.500 2.005 1.787 2.081 0.013 11 0 "[ . 1 . 2]" 1
924 1 25 VAL HA 1 28 PHE HB3 5.200 . 5.200 3.163 3.001 3.283 . 0 0 "[ . 1 . 2]" 1
925 1 25 VAL HA 1 28 PHE QD 4.050 . 4.050 3.958 3.775 4.085 0.035 8 0 "[ . 1 . 2]" 1
926 1 25 VAL HA 1 29 SER H 3.960 . 3.960 3.375 3.153 3.684 . 0 0 "[ . 1 . 2]" 1
927 1 25 VAL HA 1 29 SER QB 5.340 . 5.340 4.339 3.792 4.981 . 0 0 "[ . 1 . 2]" 1
928 1 25 VAL HA 1 49 LEU QD 5.130 . 5.130 5.138 4.980 5.178 0.048 1 0 "[ . 1 . 2]" 1
929 1 25 VAL HB 1 26 SER H 4.490 . 4.490 3.030 2.792 4.432 . 0 0 "[ . 1 . 2]" 1
930 1 25 VAL QG 1 26 SER H 3.460 . 3.460 3.210 2.620 3.332 . 0 0 "[ . 1 . 2]" 1
931 1 25 VAL QG 1 26 SER HA 5.440 . 5.440 3.491 3.311 3.710 . 0 0 "[ . 1 . 2]" 1
932 1 25 VAL QG 1 26 SER QB 4.650 . 4.650 4.436 4.141 4.684 0.034 17 0 "[ . 1 . 2]" 1
933 1 25 VAL QG 1 27 GLU H 4.480 . 4.480 4.455 4.254 4.519 0.039 18 0 "[ . 1 . 2]" 1
934 1 25 VAL QG 1 28 PHE H 4.610 . 4.610 4.275 4.222 4.353 . 0 0 "[ . 1 . 2]" 1
935 1 25 VAL QG 1 28 PHE HB2 4.900 . 4.900 3.440 3.312 3.684 . 0 0 "[ . 1 . 2]" 1
936 1 25 VAL QG 1 29 SER H 4.060 . 4.060 3.459 3.245 3.750 . 0 0 "[ . 1 . 2]" 1
937 1 25 VAL QG 1 29 SER HA 5.440 . 5.440 4.465 4.104 4.697 . 0 0 "[ . 1 . 2]" 1
938 1 25 VAL QG 1 29 SER QB 4.040 . 4.040 2.881 2.306 3.502 . 0 0 "[ . 1 . 2]" 1
939 1 25 VAL MG1 1 26 SER H 4.050 . 4.050 3.447 2.699 3.693 . 0 0 "[ . 1 . 2]" 1
940 1 25 VAL MG1 1 27 GLU H 5.420 . 5.420 4.788 4.645 4.938 . 0 0 "[ . 1 . 2]" 1
941 1 25 VAL MG2 1 26 SER H 4.050 . 4.050 3.851 3.541 3.941 . 0 0 "[ . 1 . 2]" 1
942 1 25 VAL MG2 1 27 GLU H 5.420 . 5.420 5.329 4.695 5.435 0.015 18 0 "[ . 1 . 2]" 1
943 1 26 SER H 1 26 SER HA 2.800 . 2.800 2.728 2.690 2.779 . 0 0 "[ . 1 . 2]" 1
944 1 26 SER H 1 26 SER QB 2.830 . 2.830 2.426 2.138 2.604 . 0 0 "[ . 1 . 2]" 1
945 1 26 SER H 1 27 GLU H 3.020 . 3.020 2.846 2.744 2.938 . 0 0 "[ . 1 . 2]" 1
946 1 26 SER H 1 27 GLU QB 4.970 . 4.970 4.730 4.559 4.863 . 0 0 "[ . 1 . 2]" 1
947 1 26 SER H 1 28 PHE H 4.140 . 4.140 4.088 4.022 4.144 0.004 19 0 "[ . 1 . 2]" 1
948 1 26 SER H 1 29 SER H 5.320 . 5.320 4.916 4.841 5.020 . 0 0 "[ . 1 . 2]" 1
949 1 26 SER HA 1 26 SER QB 2.470 . 2.470 2.321 2.275 2.386 . 0 0 "[ . 1 . 2]" 1
950 1 26 SER HA 1 27 GLU HA 5.500 . 5.500 4.537 4.483 4.589 . 0 0 "[ . 1 . 2]" 1
951 1 26 SER HA 1 28 PHE H 5.110 . 5.110 4.890 4.774 4.969 . 0 0 "[ . 1 . 2]" 1
952 1 26 SER HA 1 30 ALA MB 5.320 . 5.320 4.882 4.531 5.165 . 0 0 "[ . 1 . 2]" 1
953 1 26 SER QB 1 27 GLU H 3.120 . 3.120 2.646 2.492 2.891 . 0 0 "[ . 1 . 2]" 1
954 1 26 SER QB 1 27 GLU QB 3.640 . 3.640 3.458 3.258 3.652 0.012 15 0 "[ . 1 . 2]" 1
955 1 26 SER QB 1 29 SER H 5.500 . 5.500 5.488 5.355 5.556 0.056 7 0 "[ . 1 . 2]" 1
956 1 27 GLU H 1 27 GLU HB2 3.080 . 3.080 2.886 2.733 2.996 . 0 0 "[ . 1 . 2]" 1
957 1 27 GLU H 1 27 GLU QB 2.510 . 2.510 2.390 2.306 2.483 . 0 0 "[ . 1 . 2]" 1
958 1 27 GLU H 1 27 GLU HB3 3.080 . 3.080 2.551 2.485 2.650 . 0 0 "[ . 1 . 2]" 1
959 1 27 GLU H 1 27 GLU HG2 4.940 . 4.940 4.758 4.664 4.847 . 0 0 "[ . 1 . 2]" 1
960 1 27 GLU H 1 27 GLU QG 4.220 . 4.220 4.077 4.026 4.127 . 0 0 "[ . 1 . 2]" 1
961 1 27 GLU H 1 27 GLU HG3 4.940 . 4.940 4.435 4.367 4.475 . 0 0 "[ . 1 . 2]" 1
962 1 27 GLU H 1 28 PHE H 2.660 . 2.660 2.098 1.946 2.193 . 0 0 "[ . 1 . 2]" 1
963 1 27 GLU H 1 28 PHE HB2 4.150 . 4.150 3.882 3.713 4.004 . 0 0 "[ . 1 . 2]" 1
964 1 27 GLU H 1 28 PHE HB3 5.500 . 5.500 5.374 5.202 5.510 0.010 18 0 "[ . 1 . 2]" 1
965 1 27 GLU H 1 30 ALA MB 4.650 . 4.650 4.539 4.287 4.685 0.035 17 0 "[ . 1 . 2]" 1
966 1 27 GLU H 1 49 LEU QD 4.630 . 4.630 3.761 3.627 4.075 . 0 0 "[ . 1 . 2]" 1
967 1 27 GLU HA 1 27 GLU HG2 4.170 . 4.170 3.791 3.747 3.844 . 0 0 "[ . 1 . 2]" 1
968 1 27 GLU HA 1 27 GLU HG3 4.170 . 4.170 3.094 2.979 3.237 . 0 0 "[ . 1 . 2]" 1
969 1 27 GLU HA 1 29 SER H 4.870 . 4.870 4.111 3.789 4.395 . 0 0 "[ . 1 . 2]" 1
970 1 27 GLU HA 1 29 SER QB 5.340 . 5.340 5.006 4.558 5.414 0.074 9 0 "[ . 1 . 2]" 1
971 1 27 GLU HA 1 30 ALA H 3.230 . 3.230 3.011 2.739 3.227 . 0 0 "[ . 1 . 2]" 1
972 1 27 GLU HA 1 30 ALA MB 2.930 . 2.930 2.235 2.032 2.401 . 0 0 "[ . 1 . 2]" 1
973 1 27 GLU HA 1 31 GLN H 5.180 . 5.180 4.224 3.907 4.408 . 0 0 "[ . 1 . 2]" 1
974 1 27 GLU HA 1 31 GLN HE21 5.500 . 5.500 4.657 4.366 4.869 . 0 0 "[ . 1 . 2]" 1
975 1 27 GLU HA 1 49 LEU QD 5.410 . 5.410 3.924 3.816 4.295 . 0 0 "[ . 1 . 2]" 1
976 1 27 GLU QB 1 28 PHE H 2.960 . 2.960 2.853 2.709 2.962 0.002 2 0 "[ . 1 . 2]" 1
977 1 27 GLU QB 1 28 PHE HA 5.340 . 5.340 4.280 4.203 4.418 . 0 0 "[ . 1 . 2]" 1
978 1 27 GLU QB 1 28 PHE QD 4.180 . 4.180 3.730 3.469 3.950 . 0 0 "[ . 1 . 2]" 1
979 1 27 GLU QB 1 29 SER H 5.050 . 5.050 4.878 4.700 5.006 . 0 0 "[ . 1 . 2]" 1
980 1 27 GLU QB 1 30 ALA H 5.260 . 5.260 4.658 4.533 4.758 . 0 0 "[ . 1 . 2]" 1
981 1 27 GLU QB 1 31 GLN H 5.340 . 5.340 5.247 5.002 5.378 0.038 15 0 "[ . 1 . 2]" 1
982 1 27 GLU QB 1 31 GLN HE21 4.610 . 4.610 4.115 3.867 4.336 . 0 0 "[ . 1 . 2]" 1
983 1 27 GLU QB 1 49 LEU HA 4.870 . 4.870 3.678 3.270 4.036 . 0 0 "[ . 1 . 2]" 1
984 1 27 GLU QB 1 49 LEU QD 4.130 . 4.130 2.131 1.958 2.640 . 0 0 "[ . 1 . 2]" 1
985 1 27 GLU QG 1 28 PHE H 5.140 . 5.140 3.916 3.804 3.993 . 0 0 "[ . 1 . 2]" 1
986 1 27 GLU QG 1 31 GLN HE21 3.600 . 3.600 2.068 1.789 2.303 0.011 19 0 "[ . 1 . 2]" 1
987 1 27 GLU QG 1 31 GLN HE22 4.500 . 4.500 3.016 2.899 3.159 . 0 0 "[ . 1 . 2]" 1
988 1 27 GLU QG 1 49 LEU HA 2.940 . 2.940 2.220 1.907 2.652 . 0 0 "[ . 1 . 2]" 1
989 1 27 GLU QG 1 49 LEU QD 3.070 . 3.070 1.915 1.847 2.073 . 0 0 "[ . 1 . 2]" 1
990 1 28 PHE H 1 28 PHE HA 2.900 . 2.900 2.771 2.727 2.796 . 0 0 "[ . 1 . 2]" 1
991 1 28 PHE H 1 28 PHE HB2 2.520 . 2.520 2.133 2.098 2.161 . 0 0 "[ . 1 . 2]" 1
992 1 28 PHE H 1 28 PHE HB3 3.470 . 3.470 3.451 3.405 3.495 0.025 11 0 "[ . 1 . 2]" 1
993 1 28 PHE H 1 29 SER H 2.810 . 2.810 2.751 2.630 2.825 0.015 14 0 "[ . 1 . 2]" 1
994 1 28 PHE H 1 29 SER HA 5.500 . 5.500 5.335 5.244 5.378 . 0 0 "[ . 1 . 2]" 1
995 1 28 PHE H 1 30 ALA H 5.500 . 5.500 3.896 3.728 4.019 . 0 0 "[ . 1 . 2]" 1
996 1 28 PHE H 1 30 ALA MB 4.900 . 4.900 4.626 4.400 4.761 . 0 0 "[ . 1 . 2]" 1
997 1 28 PHE H 1 31 GLN HG3 5.500 . 5.500 4.920 4.722 5.234 . 0 0 "[ . 1 . 2]" 1
998 1 28 PHE H 1 49 LEU HB3 5.500 . 5.500 5.058 4.663 5.271 . 0 0 "[ . 1 . 2]" 1
999 1 28 PHE H 1 49 LEU QD 3.880 . 3.880 2.834 2.749 3.083 . 0 0 "[ . 1 . 2]" 1
1000 1 28 PHE HA 1 28 PHE QE 4.540 . 4.540 4.472 4.406 4.524 . 0 0 "[ . 1 . 2]" 1
1001 1 28 PHE HA 1 29 SER H 3.560 . 3.560 3.513 3.437 3.540 . 0 0 "[ . 1 . 2]" 1
1002 1 28 PHE HA 1 31 GLN H 4.250 . 4.250 3.773 3.604 3.947 . 0 0 "[ . 1 . 2]" 1
1003 1 28 PHE HA 1 33 ILE HB 4.310 . 4.310 2.889 2.673 3.091 . 0 0 "[ . 1 . 2]" 1
1004 1 28 PHE HA 1 33 ILE MD 4.660 . 4.660 4.079 3.856 4.264 . 0 0 "[ . 1 . 2]" 1
1005 1 28 PHE HA 1 33 ILE HG12 3.510 . 3.510 2.831 2.523 3.029 . 0 0 "[ . 1 . 2]" 1
1006 1 28 PHE HA 1 33 ILE HG13 3.610 . 3.610 2.609 2.390 2.826 . 0 0 "[ . 1 . 2]" 1
1007 1 28 PHE HA 1 33 ILE MG 4.460 . 4.460 3.829 3.660 4.004 . 0 0 "[ . 1 . 2]" 1
1008 1 28 PHE HA 1 49 LEU MD1 4.710 . 4.710 2.254 2.072 4.019 . 0 0 "[ . 1 . 2]" 1
1009 1 28 PHE HA 1 49 LEU QD 3.190 . 3.190 2.169 2.065 2.489 . 0 0 "[ . 1 . 2]" 1
1010 1 28 PHE HA 1 49 LEU MD2 4.710 . 4.710 3.911 2.513 4.159 . 0 0 "[ . 1 . 2]" 1
1011 1 28 PHE HB2 1 29 SER H 3.450 . 3.450 2.918 2.822 3.034 . 0 0 "[ . 1 . 2]" 1
1012 1 28 PHE HB2 1 30 ALA H 5.470 . 5.470 4.934 4.718 5.125 . 0 0 "[ . 1 . 2]" 1
1013 1 28 PHE HB2 1 33 ILE HB 5.060 . 5.060 4.452 4.153 4.645 . 0 0 "[ . 1 . 2]" 1
1014 1 28 PHE HB2 1 33 ILE MG 5.160 . 5.160 5.030 4.845 5.183 0.023 12 0 "[ . 1 . 2]" 1
1015 1 28 PHE HB3 1 29 SER H 3.560 . 3.560 3.086 2.910 3.271 . 0 0 "[ . 1 . 2]" 1
1016 1 28 PHE HB3 1 29 SER HA 4.620 . 4.620 3.911 3.771 4.070 . 0 0 "[ . 1 . 2]" 1
1017 1 28 PHE HB3 1 33 ILE H 5.040 . 5.040 4.427 4.100 4.701 . 0 0 "[ . 1 . 2]" 1
1018 1 28 PHE HB3 1 33 ILE HB 4.250 . 4.250 3.088 2.782 3.243 . 0 0 "[ . 1 . 2]" 1
1019 1 28 PHE HB3 1 33 ILE HG13 5.450 . 5.450 4.515 4.191 4.749 . 0 0 "[ . 1 . 2]" 1
1020 1 28 PHE HB3 1 33 ILE MG 4.290 . 4.290 4.084 3.934 4.261 . 0 0 "[ . 1 . 2]" 1
1021 1 28 PHE HB3 1 49 LEU QD 4.940 . 4.940 4.178 4.112 4.319 . 0 0 "[ . 1 . 2]" 1
1022 1 28 PHE QD 1 31 GLN HG3 5.500 . 5.500 5.233 4.989 5.534 0.034 15 0 "[ . 1 . 2]" 1
1023 1 28 PHE QD 1 33 ILE HA 5.500 . 5.500 5.272 5.183 5.464 . 0 0 "[ . 1 . 2]" 1
1024 1 28 PHE QD 1 33 ILE HB 3.720 . 3.720 2.653 2.478 2.921 . 0 0 "[ . 1 . 2]" 1
1025 1 28 PHE QD 1 33 ILE MG 2.940 . 2.940 2.672 2.450 2.814 . 0 0 "[ . 1 . 2]" 1
1026 1 28 PHE QD 1 38 LEU MD1 5.240 . 5.240 4.541 4.344 4.711 . 0 0 "[ . 1 . 2]" 1
1027 1 28 PHE QD 1 38 LEU HG 4.380 . 4.380 4.378 4.240 4.431 0.051 19 0 "[ . 1 . 2]" 1
1028 1 28 PHE QD 1 49 LEU HA 5.500 . 5.500 5.464 5.351 5.546 0.046 15 0 "[ . 1 . 2]" 1
1029 1 28 PHE QD 1 49 LEU HB3 4.060 . 4.060 4.038 3.917 4.104 0.044 12 0 "[ . 1 . 2]" 1
1030 1 28 PHE QD 1 49 LEU MD1 4.060 . 4.060 2.344 2.101 2.618 . 0 0 "[ . 1 . 2]" 1
1031 1 28 PHE QD 1 49 LEU QD 3.390 . 3.390 2.304 2.089 2.530 . 0 0 "[ . 1 . 2]" 1
1032 1 28 PHE QD 1 49 LEU MD2 4.060 . 4.060 3.700 2.498 4.041 . 0 0 "[ . 1 . 2]" 1
1033 1 28 PHE QE 1 33 ILE MG 5.500 . 5.500 2.552 2.413 2.644 . 0 0 "[ . 1 . 2]" 1
1034 1 28 PHE QE 1 38 LEU HA 5.090 . 5.090 3.338 3.168 3.476 . 0 0 "[ . 1 . 2]" 1
1035 1 28 PHE QE 1 38 LEU MD1 4.510 . 4.510 3.893 3.652 4.203 . 0 0 "[ . 1 . 2]" 1
1036 1 28 PHE QE 1 38 LEU MD2 5.500 . 5.500 3.967 3.812 4.097 . 0 0 "[ . 1 . 2]" 1
1037 1 28 PHE QE 1 38 LEU HG 3.630 . 3.630 2.670 2.452 2.939 . 0 0 "[ . 1 . 2]" 1
1038 1 28 PHE QE 1 41 LEU HB3 5.500 . 5.500 5.494 5.408 5.525 0.025 15 0 "[ . 1 . 2]" 1
1039 1 28 PHE QE 1 49 LEU HB3 4.540 . 4.540 4.329 4.098 4.547 0.007 14 0 "[ . 1 . 2]" 1
1040 1 28 PHE QE 1 49 LEU MD1 4.290 . 4.290 3.271 1.866 3.588 . 0 0 "[ . 1 . 2]" 1
1041 1 28 PHE QE 1 49 LEU QD 3.370 . 3.370 2.850 1.857 3.042 . 0 0 "[ . 1 . 2]" 1
1042 1 28 PHE QE 1 49 LEU MD2 4.290 . 4.290 3.229 2.596 3.557 . 0 0 "[ . 1 . 2]" 1
1043 1 28 PHE QE 1 49 LEU HG 5.190 . 5.190 2.427 2.155 4.728 . 0 0 "[ . 1 . 2]" 1
1044 1 28 PHE HZ 1 38 LEU HA 4.350 . 4.350 4.310 4.032 4.396 0.046 3 0 "[ . 1 . 2]" 1
1045 1 28 PHE HZ 1 41 LEU HB3 5.320 . 5.320 4.672 4.549 4.804 . 0 0 "[ . 1 . 2]" 1
1046 1 28 PHE HZ 1 41 LEU MD1 3.830 . 3.830 1.967 1.893 2.039 . 0 0 "[ . 1 . 2]" 1
1047 1 28 PHE HZ 1 41 LEU QD 2.630 . 2.630 1.923 1.847 2.011 . 0 0 "[ . 1 . 2]" 1
1048 1 28 PHE HZ 1 41 LEU MD2 3.830 . 3.830 2.751 2.489 3.081 . 0 0 "[ . 1 . 2]" 1
1049 1 29 SER H 1 29 SER QB 2.670 . 2.670 2.386 2.199 2.678 0.008 9 0 "[ . 1 . 2]" 1
1050 1 29 SER H 1 30 ALA H 2.620 . 2.620 2.468 2.390 2.524 . 0 0 "[ . 1 . 2]" 1
1051 1 29 SER H 1 30 ALA MB 4.160 . 4.160 4.118 4.012 4.175 0.015 3 0 "[ . 1 . 2]" 1
1052 1 29 SER H 1 31 GLN H 4.200 . 4.200 4.234 4.166 4.272 0.072 20 0 "[ . 1 . 2]" 1
1053 1 29 SER H 1 33 ILE HB 5.250 . 5.250 5.108 4.918 5.276 0.026 12 0 "[ . 1 . 2]" 1
1054 1 29 SER HA 1 30 ALA H 3.550 . 3.550 3.430 3.294 3.505 . 0 0 "[ . 1 . 2]" 1
1055 1 29 SER HA 1 30 ALA MB 5.080 . 5.080 4.963 4.884 5.006 . 0 0 "[ . 1 . 2]" 1
1056 1 29 SER HA 1 31 GLN H 5.060 . 5.060 4.300 4.079 4.526 . 0 0 "[ . 1 . 2]" 1
1057 1 29 SER HA 1 32 ASN H 4.280 . 4.280 3.491 3.273 3.707 . 0 0 "[ . 1 . 2]" 1
1058 1 29 SER HA 1 33 ILE H 4.220 . 4.220 3.687 3.418 3.958 . 0 0 "[ . 1 . 2]" 1
1059 1 29 SER QB 1 30 ALA H 4.230 . 4.230 3.132 2.814 3.597 . 0 0 "[ . 1 . 2]" 1
1060 1 29 SER QB 1 30 ALA MB 5.340 . 5.340 4.044 3.744 4.526 . 0 0 "[ . 1 . 2]" 1
1061 1 29 SER QB 1 31 GLN H 5.340 . 5.340 4.975 4.713 5.252 . 0 0 "[ . 1 . 2]" 1
1062 1 29 SER QB 1 32 ASN H 5.340 . 5.340 4.835 4.582 5.133 . 0 0 "[ . 1 . 2]" 1
1063 1 30 ALA H 1 30 ALA HA 2.900 . 2.900 2.858 2.824 2.895 . 0 0 "[ . 1 . 2]" 1
1064 1 30 ALA H 1 30 ALA MB 2.400 . 2.400 2.250 2.215 2.300 . 0 0 "[ . 1 . 2]" 1
1065 1 30 ALA H 1 31 GLN H 2.820 . 2.820 2.411 2.252 2.534 . 0 0 "[ . 1 . 2]" 1
1066 1 30 ALA H 1 31 GLN HG2 4.250 . 4.250 4.204 3.740 4.318 0.068 15 0 "[ . 1 . 2]" 1
1067 1 30 ALA H 1 31 GLN HG3 4.620 . 4.620 4.119 3.821 4.661 0.041 12 0 "[ . 1 . 2]" 1
1068 1 30 ALA H 1 32 ASN H 4.280 . 4.280 3.682 3.508 3.839 . 0 0 "[ . 1 . 2]" 1
1069 1 30 ALA HA 1 31 GLN H 3.470 . 3.470 3.487 3.472 3.510 0.040 20 0 "[ . 1 . 2]" 1
1070 1 30 ALA HA 1 31 GLN HG2 5.090 . 5.090 5.062 4.885 5.146 0.056 16 0 "[ . 1 . 2]" 1
1071 1 30 ALA MB 1 31 GLN H 5.500 . 5.500 2.644 2.372 2.933 . 0 0 "[ . 1 . 2]" 1
1072 1 30 ALA MB 1 31 GLN HE21 4.090 . 4.090 3.946 3.701 4.097 0.007 15 0 "[ . 1 . 2]" 1
1073 1 30 ALA MB 1 31 GLN HE22 5.500 . 5.500 5.428 5.200 5.523 0.023 7 0 "[ . 1 . 2]" 1
1074 1 30 ALA MB 1 31 GLN HG2 3.550 . 3.550 2.922 2.739 3.067 . 0 0 "[ . 1 . 2]" 1
1075 1 30 ALA MB 1 31 GLN HG3 4.220 . 4.220 3.770 3.457 4.270 0.050 16 0 "[ . 1 . 2]" 1
1076 1 30 ALA MB 1 32 ASN H 4.790 . 4.790 4.219 4.108 4.354 . 0 0 "[ . 1 . 2]" 1
1077 1 31 GLN H 1 31 GLN HB2 4.010 . 4.010 3.213 2.968 3.618 . 0 0 "[ . 1 . 2]" 1
1078 1 31 GLN H 1 31 GLN HB3 4.010 . 4.010 3.635 3.298 3.740 . 0 0 "[ . 1 . 2]" 1
1079 1 31 GLN H 1 31 GLN HE21 4.520 . 4.520 4.387 3.981 4.548 0.028 2 0 "[ . 1 . 2]" 1
1080 1 31 GLN H 1 31 GLN HG2 2.900 . 2.900 2.436 1.944 2.604 . 0 0 "[ . 1 . 2]" 1
1081 1 31 GLN H 1 31 GLN HG3 3.830 . 3.830 2.301 2.115 2.608 . 0 0 "[ . 1 . 2]" 1
1082 1 31 GLN H 1 32 ASN H 2.600 . 2.600 2.423 2.211 2.610 0.010 16 0 "[ . 1 . 2]" 1
1083 1 31 GLN H 1 32 ASN QB 5.340 . 5.340 5.223 5.039 5.321 . 0 0 "[ . 1 . 2]" 1
1084 1 31 GLN H 1 33 ILE H 4.110 . 4.110 3.585 3.422 4.133 0.023 9 0 "[ . 1 . 2]" 1
1085 1 31 GLN H 1 33 ILE HG13 5.500 . 5.500 4.773 4.634 5.076 . 0 0 "[ . 1 . 2]" 1
1086 1 31 GLN H 1 49 LEU QD 4.670 . 4.670 4.061 3.914 4.431 . 0 0 "[ . 1 . 2]" 1
1087 1 31 GLN HA 1 31 GLN HG2 3.440 . 3.440 3.092 2.889 3.470 0.030 9 0 "[ . 1 . 2]" 1
1088 1 31 GLN HA 1 31 GLN HG3 3.920 . 3.920 3.702 3.608 3.838 . 0 0 "[ . 1 . 2]" 1
1089 1 31 GLN HA 1 32 ASN H 3.320 . 3.320 3.164 2.974 3.298 . 0 0 "[ . 1 . 2]" 1
1090 1 31 GLN HA 1 32 ASN HD21 4.000 . 4.000 3.165 2.986 3.477 . 0 0 "[ . 1 . 2]" 1
1091 1 31 GLN HA 1 32 ASN HD22 4.210 . 4.210 4.207 3.763 4.271 0.061 20 0 "[ . 1 . 2]" 1
1092 1 31 GLN HA 1 33 ILE MD 4.990 . 4.990 4.697 4.555 4.994 0.004 14 0 "[ . 1 . 2]" 1
1093 1 31 GLN QB 1 32 ASN H 4.310 . 4.310 3.665 3.482 3.961 . 0 0 "[ . 1 . 2]" 1
1094 1 31 GLN QB 1 32 ASN HD21 4.870 . 4.870 4.452 4.345 4.929 0.059 9 0 "[ . 1 . 2]" 1
1095 1 31 GLN QB 1 33 ILE H 5.340 . 5.340 3.594 3.185 4.594 . 0 0 "[ . 1 . 2]" 1
1096 1 31 GLN QB 1 33 ILE MD 3.330 . 3.330 2.355 2.152 2.753 . 0 0 "[ . 1 . 2]" 1
1097 1 31 GLN QB 1 33 ILE HG13 5.250 . 5.250 3.608 3.242 4.458 . 0 0 "[ . 1 . 2]" 1
1098 1 31 GLN HB2 1 32 ASN H 5.030 . 5.030 3.864 3.622 4.266 . 0 0 "[ . 1 . 2]" 1
1099 1 31 GLN HB2 1 33 ILE MD 4.020 . 4.020 2.393 2.197 2.798 . 0 0 "[ . 1 . 2]" 1
1100 1 31 GLN HB3 1 32 ASN H 5.030 . 5.030 4.577 4.478 4.727 . 0 0 "[ . 1 . 2]" 1
1101 1 31 GLN HB3 1 33 ILE MD 4.020 . 4.020 3.515 3.059 4.102 0.082 9 0 "[ . 1 . 2]" 1
1102 1 31 GLN HE21 1 31 GLN HG2 3.020 . 3.020 2.201 2.137 2.545 . 0 0 "[ . 1 . 2]" 1
1103 1 31 GLN HE21 1 49 LEU H 5.500 . 5.500 5.471 5.086 5.546 0.046 6 0 "[ . 1 . 2]" 1
1104 1 31 GLN HE21 1 49 LEU HA 3.780 . 3.780 2.850 2.527 3.081 . 0 0 "[ . 1 . 2]" 1
1105 1 31 GLN HE21 1 49 LEU QD 3.460 . 3.460 2.700 1.789 3.026 0.011 15 0 "[ . 1 . 2]" 1
1106 1 31 GLN HE22 1 31 GLN HG2 3.500 . 3.500 3.496 3.453 3.601 0.101 15 0 "[ . 1 . 2]" 1
1107 1 31 GLN HE22 1 48 ALA MB 4.020 . 4.020 3.507 2.968 3.911 . 0 0 "[ . 1 . 2]" 1
1108 1 31 GLN HE22 1 49 LEU HA 3.440 . 3.440 2.262 1.932 2.767 . 0 0 "[ . 1 . 2]" 1
1109 1 31 GLN HE22 1 49 LEU QD 3.480 . 3.480 2.651 2.363 2.828 . 0 0 "[ . 1 . 2]" 1
1110 1 31 GLN HG2 1 32 ASN H 4.730 . 4.730 4.530 4.270 4.691 . 0 0 "[ . 1 . 2]" 1
1111 1 31 GLN HG2 1 49 LEU QD 4.200 . 4.200 3.357 2.840 3.862 . 0 0 "[ . 1 . 2]" 1
1112 1 31 GLN HG3 1 33 ILE H 4.490 . 4.490 4.016 3.546 4.195 . 0 0 "[ . 1 . 2]" 1
1113 1 31 GLN HG3 1 33 ILE HA 5.500 . 5.500 5.458 4.830 5.629 0.129 8 0 "[ . 1 . 2]" 1
1114 1 31 GLN HG3 1 33 ILE MD 3.860 . 3.860 3.220 2.528 3.564 . 0 0 "[ . 1 . 2]" 1
1115 1 31 GLN HG3 1 49 LEU QD 3.410 . 3.410 2.643 2.449 2.961 . 0 0 "[ . 1 . 2]" 1
1116 1 32 ASN H 1 32 ASN HA 2.400 . 2.400 2.226 2.145 2.268 . 0 0 "[ . 1 . 2]" 1
1117 1 32 ASN H 1 32 ASN HB2 4.160 . 4.160 3.589 3.499 3.987 . 0 0 "[ . 1 . 2]" 1
1118 1 32 ASN H 1 32 ASN QB 3.550 . 3.550 3.334 2.968 3.404 . 0 0 "[ . 1 . 2]" 1
1119 1 32 ASN H 1 32 ASN HB3 4.160 . 4.160 4.023 3.062 4.153 . 0 0 "[ . 1 . 2]" 1
1120 1 32 ASN H 1 32 ASN HD21 4.560 . 4.560 3.351 2.205 3.786 . 0 0 "[ . 1 . 2]" 1
1121 1 32 ASN H 1 32 ASN HD22 4.390 . 4.390 4.114 3.790 4.427 0.037 9 0 "[ . 1 . 2]" 1
1122 1 32 ASN H 1 33 ILE H 2.950 . 2.950 2.627 2.497 2.983 0.033 9 0 "[ . 1 . 2]" 1
1123 1 32 ASN H 1 33 ILE MD 5.300 . 5.300 4.741 4.658 4.925 . 0 0 "[ . 1 . 2]" 1
1124 1 32 ASN HA 1 32 ASN HB2 2.960 . 2.960 2.993 2.565 3.023 0.063 15 0 "[ . 1 . 2]" 1
1125 1 32 ASN HA 1 32 ASN QB 2.570 . 2.570 2.372 2.167 2.419 . 0 0 "[ . 1 . 2]" 1
1126 1 32 ASN HA 1 32 ASN HB3 2.960 . 2.960 2.488 2.336 2.547 . 0 0 "[ . 1 . 2]" 1
1127 1 32 ASN HA 1 32 ASN HD21 4.320 . 4.320 3.837 2.876 4.088 . 0 0 "[ . 1 . 2]" 1
1128 1 32 ASN HA 1 32 ASN HD22 4.940 . 4.940 4.404 3.968 4.992 0.052 9 0 "[ . 1 . 2]" 1
1129 1 32 ASN HA 1 33 ILE H 3.360 . 3.360 2.735 2.285 2.841 . 0 0 "[ . 1 . 2]" 1
1130 1 32 ASN QB 1 32 ASN HD21 2.620 . 2.620 2.230 2.132 2.654 0.034 20 0 "[ . 1 . 2]" 1
1131 1 32 ASN QB 1 32 ASN HD22 3.340 . 3.340 3.293 3.258 3.403 0.063 10 0 "[ . 1 . 2]" 1
1132 1 32 ASN QB 1 33 ILE HA 5.340 . 5.340 4.376 4.245 4.685 . 0 0 "[ . 1 . 2]" 1
1133 1 32 ASN QB 1 33 ILE MD 5.340 . 5.340 4.612 4.365 5.106 . 0 0 "[ . 1 . 2]" 1
1134 1 32 ASN QB 1 34 SER QB 5.180 . 5.180 4.559 4.377 4.822 . 0 0 "[ . 1 . 2]" 1
1135 1 32 ASN HB2 1 32 ASN HD22 4.060 . 4.060 3.514 3.446 4.011 . 0 0 "[ . 1 . 2]" 1
1136 1 32 ASN HB3 1 32 ASN HD22 4.060 . 4.060 4.021 3.465 4.074 0.014 10 0 "[ . 1 . 2]" 1
1137 1 33 ILE H 1 33 ILE HB 2.590 . 2.590 2.507 2.452 2.552 . 0 0 "[ . 1 . 2]" 1
1138 1 33 ILE H 1 33 ILE MD 3.710 . 3.710 3.308 3.194 3.430 . 0 0 "[ . 1 . 2]" 1
1139 1 33 ILE H 1 33 ILE HG12 2.590 . 2.590 2.239 2.135 2.316 . 0 0 "[ . 1 . 2]" 1
1140 1 33 ILE H 1 33 ILE HG13 3.790 . 3.790 3.675 3.600 3.737 . 0 0 "[ . 1 . 2]" 1
1141 1 33 ILE H 1 33 ILE MG 3.950 . 3.950 3.772 3.745 3.790 . 0 0 "[ . 1 . 2]" 1
1142 1 33 ILE H 1 34 SER H 4.540 . 4.540 4.380 4.324 4.521 . 0 0 "[ . 1 . 2]" 1
1143 1 33 ILE HA 1 33 ILE MD 2.890 . 2.890 2.089 2.057 2.122 . 0 0 "[ . 1 . 2]" 1
1144 1 33 ILE HA 1 33 ILE HG12 4.230 . 4.230 3.079 3.034 3.149 . 0 0 "[ . 1 . 2]" 1
1145 1 33 ILE HA 1 33 ILE HG13 3.900 . 3.900 3.769 3.740 3.812 . 0 0 "[ . 1 . 2]" 1
1146 1 33 ILE HA 1 33 ILE MG 2.940 . 2.940 2.464 2.435 2.492 . 0 0 "[ . 1 . 2]" 1
1147 1 33 ILE HA 1 34 SER H 2.400 . 2.400 2.197 2.127 2.282 . 0 0 "[ . 1 . 2]" 1
1148 1 33 ILE HA 1 37 GLN H 4.860 . 4.860 4.545 4.375 4.718 . 0 0 "[ . 1 . 2]" 1
1149 1 33 ILE HA 1 37 GLN HB2 3.910 . 3.910 3.905 3.687 3.965 0.055 3 0 "[ . 1 . 2]" 1
1150 1 33 ILE HA 1 37 GLN HE21 5.290 . 5.290 5.002 4.737 5.313 0.023 14 0 "[ . 1 . 2]" 1
1151 1 33 ILE HA 1 37 GLN HE22 5.500 . 5.500 5.275 4.907 5.590 0.090 15 0 "[ . 1 . 2]" 1
1152 1 33 ILE HA 1 37 GLN HG2 3.840 . 3.840 2.481 2.291 2.842 . 0 0 "[ . 1 . 2]" 1
1153 1 33 ILE HA 1 37 GLN HG3 4.400 . 4.400 2.117 1.940 2.240 . 0 0 "[ . 1 . 2]" 1
1154 1 33 ILE HA 1 45 LYS QE 5.500 . 5.500 5.339 5.152 5.515 0.015 10 0 "[ . 1 . 2]" 1
1155 1 33 ILE HB 1 34 SER H 5.100 . 5.100 4.333 4.225 4.408 . 0 0 "[ . 1 . 2]" 1
1156 1 33 ILE HB 1 49 LEU QD 5.440 . 5.440 3.866 3.704 4.182 . 0 0 "[ . 1 . 2]" 1
1157 1 33 ILE MD 1 33 ILE MG 2.920 . 2.920 1.993 1.936 2.081 . 0 0 "[ . 1 . 2]" 1
1158 1 33 ILE MD 1 34 SER H 3.860 . 3.860 3.843 3.777 3.887 0.027 9 0 "[ . 1 . 2]" 1
1159 1 33 ILE MD 1 37 GLN H 5.090 . 5.090 4.868 4.793 4.965 . 0 0 "[ . 1 . 2]" 1
1160 1 33 ILE MD 1 37 GLN HA 4.910 . 4.910 4.931 4.705 4.980 0.070 12 0 "[ . 1 . 2]" 1
1161 1 33 ILE MD 1 37 GLN HB2 3.340 . 3.340 2.598 2.447 3.012 . 0 0 "[ . 1 . 2]" 1
1162 1 33 ILE MD 1 37 GLN HB3 3.520 . 3.520 3.353 2.893 3.533 0.013 9 0 "[ . 1 . 2]" 1
1163 1 33 ILE MD 1 37 GLN HE21 5.020 . 5.020 4.420 4.185 4.761 . 0 0 "[ . 1 . 2]" 1
1164 1 33 ILE MD 1 37 GLN HG2 3.440 . 3.440 3.164 3.011 3.443 0.003 15 0 "[ . 1 . 2]" 1
1165 1 33 ILE MD 1 37 GLN HG3 4.000 . 4.000 2.062 1.970 2.185 . 0 0 "[ . 1 . 2]" 1
1166 1 33 ILE MD 1 38 LEU HA 5.500 . 5.500 5.430 5.214 5.536 0.036 14 0 "[ . 1 . 2]" 1
1167 1 33 ILE MD 1 45 LYS HB2 5.500 . 5.500 5.489 5.426 5.540 0.040 5 0 "[ . 1 . 2]" 1
1168 1 33 ILE MD 1 45 LYS QE 4.420 . 4.420 2.822 2.655 2.997 . 0 0 "[ . 1 . 2]" 1
1169 1 33 ILE MD 1 49 LEU QD 4.030 . 4.030 2.917 2.537 3.327 . 0 0 "[ . 1 . 2]" 1
1170 1 33 ILE HG12 1 37 GLN HG2 5.500 . 5.500 5.125 4.936 5.523 0.023 15 0 "[ . 1 . 2]" 1
1171 1 33 ILE HG12 1 49 LEU QD 5.440 . 5.440 3.229 3.078 3.565 . 0 0 "[ . 1 . 2]" 1
1172 1 33 ILE HG13 1 37 GLN HG2 5.500 . 5.500 5.085 4.871 5.545 0.045 19 0 "[ . 1 . 2]" 1
1173 1 33 ILE HG13 1 45 LYS QE 5.500 . 5.500 4.585 4.260 4.977 . 0 0 "[ . 1 . 2]" 1
1174 1 33 ILE HG13 1 49 LEU QD 3.630 . 3.630 2.334 2.141 2.587 . 0 0 "[ . 1 . 2]" 1
1175 1 33 ILE MG 1 34 SER H 3.190 . 3.190 3.039 2.790 3.153 . 0 0 "[ . 1 . 2]" 1
1176 1 33 ILE MG 1 34 SER HA 5.160 . 5.160 3.780 3.493 3.880 . 0 0 "[ . 1 . 2]" 1
1177 1 33 ILE MG 1 35 GLY H 5.370 . 5.370 5.094 4.889 5.208 . 0 0 "[ . 1 . 2]" 1
1178 1 33 ILE MG 1 35 GLY HA2 5.500 . 5.500 4.651 4.341 4.851 . 0 0 "[ . 1 . 2]" 1
1179 1 33 ILE MG 1 37 GLN H 3.770 . 3.770 3.613 3.489 3.721 . 0 0 "[ . 1 . 2]" 1
1180 1 33 ILE MG 1 37 GLN HA 4.360 . 4.360 4.339 4.195 4.392 0.032 14 0 "[ . 1 . 2]" 1
1181 1 33 ILE MG 1 37 GLN HB2 3.130 . 3.130 2.141 1.833 2.274 . 0 0 "[ . 1 . 2]" 1
1182 1 33 ILE MG 1 37 GLN HB3 3.570 . 3.570 3.516 2.917 3.643 0.073 12 0 "[ . 1 . 2]" 1
1183 1 33 ILE MG 1 37 GLN HG3 5.260 . 5.260 2.375 2.113 2.537 . 0 0 "[ . 1 . 2]" 1
1184 1 33 ILE MG 1 38 LEU H 4.330 . 4.330 3.358 3.169 3.623 . 0 0 "[ . 1 . 2]" 1
1185 1 33 ILE MG 1 38 LEU HA 3.570 . 3.570 3.350 3.129 3.574 0.004 14 0 "[ . 1 . 2]" 1
1186 1 33 ILE MG 1 38 LEU HB3 5.200 . 5.200 4.652 4.517 4.843 . 0 0 "[ . 1 . 2]" 1
1187 1 33 ILE MG 1 45 LYS HB3 5.500 . 5.500 4.974 4.787 5.235 . 0 0 "[ . 1 . 2]" 1
1188 1 33 ILE MG 1 45 LYS QD 5.500 . 5.500 4.643 4.438 4.914 . 0 0 "[ . 1 . 2]" 1
1189 1 33 ILE MG 1 45 LYS QE 5.500 . 5.500 3.704 3.451 3.965 . 0 0 "[ . 1 . 2]" 1
1190 1 34 SER H 1 34 SER HB2 3.860 . 3.860 3.645 3.515 3.702 . 0 0 "[ . 1 . 2]" 1
1191 1 34 SER H 1 34 SER HB3 3.860 . 3.860 2.836 2.705 3.031 . 0 0 "[ . 1 . 2]" 1
1192 1 34 SER H 1 35 GLY H 5.500 . 5.500 4.323 4.269 4.372 . 0 0 "[ . 1 . 2]" 1
1193 1 34 SER H 1 36 GLU HB2 5.290 . 5.290 5.249 4.973 5.349 0.059 13 0 "[ . 1 . 2]" 1
1194 1 34 SER H 1 36 GLU HB3 5.500 . 5.500 3.917 3.777 4.301 . 0 0 "[ . 1 . 2]" 1
1195 1 34 SER H 1 37 GLN H 3.680 . 3.680 3.149 3.039 3.303 . 0 0 "[ . 1 . 2]" 1
1196 1 34 SER H 1 37 GLN HB2 4.370 . 4.370 4.319 3.906 4.427 0.057 20 0 "[ . 1 . 2]" 1
1197 1 34 SER H 1 37 GLN HB3 5.500 . 5.500 4.748 4.678 4.812 . 0 0 "[ . 1 . 2]" 1
1198 1 34 SER H 1 37 GLN HE21 5.140 . 5.140 4.649 4.418 4.849 . 0 0 "[ . 1 . 2]" 1
1199 1 34 SER H 1 37 GLN HE22 5.130 . 5.130 4.558 4.227 5.148 0.018 19 0 "[ . 1 . 2]" 1
1200 1 34 SER H 1 37 GLN HG2 5.500 . 5.500 1.958 1.781 2.023 0.019 17 0 "[ . 1 . 2]" 1
1201 1 34 SER H 1 37 GLN HG3 3.880 . 3.880 2.918 2.606 3.056 . 0 0 "[ . 1 . 2]" 1
1202 1 34 SER H 1 38 LEU H 5.500 . 5.500 4.449 4.253 4.723 . 0 0 "[ . 1 . 2]" 1
1203 1 34 SER HA 1 34 SER QB 2.520 . 2.520 2.186 2.161 2.205 . 0 0 "[ . 1 . 2]" 1
1204 1 34 SER HA 1 35 GLY H 2.900 . 2.900 2.723 2.619 2.806 . 0 0 "[ . 1 . 2]" 1
1205 1 34 SER HA 1 37 GLN HG2 5.020 . 5.020 4.337 4.238 4.428 . 0 0 "[ . 1 . 2]" 1
1206 1 34 SER QB 1 35 GLY H 2.530 . 2.530 1.968 1.872 2.048 . 0 0 "[ . 1 . 2]" 1
1207 1 34 SER QB 1 36 GLU H 4.530 . 4.530 3.009 2.686 3.229 . 0 0 "[ . 1 . 2]" 1
1208 1 34 SER QB 1 37 GLN H 5.340 . 5.340 4.281 4.068 4.370 . 0 0 "[ . 1 . 2]" 1
1209 1 34 SER QB 1 38 LEU MD1 5.340 . 5.340 5.306 5.153 5.376 0.036 15 0 "[ . 1 . 2]" 1
1210 1 35 GLY H 1 35 GLY HA2 2.870 . 2.870 2.806 2.785 2.823 . 0 0 "[ . 1 . 2]" 1
1211 1 35 GLY H 1 35 GLY HA3 2.800 . 2.800 2.270 2.257 2.290 . 0 0 "[ . 1 . 2]" 1
1212 1 35 GLY H 1 36 GLU H 2.960 . 2.960 2.544 2.454 2.627 . 0 0 "[ . 1 . 2]" 1
1213 1 35 GLY H 1 36 GLU HA 5.500 . 5.500 5.159 5.058 5.276 . 0 0 "[ . 1 . 2]" 1
1214 1 35 GLY H 1 37 GLN H 4.270 . 4.270 4.332 4.298 4.368 0.098 11 0 "[ . 1 . 2]" 1
1215 1 35 GLY H 1 38 LEU H 5.500 . 5.500 4.600 4.479 4.748 . 0 0 "[ . 1 . 2]" 1
1216 1 35 GLY H 1 38 LEU HB3 5.360 . 5.360 4.843 4.729 4.934 . 0 0 "[ . 1 . 2]" 1
1217 1 35 GLY HA2 1 37 GLN H 4.430 . 4.430 4.152 4.007 4.278 . 0 0 "[ . 1 . 2]" 1
1218 1 35 GLY HA2 1 38 LEU H 3.500 . 3.500 3.046 2.861 3.121 . 0 0 "[ . 1 . 2]" 1
1219 1 35 GLY HA2 1 38 LEU HB2 4.050 . 4.050 2.128 2.010 2.271 . 0 0 "[ . 1 . 2]" 1
1220 1 35 GLY HA2 1 38 LEU HB3 3.750 . 3.750 2.104 1.983 2.180 . 0 0 "[ . 1 . 2]" 1
1221 1 35 GLY HA2 1 38 LEU MD1 4.030 . 4.030 2.413 2.173 2.608 . 0 0 "[ . 1 . 2]" 1
1222 1 35 GLY HA2 1 38 LEU MD2 5.340 . 5.340 3.893 3.746 4.024 . 0 0 "[ . 1 . 2]" 1
1223 1 35 GLY HA2 1 39 LEU H 4.380 . 4.380 3.631 3.427 3.838 . 0 0 "[ . 1 . 2]" 1
1224 1 35 GLY HA3 1 36 GLU H 2.980 . 2.980 2.926 2.798 2.989 0.009 6 0 "[ . 1 . 2]" 1
1225 1 35 GLY HA3 1 37 GLN H 5.500 . 5.500 4.727 4.613 4.805 . 0 0 "[ . 1 . 2]" 1
1226 1 35 GLY HA3 1 38 LEU H 4.690 . 4.690 4.278 4.157 4.399 . 0 0 "[ . 1 . 2]" 1
1227 1 35 GLY HA3 1 38 LEU HB3 4.620 . 4.620 3.582 3.460 3.674 . 0 0 "[ . 1 . 2]" 1
1228 1 35 GLY HA3 1 38 LEU MD1 5.500 . 5.500 3.488 3.190 3.685 . 0 0 "[ . 1 . 2]" 1
1229 1 35 GLY HA3 1 39 LEU H 5.070 . 5.070 4.542 4.404 4.668 . 0 0 "[ . 1 . 2]" 1
1230 1 36 GLU H 1 36 GLU HA 2.910 . 2.910 2.794 2.744 2.832 . 0 0 "[ . 1 . 2]" 1
1231 1 36 GLU H 1 36 GLU HB2 2.630 . 2.630 2.402 2.306 2.504 . 0 0 "[ . 1 . 2]" 1
1232 1 36 GLU H 1 36 GLU HB3 3.360 . 3.360 2.506 2.375 2.643 . 0 0 "[ . 1 . 2]" 1
1233 1 36 GLU H 1 36 GLU HG2 4.790 . 4.790 4.462 4.360 4.602 . 0 0 "[ . 1 . 2]" 1
1234 1 36 GLU H 1 36 GLU HG3 4.790 . 4.790 4.404 4.335 4.458 . 0 0 "[ . 1 . 2]" 1
1235 1 36 GLU H 1 37 GLN H 2.920 . 2.920 2.704 2.567 2.884 . 0 0 "[ . 1 . 2]" 1
1236 1 36 GLU H 1 37 GLN HG2 5.140 . 5.140 4.346 3.833 4.722 . 0 0 "[ . 1 . 2]" 1
1237 1 36 GLU H 1 38 LEU H 4.250 . 4.250 3.731 3.604 3.889 . 0 0 "[ . 1 . 2]" 1
1238 1 36 GLU HA 1 36 GLU QG 2.770 . 2.770 2.611 2.438 2.881 0.111 20 0 "[ . 1 . 2]" 1
1239 1 36 GLU HA 1 37 GLN HE21 5.420 . 5.420 5.299 4.550 5.476 0.056 17 0 "[ . 1 . 2]" 1
1240 1 36 GLU HA 1 38 LEU H 5.500 . 5.500 4.324 4.087 4.636 . 0 0 "[ . 1 . 2]" 1
1241 1 36 GLU HA 1 39 LEU H 5.500 . 5.500 4.274 3.953 4.608 . 0 0 "[ . 1 . 2]" 1
1242 1 36 GLU HA 1 39 LEU QD 3.630 . 3.630 3.002 2.358 3.378 . 0 0 "[ . 1 . 2]" 1
1243 1 36 GLU HB2 1 36 GLU QG 2.620 . 2.620 2.336 2.285 2.390 . 0 0 "[ . 1 . 2]" 1
1244 1 36 GLU HB2 1 37 GLN H 3.900 . 3.900 3.773 3.672 3.902 0.002 19 0 "[ . 1 . 2]" 1
1245 1 36 GLU HB2 1 37 GLN HE21 5.280 . 5.280 5.068 4.361 5.297 0.017 17 0 "[ . 1 . 2]" 1
1246 1 36 GLU HB3 1 36 GLU QG 2.520 . 2.520 2.278 2.131 2.383 . 0 0 "[ . 1 . 2]" 1
1247 1 36 GLU HB3 1 37 GLN H 3.150 . 3.150 2.477 2.347 2.688 . 0 0 "[ . 1 . 2]" 1
1248 1 36 GLU HB3 1 37 GLN HA 5.010 . 5.010 4.304 4.151 4.455 . 0 0 "[ . 1 . 2]" 1
1249 1 36 GLU HB3 1 37 GLN HE21 3.650 . 3.650 3.484 2.772 3.668 0.018 17 0 "[ . 1 . 2]" 1
1250 1 36 GLU HB3 1 37 GLN HE22 3.930 . 3.930 2.844 2.595 3.720 . 0 0 "[ . 1 . 2]" 1
1251 1 36 GLU QG 1 37 GLN HE21 5.220 . 5.220 3.066 2.482 3.382 . 0 0 "[ . 1 . 2]" 1
1252 1 36 GLU QG 1 37 GLN HE22 4.330 . 4.330 2.697 2.450 3.356 . 0 0 "[ . 1 . 2]" 1
1253 1 36 GLU HG2 1 37 GLN H 5.410 . 5.410 4.046 3.549 4.880 . 0 0 "[ . 1 . 2]" 1
1254 1 36 GLU HG3 1 37 GLN H 5.410 . 5.410 4.411 3.660 4.856 . 0 0 "[ . 1 . 2]" 1
1255 1 37 GLN H 1 37 GLN HB2 3.730 . 3.730 3.404 2.956 3.510 . 0 0 "[ . 1 . 2]" 1
1256 1 37 GLN H 1 37 GLN HB3 3.880 . 3.880 3.519 3.459 3.667 . 0 0 "[ . 1 . 2]" 1
1257 1 37 GLN H 1 37 GLN HE21 4.080 . 4.080 3.396 2.741 3.600 . 0 0 "[ . 1 . 2]" 1
1258 1 37 GLN H 1 37 GLN HE22 4.580 . 4.580 3.848 3.702 4.289 . 0 0 "[ . 1 . 2]" 1
1259 1 37 GLN H 1 37 GLN HG2 4.220 . 4.220 2.167 1.913 2.279 . 0 0 "[ . 1 . 2]" 1
1260 1 37 GLN H 1 37 GLN HG3 3.580 . 3.580 3.618 3.500 3.665 0.085 12 0 "[ . 1 . 2]" 1
1261 1 37 GLN H 1 38 LEU H 2.600 . 2.600 2.203 2.128 2.281 . 0 0 "[ . 1 . 2]" 1
1262 1 37 GLN H 1 38 LEU HA 4.870 . 4.870 4.835 4.760 4.890 0.020 8 0 "[ . 1 . 2]" 1
1263 1 37 GLN H 1 38 LEU HB2 4.300 . 4.300 3.972 3.860 4.080 . 0 0 "[ . 1 . 2]" 1
1264 1 37 GLN H 1 38 LEU HB3 5.500 . 5.500 4.594 4.381 4.695 . 0 0 "[ . 1 . 2]" 1
1265 1 37 GLN H 1 39 LEU QD 5.440 . 5.440 5.126 4.711 5.332 . 0 0 "[ . 1 . 2]" 1
1266 1 37 GLN H 1 40 GLN H 5.500 . 5.500 5.087 4.865 5.241 . 0 0 "[ . 1 . 2]" 1
1267 1 37 GLN HA 1 37 GLN HB2 2.990 . 2.990 2.790 2.721 2.927 . 0 0 "[ . 1 . 2]" 1
1268 1 37 GLN HA 1 37 GLN HE21 4.390 . 4.390 2.830 1.914 3.186 . 0 0 "[ . 1 . 2]" 1
1269 1 37 GLN HA 1 37 GLN HE22 4.380 . 4.380 4.171 3.578 4.397 0.017 3 0 "[ . 1 . 2]" 1
1270 1 37 GLN HA 1 37 GLN HG2 3.790 . 3.790 3.718 3.565 3.788 . 0 0 "[ . 1 . 2]" 1
1271 1 37 GLN HA 1 39 LEU H 5.500 . 5.500 4.322 4.106 4.577 . 0 0 "[ . 1 . 2]" 1
1272 1 37 GLN HA 1 40 GLN H 4.060 . 4.060 3.439 3.107 3.793 . 0 0 "[ . 1 . 2]" 1
1273 1 37 GLN HA 1 40 GLN HB3 5.500 . 5.500 4.767 4.547 5.139 . 0 0 "[ . 1 . 2]" 1
1274 1 37 GLN HA 1 40 GLN HE21 3.730 . 3.730 1.905 1.772 2.315 0.028 13 0 "[ . 1 . 2]" 1
1275 1 37 GLN HA 1 40 GLN HE22 4.070 . 4.070 3.455 2.952 3.805 . 0 0 "[ . 1 . 2]" 1
1276 1 37 GLN HA 1 40 GLN HG2 3.530 . 3.530 3.247 2.857 3.545 0.015 19 0 "[ . 1 . 2]" 1
1277 1 37 GLN HA 1 40 GLN HG3 3.120 . 3.120 2.219 2.019 2.580 . 0 0 "[ . 1 . 2]" 1
1278 1 37 GLN HB2 1 37 GLN HG2 2.870 . 2.870 2.454 2.414 2.576 . 0 0 "[ . 1 . 2]" 1
1279 1 37 GLN HB2 1 37 GLN HG3 2.720 . 2.720 2.303 2.212 2.361 . 0 0 "[ . 1 . 2]" 1
1280 1 37 GLN HB2 1 38 LEU H 5.500 . 5.500 3.589 2.583 3.951 . 0 0 "[ . 1 . 2]" 1
1281 1 37 GLN HB2 1 40 GLN HE21 5.500 . 5.500 3.221 2.749 3.919 . 0 0 "[ . 1 . 2]" 1
1282 1 37 GLN HB2 1 45 LYS QE 5.500 . 5.500 2.695 2.308 3.450 . 0 0 "[ . 1 . 2]" 1
1283 1 37 GLN HB3 1 38 LEU H 4.680 . 4.680 4.420 3.923 4.582 . 0 0 "[ . 1 . 2]" 1
1284 1 37 GLN HB3 1 40 GLN HE22 5.200 . 5.200 3.299 2.821 3.560 . 0 0 "[ . 1 . 2]" 1
1285 1 37 GLN HE21 1 40 GLN HE21 4.910 . 4.910 3.631 3.054 4.044 . 0 0 "[ . 1 . 2]" 1
1286 1 37 GLN HE21 1 40 GLN HE22 4.750 . 4.750 4.416 3.791 4.776 0.026 13 0 "[ . 1 . 2]" 1
1287 1 37 GLN HE22 1 40 GLN HE21 5.500 . 5.500 5.177 4.313 5.582 0.082 10 0 "[ . 1 . 2]" 1
1288 1 37 GLN HG2 1 38 LEU HA 5.370 . 5.370 5.027 4.739 5.399 0.029 14 0 "[ . 1 . 2]" 1
1289 1 37 GLN HG3 1 38 LEU H 5.500 . 5.500 4.757 4.327 5.105 . 0 0 "[ . 1 . 2]" 1
1290 1 38 LEU H 1 38 LEU HB2 2.860 . 2.860 2.194 2.104 2.326 . 0 0 "[ . 1 . 2]" 1
1291 1 38 LEU H 1 38 LEU HB3 3.030 . 3.030 2.638 2.580 2.739 . 0 0 "[ . 1 . 2]" 1
1292 1 38 LEU H 1 38 LEU MD1 4.520 . 4.520 4.070 3.996 4.128 . 0 0 "[ . 1 . 2]" 1
1293 1 38 LEU H 1 39 LEU H 2.920 . 2.920 2.629 2.295 2.910 . 0 0 "[ . 1 . 2]" 1
1294 1 38 LEU H 1 39 LEU QD 5.440 . 5.440 4.549 4.071 4.770 . 0 0 "[ . 1 . 2]" 1
1295 1 38 LEU H 1 40 GLN H 4.550 . 4.550 4.017 3.778 4.343 . 0 0 "[ . 1 . 2]" 1
1296 1 38 LEU H 1 40 GLN HE21 5.500 . 5.500 4.808 4.445 5.121 . 0 0 "[ . 1 . 2]" 1
1297 1 38 LEU HA 1 38 LEU MD1 3.990 . 3.990 3.854 3.818 3.894 . 0 0 "[ . 1 . 2]" 1
1298 1 38 LEU HA 1 38 LEU MD2 2.900 . 2.900 2.692 2.530 2.821 . 0 0 "[ . 1 . 2]" 1
1299 1 38 LEU HA 1 38 LEU HG 3.930 . 3.930 2.663 2.600 2.739 . 0 0 "[ . 1 . 2]" 1
1300 1 38 LEU HA 1 40 GLN H 4.770 . 4.770 4.427 4.280 4.586 . 0 0 "[ . 1 . 2]" 1
1301 1 38 LEU HA 1 41 LEU H 4.090 . 4.090 3.823 3.719 3.991 . 0 0 "[ . 1 . 2]" 1
1302 1 38 LEU HA 1 41 LEU HB2 4.390 . 4.390 3.881 3.726 4.037 . 0 0 "[ . 1 . 2]" 1
1303 1 38 LEU HA 1 41 LEU MD1 4.260 . 4.260 2.246 2.134 2.410 . 0 0 "[ . 1 . 2]" 1
1304 1 38 LEU HA 1 41 LEU QD 2.930 . 2.930 2.204 2.098 2.334 . 0 0 "[ . 1 . 2]" 1
1305 1 38 LEU HA 1 41 LEU MD2 4.260 . 4.260 3.223 3.074 3.432 . 0 0 "[ . 1 . 2]" 1
1306 1 38 LEU HA 1 41 LEU HG 3.330 . 3.330 2.031 1.939 2.346 . 0 0 "[ . 1 . 2]" 1
1307 1 38 LEU HA 1 64 LEU QD 5.440 . 5.440 4.710 4.181 4.987 . 0 0 "[ . 1 . 2]" 1
1308 1 38 LEU HA 1 67 MET QG 5.340 . 5.340 5.385 5.292 5.452 0.112 1 0 "[ . 1 . 2]" 1
1309 1 38 LEU HB2 1 38 LEU MD2 3.540 . 3.540 3.199 3.182 3.229 . 0 0 "[ . 1 . 2]" 1
1310 1 38 LEU HB3 1 38 LEU MD1 3.460 . 3.460 2.333 2.285 2.366 . 0 0 "[ . 1 . 2]" 1
1311 1 38 LEU HB3 1 38 LEU MD2 3.070 . 3.070 2.410 2.368 2.464 . 0 0 "[ . 1 . 2]" 1
1312 1 38 LEU HB3 1 39 LEU H 2.890 . 2.890 2.260 2.193 2.405 . 0 0 "[ . 1 . 2]" 1
1313 1 38 LEU HB3 1 39 LEU QD 4.020 . 4.020 3.661 3.423 3.914 . 0 0 "[ . 1 . 2]" 1
1314 1 38 LEU MD1 1 39 LEU H 4.740 . 4.740 4.202 4.070 4.347 . 0 0 "[ . 1 . 2]" 1
1315 1 38 LEU MD1 1 39 LEU HA 5.500 . 5.500 4.990 4.850 5.152 . 0 0 "[ . 1 . 2]" 1
1316 1 38 LEU MD1 1 39 LEU QD 5.440 . 5.440 3.954 3.686 4.448 . 0 0 "[ . 1 . 2]" 1
1317 1 38 LEU MD1 1 41 LEU QD 5.440 . 5.440 4.066 3.865 4.322 . 0 0 "[ . 1 . 2]" 1
1318 1 38 LEU MD1 1 67 MET QG 5.340 . 5.340 3.607 3.084 4.244 . 0 0 "[ . 1 . 2]" 1
1319 1 38 LEU MD1 1 71 LEU HB2 5.500 . 5.500 5.338 5.034 5.504 0.004 2 0 "[ . 1 . 2]" 1
1320 1 38 LEU MD2 1 39 LEU H 3.890 . 3.890 3.483 3.384 3.664 . 0 0 "[ . 1 . 2]" 1
1321 1 38 LEU MD2 1 39 LEU HA 3.590 . 3.590 3.250 3.126 3.544 . 0 0 "[ . 1 . 2]" 1
1322 1 38 LEU MD2 1 39 LEU MD1 5.500 . 5.500 4.861 4.651 5.160 . 0 0 "[ . 1 . 2]" 1
1323 1 38 LEU MD2 1 39 LEU MD2 5.500 . 5.500 3.323 2.936 4.209 . 0 0 "[ . 1 . 2]" 1
1324 1 38 LEU MD2 1 40 GLN H 5.090 . 5.090 4.912 4.789 5.024 . 0 0 "[ . 1 . 2]" 1
1325 1 38 LEU MD2 1 41 LEU H 5.310 . 5.310 4.328 4.194 4.565 . 0 0 "[ . 1 . 2]" 1
1326 1 38 LEU MD2 1 41 LEU QD 5.440 . 5.440 2.390 2.134 2.717 . 0 0 "[ . 1 . 2]" 1
1327 1 38 LEU MD2 1 64 LEU HA 4.580 . 4.580 3.047 2.693 3.336 . 0 0 "[ . 1 . 2]" 1
1328 1 38 LEU MD2 1 64 LEU QD 5.440 . 5.440 3.788 3.340 4.089 . 0 0 "[ . 1 . 2]" 1
1329 1 38 LEU MD2 1 67 MET HA 5.500 . 5.500 4.857 4.223 5.451 . 0 0 "[ . 1 . 2]" 1
1330 1 38 LEU MD2 1 67 MET QG 5.340 . 5.340 2.058 1.843 2.462 . 0 0 "[ . 1 . 2]" 1
1331 1 38 LEU HG 1 41 LEU QD 5.440 . 5.440 2.947 2.698 3.270 . 0 0 "[ . 1 . 2]" 1
1332 1 39 LEU H 1 39 LEU HB2 2.780 . 2.780 2.452 2.408 2.533 . 0 0 "[ . 1 . 2]" 1
1333 1 39 LEU H 1 39 LEU HB3 3.640 . 3.640 3.556 3.534 3.577 . 0 0 "[ . 1 . 2]" 1
1334 1 39 LEU H 1 39 LEU MD1 4.100 . 4.100 3.285 3.073 3.364 . 0 0 "[ . 1 . 2]" 1
1335 1 39 LEU H 1 39 LEU QD 3.590 . 3.590 3.013 2.939 3.076 . 0 0 "[ . 1 . 2]" 1
1336 1 39 LEU H 1 39 LEU MD2 4.100 . 4.100 3.517 3.312 3.740 . 0 0 "[ . 1 . 2]" 1
1337 1 39 LEU H 1 39 LEU HG 2.580 . 2.580 2.192 2.038 2.382 . 0 0 "[ . 1 . 2]" 1
1338 1 39 LEU H 1 40 GLN H 2.880 . 2.880 2.649 2.588 2.732 . 0 0 "[ . 1 . 2]" 1
1339 1 39 LEU H 1 40 GLN HG3 5.010 . 5.010 4.191 4.004 4.310 . 0 0 "[ . 1 . 2]" 1
1340 1 39 LEU H 1 41 LEU H 4.440 . 4.440 4.154 4.061 4.245 . 0 0 "[ . 1 . 2]" 1
1341 1 39 LEU HA 1 39 LEU QD 2.910 . 2.910 2.196 2.089 2.440 . 0 0 "[ . 1 . 2]" 1
1342 1 39 LEU HA 1 39 LEU HG 3.740 . 3.740 2.935 2.836 3.131 . 0 0 "[ . 1 . 2]" 1
1343 1 39 LEU HA 1 41 LEU H 4.710 . 4.710 3.927 3.803 4.089 . 0 0 "[ . 1 . 2]" 1
1344 1 39 LEU HA 1 41 LEU QD 4.770 . 4.770 4.776 4.662 4.813 0.043 18 0 "[ . 1 . 2]" 1
1345 1 39 LEU HA 1 64 LEU QD 3.940 . 3.940 3.932 3.470 4.043 0.103 8 0 "[ . 1 . 2]" 1
1346 1 39 LEU HA 1 67 MET QG 4.480 . 4.480 3.338 2.211 4.459 . 0 0 "[ . 1 . 2]" 1
1347 1 39 LEU HB2 1 39 LEU QD 3.100 . 3.100 2.143 2.098 2.178 . 0 0 "[ . 1 . 2]" 1
1348 1 39 LEU HB2 1 40 GLN H 3.550 . 3.550 2.599 2.512 2.711 . 0 0 "[ . 1 . 2]" 1
1349 1 39 LEU HB2 1 40 GLN HA 5.100 . 5.100 4.386 4.264 4.478 . 0 0 "[ . 1 . 2]" 1
1350 1 39 LEU HB3 1 39 LEU MD1 3.300 . 3.300 2.509 2.444 2.665 . 0 0 "[ . 1 . 2]" 1
1351 1 39 LEU HB3 1 39 LEU QD 2.800 . 2.800 2.093 2.079 2.116 . 0 0 "[ . 1 . 2]" 1
1352 1 39 LEU HB3 1 39 LEU MD2 3.300 . 3.300 2.244 2.198 2.280 . 0 0 "[ . 1 . 2]" 1
1353 1 39 LEU HB3 1 40 GLN H 4.490 . 4.490 3.612 3.469 3.709 . 0 0 "[ . 1 . 2]" 1
1354 1 39 LEU QD 1 40 GLN H 3.870 . 3.870 3.989 3.941 4.040 0.170 9 0 "[ . 1 . 2]" 1
1355 1 39 LEU QD 1 41 LEU H 5.440 . 5.440 5.216 5.129 5.358 . 0 0 "[ . 1 . 2]" 1
1356 1 39 LEU QD 1 67 MET QB 4.230 . 4.230 3.143 2.094 4.334 0.104 5 0 "[ . 1 . 2]" 1
1357 1 39 LEU QD 1 67 MET QG 4.890 . 4.890 2.751 1.880 4.444 . 0 0 "[ . 1 . 2]" 1
1358 1 39 LEU QD 1 68 LYS H 4.270 . 4.270 3.820 3.593 4.196 . 0 0 "[ . 1 . 2]" 1
1359 1 39 LEU QD 1 68 LYS HA 5.000 . 5.000 3.479 2.776 4.208 . 0 0 "[ . 1 . 2]" 1
1360 1 39 LEU QD 1 68 LYS HB2 5.440 . 5.440 4.124 2.831 5.441 0.001 18 0 "[ . 1 . 2]" 1
1361 1 39 LEU QD 1 68 LYS QE 5.010 . 5.010 4.261 3.013 5.080 0.070 10 0 "[ . 1 . 2]" 1
1362 1 39 LEU QD 1 71 LEU H 5.440 . 5.440 5.547 5.435 5.652 0.212 8 0 "[ . 1 . 2]" 1
1363 1 39 LEU QD 1 71 LEU HB3 4.790 . 4.790 4.497 4.250 4.662 . 0 0 "[ . 1 . 2]" 1
1364 1 39 LEU MD1 1 40 GLN H 5.340 . 5.340 4.303 4.175 4.391 . 0 0 "[ . 1 . 2]" 1
1365 1 39 LEU MD2 1 40 GLN H 5.340 . 5.340 4.720 4.656 4.838 . 0 0 "[ . 1 . 2]" 1
1366 1 40 GLN H 1 40 GLN HB2 3.990 . 3.990 3.736 3.703 3.772 . 0 0 "[ . 1 . 2]" 1
1367 1 40 GLN H 1 40 GLN HB3 3.060 . 3.060 2.924 2.815 3.062 0.002 17 0 "[ . 1 . 2]" 1
1368 1 40 GLN H 1 40 GLN HG2 3.490 . 3.490 3.462 3.371 3.514 0.024 16 0 "[ . 1 . 2]" 1
1369 1 40 GLN H 1 40 GLN HG3 2.820 . 2.820 2.071 1.946 2.174 . 0 0 "[ . 1 . 2]" 1
1370 1 40 GLN H 1 41 LEU HB2 5.500 . 5.500 4.838 4.718 5.014 . 0 0 "[ . 1 . 2]" 1
1371 1 40 GLN H 1 41 LEU QD 5.440 . 5.440 4.583 4.454 4.725 . 0 0 "[ . 1 . 2]" 1
1372 1 40 GLN HA 1 40 GLN HB2 2.950 . 2.950 2.460 2.434 2.501 . 0 0 "[ . 1 . 2]" 1
1373 1 40 GLN HA 1 40 GLN HE21 5.500 . 5.500 5.201 4.456 5.514 0.014 6 0 "[ . 1 . 2]" 1
1374 1 40 GLN HA 1 40 GLN HG3 3.940 . 3.940 3.648 3.575 3.684 . 0 0 "[ . 1 . 2]" 1
1375 1 40 GLN HA 1 41 LEU H 3.210 . 3.210 3.082 2.960 3.164 . 0 0 "[ . 1 . 2]" 1
1376 1 40 GLN HA 1 41 LEU HB2 5.310 . 5.310 5.028 4.933 5.130 . 0 0 "[ . 1 . 2]" 1
1377 1 40 GLN HA 1 64 LEU QD 5.440 . 5.440 3.935 3.650 4.184 . 0 0 "[ . 1 . 2]" 1
1378 1 40 GLN HE21 1 40 GLN HG2 3.340 . 3.340 3.038 2.910 3.361 0.021 17 0 "[ . 1 . 2]" 1
1379 1 40 GLN HE21 1 40 GLN HG3 3.510 . 3.510 2.190 2.114 2.257 . 0 0 "[ . 1 . 2]" 1
1380 1 40 GLN HE21 1 41 LEU QD 4.420 . 4.420 4.121 3.592 4.447 0.027 4 0 "[ . 1 . 2]" 1
1381 1 40 GLN HE21 1 45 LYS HG2 5.500 . 5.500 5.520 5.436 5.565 0.065 19 0 "[ . 1 . 2]" 1
1382 1 40 GLN HE21 1 45 LYS HG3 5.500 . 5.500 5.217 4.860 5.462 . 0 0 "[ . 1 . 2]" 1
1383 1 40 GLN HE22 1 40 GLN HG3 3.700 . 3.700 3.442 3.388 3.477 . 0 0 "[ . 1 . 2]" 1
1384 1 40 GLN HE22 1 41 LEU HA 4.250 . 4.250 4.213 3.757 4.324 0.074 3 0 "[ . 1 . 2]" 1
1385 1 40 GLN HE22 1 41 LEU QD 5.010 . 5.010 4.310 3.920 4.529 . 0 0 "[ . 1 . 2]" 1
1386 1 40 GLN HE22 1 45 LYS HB2 5.500 . 5.500 5.500 5.243 5.557 0.057 7 0 "[ . 1 . 2]" 1
1387 1 40 GLN HE22 1 45 LYS QD 5.500 . 5.500 1.839 1.788 2.026 0.012 16 0 "[ . 1 . 2]" 1
1388 1 40 GLN HG2 1 45 LYS QE 5.500 . 5.500 5.506 5.406 5.575 0.075 10 0 "[ . 1 . 2]" 1
1389 1 40 GLN HG3 1 41 LEU HA 4.830 . 4.830 4.696 4.499 4.898 0.068 8 0 "[ . 1 . 2]" 1
1390 1 41 LEU H 1 41 LEU HA 2.850 . 2.850 2.740 2.696 2.785 . 0 0 "[ . 1 . 2]" 1
1391 1 41 LEU H 1 41 LEU HB2 2.630 . 2.630 2.295 2.202 2.350 . 0 0 "[ . 1 . 2]" 1
1392 1 41 LEU H 1 41 LEU HB3 3.610 . 3.610 3.547 3.506 3.577 . 0 0 "[ . 1 . 2]" 1
1393 1 41 LEU H 1 41 LEU QD 3.700 . 3.700 3.223 3.174 3.286 . 0 0 "[ . 1 . 2]" 1
1394 1 41 LEU H 1 41 LEU HG 4.320 . 4.320 2.608 2.500 2.787 . 0 0 "[ . 1 . 2]" 1
1395 1 41 LEU H 1 42 ASP H 4.790 . 4.790 4.575 4.501 4.622 . 0 0 "[ . 1 . 2]" 1
1396 1 41 LEU H 1 45 LYS QD 4.740 . 4.740 4.102 3.983 4.234 . 0 0 "[ . 1 . 2]" 1
1397 1 41 LEU H 1 45 LYS HG3 5.500 . 5.500 5.562 5.525 5.624 0.124 16 0 "[ . 1 . 2]" 1
1398 1 41 LEU H 1 64 LEU MD1 4.660 . 4.660 3.152 2.733 3.411 . 0 0 "[ . 1 . 2]" 1
1399 1 41 LEU H 1 64 LEU QD 3.220 . 3.220 3.003 2.676 3.168 . 0 0 "[ . 1 . 2]" 1
1400 1 41 LEU H 1 64 LEU MD2 4.660 . 4.660 3.849 3.617 4.176 . 0 0 "[ . 1 . 2]" 1
1401 1 41 LEU HA 1 41 LEU MD1 3.560 . 3.560 3.742 3.725 3.761 0.201 7 0 "[ . 1 . 2]" 1
1402 1 41 LEU HA 1 41 LEU QD 2.840 . 2.840 2.041 1.995 2.084 . 0 0 "[ . 1 . 2]" 1
1403 1 41 LEU HA 1 41 LEU MD2 3.560 . 3.560 2.050 2.003 2.094 . 0 0 "[ . 1 . 2]" 1
1404 1 41 LEU HA 1 41 LEU HG 4.150 . 4.150 2.800 2.734 2.885 . 0 0 "[ . 1 . 2]" 1
1405 1 41 LEU HA 1 42 ASP H 2.400 . 2.400 2.264 2.111 2.404 0.004 10 0 "[ . 1 . 2]" 1
1406 1 41 LEU HA 1 45 LYS QD 3.220 . 3.220 2.023 1.875 2.186 . 0 0 "[ . 1 . 2]" 1
1407 1 41 LEU HA 1 45 LYS HG2 4.670 . 4.670 4.377 4.299 4.482 . 0 0 "[ . 1 . 2]" 1
1408 1 41 LEU HA 1 45 LYS HG3 4.620 . 4.620 2.935 2.859 3.068 . 0 0 "[ . 1 . 2]" 1
1409 1 41 LEU HB2 1 64 LEU MD1 3.860 . 3.860 2.636 2.150 3.092 . 0 0 "[ . 1 . 2]" 1
1410 1 41 LEU HB2 1 64 LEU QD 3.230 . 3.230 1.896 1.779 1.958 0.021 1 0 "[ . 1 . 2]" 1
1411 1 41 LEU HB2 1 64 LEU MD2 3.860 . 3.860 1.962 1.850 2.176 . 0 0 "[ . 1 . 2]" 1
1412 1 41 LEU HB3 1 42 ASP H 3.170 . 3.170 2.661 2.327 3.081 . 0 0 "[ . 1 . 2]" 1
1413 1 41 LEU HB3 1 49 LEU QD 5.440 . 5.440 5.338 4.728 5.476 0.036 20 0 "[ . 1 . 2]" 1
1414 1 41 LEU HB3 1 64 LEU QD 5.440 . 5.440 2.125 1.994 2.237 . 0 0 "[ . 1 . 2]" 1
1415 1 41 LEU QD 1 42 ASP H 3.280 . 3.280 2.885 2.729 3.062 . 0 0 "[ . 1 . 2]" 1
1416 1 41 LEU QD 1 42 ASP HA 5.270 . 5.270 4.721 4.594 4.827 . 0 0 "[ . 1 . 2]" 1
1417 1 41 LEU QD 1 43 GLY HA2 5.440 . 5.440 5.477 5.444 5.510 0.070 12 0 "[ . 1 . 2]" 1
1418 1 41 LEU QD 1 45 LYS H 4.710 . 4.710 4.375 4.254 4.597 . 0 0 "[ . 1 . 2]" 1
1419 1 41 LEU QD 1 45 LYS HA 4.660 . 4.660 4.365 4.176 4.591 . 0 0 "[ . 1 . 2]" 1
1420 1 41 LEU QD 1 45 LYS HB2 3.540 . 3.540 2.263 2.171 2.492 . 0 0 "[ . 1 . 2]" 1
1421 1 41 LEU QD 1 45 LYS HB3 3.910 . 3.910 2.535 2.308 2.754 . 0 0 "[ . 1 . 2]" 1
1422 1 41 LEU QD 1 45 LYS QD 3.570 . 3.570 1.942 1.851 2.046 . 0 0 "[ . 1 . 2]" 1
1423 1 41 LEU QD 1 45 LYS QE 4.030 . 4.030 2.700 2.465 2.893 . 0 0 "[ . 1 . 2]" 1
1424 1 41 LEU QD 1 45 LYS HG2 4.430 . 4.430 4.034 3.953 4.225 . 0 0 "[ . 1 . 2]" 1
1425 1 41 LEU QD 1 46 LEU H 4.230 . 4.230 3.718 3.575 3.851 . 0 0 "[ . 1 . 2]" 1
1426 1 41 LEU QD 1 46 LEU HA 5.000 . 5.000 3.849 3.681 4.070 . 0 0 "[ . 1 . 2]" 1
1427 1 41 LEU QD 1 46 LEU QD 3.330 . 3.330 2.246 2.054 2.503 . 0 0 "[ . 1 . 2]" 1
1428 1 41 LEU QD 1 49 LEU HB2 5.440 . 5.440 5.188 4.883 5.434 . 0 0 "[ . 1 . 2]" 1
1429 1 41 LEU QD 1 49 LEU QD 3.190 . 3.190 2.882 2.513 2.994 . 0 0 "[ . 1 . 2]" 1
1430 1 41 LEU QD 1 60 VAL MG2 4.130 . 4.130 2.632 2.345 2.860 . 0 0 "[ . 1 . 2]" 1
1431 1 41 LEU QD 1 64 LEU H 5.440 . 5.440 4.925 4.745 5.170 . 0 0 "[ . 1 . 2]" 1
1432 1 41 LEU QD 1 64 LEU HA 4.760 . 4.760 4.256 3.981 4.507 . 0 0 "[ . 1 . 2]" 1
1433 1 41 LEU QD 1 67 MET QG 5.280 . 5.280 4.581 4.261 4.905 . 0 0 "[ . 1 . 2]" 1
1434 1 41 LEU HG 1 42 ASP H 4.680 . 4.680 4.603 4.485 4.724 0.044 1 0 "[ . 1 . 2]" 1
1435 1 42 ASP H 1 42 ASP QB 3.280 . 3.280 2.833 2.550 3.259 . 0 0 "[ . 1 . 2]" 1
1436 1 42 ASP H 1 44 ASN H 5.350 . 5.350 4.629 4.452 4.789 . 0 0 "[ . 1 . 2]" 1
1437 1 42 ASP H 1 44 ASN HB2 5.500 . 5.500 5.115 4.754 5.527 0.027 13 0 "[ . 1 . 2]" 1
1438 1 42 ASP H 1 45 LYS H 3.550 . 3.550 3.195 3.041 3.380 . 0 0 "[ . 1 . 2]" 1
1439 1 42 ASP H 1 45 LYS HB2 2.960 . 2.960 2.378 2.210 2.501 . 0 0 "[ . 1 . 2]" 1
1440 1 42 ASP H 1 45 LYS HB3 4.110 . 4.110 3.953 3.809 4.057 . 0 0 "[ . 1 . 2]" 1
1441 1 42 ASP H 1 45 LYS QD 4.650 . 4.650 3.191 2.927 3.466 . 0 0 "[ . 1 . 2]" 1
1442 1 42 ASP H 1 45 LYS QE 5.500 . 5.500 4.759 4.566 4.962 . 0 0 "[ . 1 . 2]" 1
1443 1 42 ASP H 1 45 LYS HG2 4.720 . 4.720 3.972 3.674 4.257 . 0 0 "[ . 1 . 2]" 1
1444 1 42 ASP H 1 45 LYS HG3 3.880 . 3.880 2.305 1.947 2.663 . 0 0 "[ . 1 . 2]" 1
1445 1 42 ASP H 1 46 LEU H 3.790 . 3.790 3.588 3.405 3.795 0.005 12 0 "[ . 1 . 2]" 1
1446 1 42 ASP H 1 46 LEU QD 4.060 . 4.060 3.820 3.483 4.102 0.042 12 0 "[ . 1 . 2]" 1
1447 1 42 ASP HA 1 44 ASN H 4.770 . 4.770 4.445 4.208 4.686 . 0 0 "[ . 1 . 2]" 1
1448 1 42 ASP HA 1 45 LYS H 5.150 . 5.150 4.784 4.557 4.984 . 0 0 "[ . 1 . 2]" 1
1449 1 42 ASP HA 1 64 LEU QD 5.440 . 5.440 3.155 2.700 3.655 . 0 0 "[ . 1 . 2]" 1
1450 1 43 GLY H 1 57 ARG HD2 5.500 . 5.500 5.430 5.111 5.560 0.060 15 0 "[ . 1 . 2]" 1
1451 1 43 GLY HA2 1 45 LYS H 4.700 . 4.700 4.395 4.199 4.496 . 0 0 "[ . 1 . 2]" 1
1452 1 43 GLY HA2 1 46 LEU H 4.220 . 4.220 3.235 2.988 3.352 . 0 0 "[ . 1 . 2]" 1
1453 1 43 GLY HA2 1 46 LEU HB2 4.090 . 4.090 2.335 2.099 2.561 . 0 0 "[ . 1 . 2]" 1
1454 1 43 GLY HA2 1 46 LEU HB3 5.360 . 5.360 3.899 3.669 4.152 . 0 0 "[ . 1 . 2]" 1
1455 1 43 GLY HA2 1 46 LEU QD 3.770 . 3.770 2.138 1.952 2.402 . 0 0 "[ . 1 . 2]" 1
1456 1 43 GLY HA2 1 46 LEU HG 5.230 . 5.230 3.005 2.630 3.339 . 0 0 "[ . 1 . 2]" 1
1457 1 43 GLY HA2 1 47 LYS H 5.200 . 5.200 3.966 3.633 4.223 . 0 0 "[ . 1 . 2]" 1
1458 1 43 GLY HA2 1 47 LYS QD 5.500 . 5.500 4.134 4.004 4.259 . 0 0 "[ . 1 . 2]" 1
1459 1 43 GLY HA2 1 57 ARG HA 5.360 . 5.360 4.874 4.395 5.409 0.049 5 0 "[ . 1 . 2]" 1
1460 1 43 GLY HA2 1 57 ARG HD2 4.550 . 4.550 2.974 2.481 3.291 . 0 0 "[ . 1 . 2]" 1
1461 1 43 GLY HA2 1 57 ARG HD3 3.750 . 3.750 3.599 3.286 3.809 0.059 16 0 "[ . 1 . 2]" 1
1462 1 43 GLY HA2 1 57 ARG QG 5.340 . 5.340 4.763 4.145 5.072 . 0 0 "[ . 1 . 2]" 1
1463 1 43 GLY HA2 1 60 VAL MG1 5.500 . 5.500 5.205 4.949 5.533 0.033 1 0 "[ . 1 . 2]" 1
1464 1 43 GLY HA2 1 61 LYS QD 5.500 . 5.500 4.699 3.585 5.590 0.090 17 0 "[ . 1 . 2]" 1
1465 1 43 GLY HA3 1 45 LYS H 4.880 . 4.880 4.816 4.707 4.891 0.011 18 0 "[ . 1 . 2]" 1
1466 1 43 GLY HA3 1 46 LEU HB2 5.020 . 5.020 3.868 3.610 4.088 . 0 0 "[ . 1 . 2]" 1
1467 1 43 GLY HA3 1 46 LEU QD 4.660 . 4.660 3.547 3.272 3.867 . 0 0 "[ . 1 . 2]" 1
1468 1 43 GLY HA3 1 46 LEU HG 5.500 . 5.500 4.669 4.263 4.938 . 0 0 "[ . 1 . 2]" 1
1469 1 43 GLY HA3 1 47 LYS QD 3.420 . 3.420 3.502 3.422 3.540 0.120 9 0 "[ . 1 . 2]" 1
1470 1 43 GLY HA3 1 57 ARG HD2 5.010 . 5.010 4.028 3.515 4.331 . 0 0 "[ . 1 . 2]" 1
1471 1 44 ASN H 1 44 ASN HB2 3.570 . 3.570 2.317 2.216 2.432 . 0 0 "[ . 1 . 2]" 1
1472 1 44 ASN H 1 44 ASN HB3 3.510 . 3.510 3.443 2.762 3.568 0.058 18 0 "[ . 1 . 2]" 1
1473 1 44 ASN H 1 45 LYS H 3.090 . 3.090 2.793 2.597 2.929 . 0 0 "[ . 1 . 2]" 1
1474 1 44 ASN H 1 47 LYS QD 3.900 . 3.900 3.833 3.586 3.950 0.050 6 0 "[ . 1 . 2]" 1
1475 1 44 ASN HA 1 44 ASN HB2 2.940 . 2.940 2.926 2.638 2.990 0.050 10 0 "[ . 1 . 2]" 1
1476 1 44 ASN HA 1 44 ASN HB3 2.960 . 2.960 2.618 2.504 2.973 0.013 13 0 "[ . 1 . 2]" 1
1477 1 44 ASN HA 1 45 LYS HG2 5.370 . 5.370 5.421 5.267 5.483 0.113 9 0 "[ . 1 . 2]" 1
1478 1 44 ASN HA 1 47 LYS H 3.910 . 3.910 3.634 3.210 3.931 0.021 4 0 "[ . 1 . 2]" 1
1479 1 44 ASN HA 1 47 LYS QB 3.460 . 3.460 2.809 2.274 3.117 . 0 0 "[ . 1 . 2]" 1
1480 1 44 ASN HA 1 47 LYS QD 3.790 . 3.790 2.330 1.908 2.614 . 0 0 "[ . 1 . 2]" 1
1481 1 44 ASN HA 1 47 LYS QE 4.860 . 4.860 3.830 2.928 4.499 . 0 0 "[ . 1 . 2]" 1
1482 1 44 ASN HA 1 47 LYS HG2 5.500 . 5.500 4.961 4.470 5.307 . 0 0 "[ . 1 . 2]" 1
1483 1 44 ASN HA 1 48 ALA H 5.040 . 5.040 4.307 3.848 4.617 . 0 0 "[ . 1 . 2]" 1
1484 1 44 ASN HB2 1 44 ASN QD 3.390 . 3.390 2.488 2.144 3.314 . 0 0 "[ . 1 . 2]" 1
1485 1 44 ASN HB2 1 45 LYS H 3.430 . 3.430 2.679 2.325 3.427 . 0 0 "[ . 1 . 2]" 1
1486 1 44 ASN HB2 1 45 LYS HG2 4.410 . 4.410 3.900 3.366 4.551 0.141 14 0 "[ . 1 . 2]" 1
1487 1 44 ASN HB3 1 45 LYS H 3.260 . 3.260 3.125 2.111 3.337 0.077 12 0 "[ . 1 . 2]" 1
1488 1 44 ASN HB3 1 45 LYS HA 4.240 . 4.240 4.085 3.717 4.208 . 0 0 "[ . 1 . 2]" 1
1489 1 44 ASN HB3 1 45 LYS HG2 5.250 . 5.250 3.859 2.838 4.163 . 0 0 "[ . 1 . 2]" 1
1490 1 44 ASN HB3 1 47 LYS H 5.500 . 5.500 5.350 5.019 5.543 0.043 11 0 "[ . 1 . 2]" 1
1491 1 44 ASN QD 1 47 LYS QD 5.140 . 5.140 4.787 3.408 5.249 0.109 14 0 "[ . 1 . 2]" 1
1492 1 45 LYS H 1 45 LYS HA 2.890 . 2.890 2.811 2.793 2.828 . 0 0 "[ . 1 . 2]" 1
1493 1 45 LYS H 1 45 LYS HB2 3.010 . 3.010 2.668 2.600 2.732 . 0 0 "[ . 1 . 2]" 1
1494 1 45 LYS H 1 45 LYS HB3 3.670 . 3.670 3.608 3.570 3.644 . 0 0 "[ . 1 . 2]" 1
1495 1 45 LYS H 1 45 LYS QD 4.200 . 4.200 4.071 4.012 4.145 . 0 0 "[ . 1 . 2]" 1
1496 1 45 LYS H 1 45 LYS HG2 2.580 . 2.580 2.631 2.594 2.685 0.105 2 0 "[ . 1 . 2]" 1
1497 1 45 LYS H 1 45 LYS HG3 3.450 . 3.450 2.352 2.260 2.489 . 0 0 "[ . 1 . 2]" 1
1498 1 45 LYS H 1 46 LEU H 2.870 . 2.870 2.654 2.527 2.751 . 0 0 "[ . 1 . 2]" 1
1499 1 45 LYS H 1 46 LEU HB2 5.500 . 5.500 4.792 4.652 4.897 . 0 0 "[ . 1 . 2]" 1
1500 1 45 LYS H 1 48 ALA H 4.990 . 4.990 4.596 4.509 4.732 . 0 0 "[ . 1 . 2]" 1
1501 1 45 LYS HA 1 45 LYS QE 4.910 . 4.910 3.610 3.462 3.701 . 0 0 "[ . 1 . 2]" 1
1502 1 45 LYS HA 1 45 LYS HG2 3.010 . 3.010 2.512 2.415 2.611 . 0 0 "[ . 1 . 2]" 1
1503 1 45 LYS HA 1 45 LYS HG3 3.820 . 3.820 3.529 3.452 3.611 . 0 0 "[ . 1 . 2]" 1
1504 1 45 LYS HA 1 47 LYS H 5.500 . 5.500 4.090 3.905 4.267 . 0 0 "[ . 1 . 2]" 1
1505 1 45 LYS HA 1 48 ALA H 3.460 . 3.460 3.124 2.989 3.283 . 0 0 "[ . 1 . 2]" 1
1506 1 45 LYS HA 1 48 ALA MB 2.820 . 2.820 2.388 2.274 2.522 . 0 0 "[ . 1 . 2]" 1
1507 1 45 LYS HB2 1 45 LYS QE 4.340 . 4.340 3.315 3.195 3.430 . 0 0 "[ . 1 . 2]" 1
1508 1 45 LYS HB2 1 46 LEU H 4.050 . 4.050 2.551 2.427 2.665 . 0 0 "[ . 1 . 2]" 1
1509 1 45 LYS HB2 1 49 LEU QD 3.870 . 3.870 3.591 3.312 3.874 0.004 1 0 "[ . 1 . 2]" 1
1510 1 45 LYS HB3 1 45 LYS QE 3.170 . 3.170 1.916 1.836 1.993 . 0 0 "[ . 1 . 2]" 1
1511 1 45 LYS HB3 1 46 LEU H 3.860 . 3.860 3.724 3.617 3.819 . 0 0 "[ . 1 . 2]" 1
1512 1 45 LYS HB3 1 49 LEU QD 3.380 . 3.380 2.958 2.633 3.425 0.045 15 0 "[ . 1 . 2]" 1
1513 1 45 LYS QD 1 45 LYS HG3 2.720 . 2.720 2.150 2.123 2.172 . 0 0 "[ . 1 . 2]" 1
1514 1 45 LYS QE 1 45 LYS HG2 3.080 . 3.080 3.090 3.004 3.136 0.056 14 0 "[ . 1 . 2]" 1
1515 1 45 LYS QE 1 45 LYS HG3 3.560 . 3.560 3.521 3.494 3.537 . 0 0 "[ . 1 . 2]" 1
1516 1 45 LYS QE 1 49 LEU QD 4.620 . 4.620 3.478 3.146 4.031 . 0 0 "[ . 1 . 2]" 1
1517 1 45 LYS HG2 1 49 LEU QD 5.440 . 5.440 4.942 4.684 5.434 . 0 0 "[ . 1 . 2]" 1
1518 1 46 LEU H 1 46 LEU HB2 2.890 . 2.890 2.497 2.436 2.598 . 0 0 "[ . 1 . 2]" 1
1519 1 46 LEU H 1 46 LEU HB3 3.590 . 3.590 3.585 3.551 3.601 0.011 2 0 "[ . 1 . 2]" 1
1520 1 46 LEU H 1 46 LEU MD1 3.780 . 3.780 3.555 3.437 3.606 . 0 0 "[ . 1 . 2]" 1
1521 1 46 LEU H 1 46 LEU QD 3.170 . 3.170 2.971 2.884 3.028 . 0 0 "[ . 1 . 2]" 1
1522 1 46 LEU H 1 46 LEU MD2 3.780 . 3.780 3.189 3.038 3.346 . 0 0 "[ . 1 . 2]" 1
1523 1 46 LEU H 1 46 LEU HG 4.210 . 4.210 2.138 2.058 2.219 . 0 0 "[ . 1 . 2]" 1
1524 1 46 LEU H 1 47 LYS H 2.910 . 2.910 2.640 2.555 2.745 . 0 0 "[ . 1 . 2]" 1
1525 1 46 LEU H 1 47 LYS HA 5.500 . 5.500 5.247 5.182 5.336 . 0 0 "[ . 1 . 2]" 1
1526 1 46 LEU H 1 48 ALA H 4.210 . 4.210 4.015 3.909 4.173 . 0 0 "[ . 1 . 2]" 1
1527 1 46 LEU H 1 48 ALA MB 5.500 . 5.500 4.803 4.668 4.919 . 0 0 "[ . 1 . 2]" 1
1528 1 46 LEU H 1 49 LEU H 5.500 . 5.500 4.841 4.703 5.047 . 0 0 "[ . 1 . 2]" 1
1529 1 46 LEU H 1 49 LEU QD 5.440 . 5.440 3.796 3.655 3.937 . 0 0 "[ . 1 . 2]" 1
1530 1 46 LEU H 1 57 ARG HD2 5.360 . 5.360 5.026 4.547 5.374 0.014 4 0 "[ . 1 . 2]" 1
1531 1 46 LEU HA 1 46 LEU MD1 4.110 . 4.110 3.873 3.855 3.897 . 0 0 "[ . 1 . 2]" 1
1532 1 46 LEU HA 1 46 LEU QD 2.770 . 2.770 2.074 2.043 2.108 . 0 0 "[ . 1 . 2]" 1
1533 1 46 LEU HA 1 46 LEU MD2 4.110 . 4.110 2.082 2.050 2.117 . 0 0 "[ . 1 . 2]" 1
1534 1 46 LEU HA 1 46 LEU HG 3.500 . 3.500 3.131 3.033 3.196 . 0 0 "[ . 1 . 2]" 1
1535 1 46 LEU HA 1 49 LEU H 3.900 . 3.900 3.508 3.386 3.665 . 0 0 "[ . 1 . 2]" 1
1536 1 46 LEU HA 1 49 LEU HB2 4.030 . 4.030 2.712 2.420 3.027 . 0 0 "[ . 1 . 2]" 1
1537 1 46 LEU HA 1 49 LEU HB3 4.680 . 4.680 4.232 3.869 4.644 . 0 0 "[ . 1 . 2]" 1
1538 1 46 LEU HA 1 49 LEU QD 3.230 . 3.230 2.401 1.816 2.912 . 0 0 "[ . 1 . 2]" 1
1539 1 46 LEU HA 1 52 THR H 4.970 . 4.970 4.857 4.594 5.018 0.048 1 0 "[ . 1 . 2]" 1
1540 1 46 LEU HA 1 57 ARG HD2 5.500 . 5.500 5.273 4.945 5.544 0.044 4 0 "[ . 1 . 2]" 1
1541 1 46 LEU HB2 1 46 LEU QD 2.810 . 2.810 2.297 2.267 2.338 . 0 0 "[ . 1 . 2]" 1
1542 1 46 LEU HB2 1 47 LYS H 3.890 . 3.890 2.739 2.555 2.899 . 0 0 "[ . 1 . 2]" 1
1543 1 46 LEU HB2 1 47 LYS HA 5.500 . 5.500 4.334 4.225 4.438 . 0 0 "[ . 1 . 2]" 1
1544 1 46 LEU HB2 1 48 ALA H 5.230 . 5.230 4.978 4.865 5.175 . 0 0 "[ . 1 . 2]" 1
1545 1 46 LEU HB2 1 52 THR HA 5.500 . 5.500 4.655 4.344 4.803 . 0 0 "[ . 1 . 2]" 1
1546 1 46 LEU HB2 1 57 ARG HD2 3.950 . 3.950 2.688 2.216 3.152 . 0 0 "[ . 1 . 2]" 1
1547 1 46 LEU HB2 1 57 ARG HD3 3.950 . 3.950 2.620 2.335 3.043 . 0 0 "[ . 1 . 2]" 1
1548 1 46 LEU HB3 1 46 LEU MD1 3.630 . 3.630 2.409 2.382 2.466 . 0 0 "[ . 1 . 2]" 1
1549 1 46 LEU HB3 1 46 LEU QD 3.000 . 3.000 2.145 2.114 2.176 . 0 0 "[ . 1 . 2]" 1
1550 1 46 LEU HB3 1 46 LEU MD2 3.630 . 3.630 2.407 2.348 2.455 . 0 0 "[ . 1 . 2]" 1
1551 1 46 LEU HB3 1 47 LYS H 4.400 . 4.400 3.764 3.612 3.880 . 0 0 "[ . 1 . 2]" 1
1552 1 46 LEU HB3 1 47 LYS HA 4.730 . 4.730 4.502 4.350 4.630 . 0 0 "[ . 1 . 2]" 1
1553 1 46 LEU HB3 1 52 THR H 5.350 . 5.350 4.347 4.064 4.618 . 0 0 "[ . 1 . 2]" 1
1554 1 46 LEU HB3 1 52 THR HA 4.100 . 4.100 4.153 4.037 4.194 0.094 20 0 "[ . 1 . 2]" 1
1555 1 46 LEU HB3 1 57 ARG HD2 4.380 . 4.380 2.988 2.704 3.270 . 0 0 "[ . 1 . 2]" 1
1556 1 46 LEU HB3 1 57 ARG HD3 4.240 . 4.240 2.846 2.230 3.148 . 0 0 "[ . 1 . 2]" 1
1557 1 46 LEU QD 1 47 LYS H 4.660 . 4.660 4.120 4.046 4.190 . 0 0 "[ . 1 . 2]" 1
1558 1 46 LEU QD 1 49 LEU H 5.310 . 5.310 4.899 4.780 5.042 . 0 0 "[ . 1 . 2]" 1
1559 1 46 LEU QD 1 49 LEU QD 3.320 . 3.320 2.986 2.148 3.329 0.009 4 0 "[ . 1 . 2]" 1
1560 1 46 LEU QD 1 57 ARG H 4.300 . 4.300 4.120 3.721 4.317 0.017 18 0 "[ . 1 . 2]" 1
1561 1 46 LEU QD 1 57 ARG HA 3.330 . 3.330 2.227 2.058 2.452 . 0 0 "[ . 1 . 2]" 1
1562 1 46 LEU QD 1 57 ARG HB2 4.660 . 4.660 4.391 3.786 4.645 . 0 0 "[ . 1 . 2]" 1
1563 1 46 LEU QD 1 57 ARG HD2 4.130 . 4.130 2.102 1.859 2.569 . 0 0 "[ . 1 . 2]" 1
1564 1 46 LEU QD 1 57 ARG QG 4.240 . 4.240 3.114 2.024 3.463 . 0 0 "[ . 1 . 2]" 1
1565 1 46 LEU QD 1 61 LYS H 4.230 . 4.230 3.866 3.630 4.076 . 0 0 "[ . 1 . 2]" 1
1566 1 46 LEU QD 1 61 LYS HA 4.070 . 4.070 3.532 3.321 3.909 . 0 0 "[ . 1 . 2]" 1
1567 1 46 LEU QD 1 61 LYS QB 4.740 . 4.740 3.324 2.903 3.910 . 0 0 "[ . 1 . 2]" 1
1568 1 46 LEU QD 1 61 LYS QE 4.490 . 4.490 3.936 2.744 4.571 0.081 4 0 "[ . 1 . 2]" 1
1569 1 46 LEU MD1 1 47 LYS H 5.500 . 5.500 4.621 4.477 4.767 . 0 0 "[ . 1 . 2]" 1
1570 1 46 LEU MD1 1 57 ARG HD3 4.810 . 4.810 3.212 2.895 3.502 . 0 0 "[ . 1 . 2]" 1
1571 1 46 LEU MD2 1 47 LYS H 5.500 . 5.500 4.631 4.584 4.735 . 0 0 "[ . 1 . 2]" 1
1572 1 46 LEU MD2 1 57 ARG HD3 4.810 . 4.810 4.661 4.176 4.850 0.040 10 0 "[ . 1 . 2]" 1
1573 1 46 LEU HG 1 57 ARG HD3 5.250 . 5.250 4.831 4.574 5.090 . 0 0 "[ . 1 . 2]" 1
1574 1 47 LYS H 1 47 LYS QB 2.630 . 2.630 2.374 2.288 2.489 . 0 0 "[ . 1 . 2]" 1
1575 1 47 LYS H 1 47 LYS HG2 4.000 . 4.000 3.781 3.473 3.939 . 0 0 "[ . 1 . 2]" 1
1576 1 47 LYS H 1 47 LYS HG3 2.730 . 2.730 2.424 2.096 2.578 . 0 0 "[ . 1 . 2]" 1
1577 1 47 LYS H 1 48 ALA H 2.700 . 2.700 2.434 2.329 2.600 . 0 0 "[ . 1 . 2]" 1
1578 1 47 LYS H 1 57 ARG HD2 5.500 . 5.500 5.032 4.475 5.468 . 0 0 "[ . 1 . 2]" 1
1579 1 47 LYS H 1 57 ARG HD3 4.530 . 4.530 4.178 3.808 4.583 0.053 4 0 "[ . 1 . 2]" 1
1580 1 47 LYS HA 1 47 LYS QD 4.990 . 4.990 4.186 4.062 4.233 . 0 0 "[ . 1 . 2]" 1
1581 1 47 LYS HA 1 47 LYS QE 5.500 . 5.500 4.398 4.068 4.946 . 0 0 "[ . 1 . 2]" 1
1582 1 47 LYS HA 1 47 LYS HG2 3.800 . 3.800 2.730 2.645 2.880 . 0 0 "[ . 1 . 2]" 1
1583 1 47 LYS HA 1 47 LYS HG3 3.800 . 3.800 2.788 2.673 2.919 . 0 0 "[ . 1 . 2]" 1
1584 1 47 LYS HA 1 48 ALA H 3.530 . 3.530 3.506 3.468 3.537 0.007 8 0 "[ . 1 . 2]" 1
1585 1 47 LYS HA 1 49 LEU H 3.900 . 3.900 3.792 3.600 3.912 0.012 7 0 "[ . 1 . 2]" 1
1586 1 47 LYS HA 1 50 GLY H 5.500 . 5.500 3.813 3.636 4.048 . 0 0 "[ . 1 . 2]" 1
1587 1 47 LYS HA 1 52 THR H 5.500 . 5.500 3.229 2.854 3.574 . 0 0 "[ . 1 . 2]" 1
1588 1 47 LYS HA 1 52 THR HA 4.080 . 4.080 2.850 2.581 3.189 . 0 0 "[ . 1 . 2]" 1
1589 1 47 LYS HA 1 52 THR MG 3.420 . 3.420 1.795 1.769 1.818 0.031 20 0 "[ . 1 . 2]" 1
1590 1 47 LYS HA 1 53 SER H 5.500 . 5.500 5.500 5.288 5.626 0.126 19 0 "[ . 1 . 2]" 1
1591 1 47 LYS QB 1 47 LYS QD 2.800 . 2.800 2.287 2.107 2.402 . 0 0 "[ . 1 . 2]" 1
1592 1 47 LYS QB 1 48 ALA H 3.280 . 3.280 2.709 2.576 2.922 . 0 0 "[ . 1 . 2]" 1
1593 1 47 LYS QB 1 48 ALA HA 4.900 . 4.900 3.989 3.923 4.087 . 0 0 "[ . 1 . 2]" 1
1594 1 47 LYS QB 1 50 GLY H 5.500 . 5.500 4.698 4.569 4.819 . 0 0 "[ . 1 . 2]" 1
1595 1 47 LYS QB 1 52 THR HA 5.500 . 5.500 4.521 4.189 4.722 . 0 0 "[ . 1 . 2]" 1
1596 1 47 LYS QB 1 52 THR HB 4.520 . 4.520 4.455 4.121 4.574 0.054 16 0 "[ . 1 . 2]" 1
1597 1 47 LYS QE 1 47 LYS HG2 3.710 . 3.710 2.556 2.335 3.024 . 0 0 "[ . 1 . 2]" 1
1598 1 47 LYS HG2 1 57 ARG HD3 4.890 . 4.890 3.861 3.399 4.636 . 0 0 "[ . 1 . 2]" 1
1599 1 47 LYS HG3 1 52 THR HA 5.500 . 5.500 3.875 3.291 4.365 . 0 0 "[ . 1 . 2]" 1
1600 1 47 LYS HG3 1 57 ARG HD3 4.740 . 4.740 3.014 2.638 3.593 . 0 0 "[ . 1 . 2]" 1
1601 1 48 ALA H 1 48 ALA MB 2.400 . 2.400 2.257 2.239 2.281 . 0 0 "[ . 1 . 2]" 1
1602 1 48 ALA H 1 49 LEU H 2.580 . 2.580 2.491 2.385 2.585 0.005 14 0 "[ . 1 . 2]" 1
1603 1 48 ALA H 1 49 LEU QD 4.910 . 4.910 3.812 3.555 4.416 . 0 0 "[ . 1 . 2]" 1
1604 1 48 ALA H 1 52 THR MG 4.600 . 4.600 4.549 4.499 4.615 0.015 10 0 "[ . 1 . 2]" 1
1605 1 48 ALA HA 1 49 LEU QD 5.440 . 5.440 4.663 4.530 5.163 . 0 0 "[ . 1 . 2]" 1
1606 1 48 ALA HA 1 52 THR MG 4.780 . 4.780 4.794 4.676 4.861 0.081 7 0 "[ . 1 . 2]" 1
1607 1 48 ALA MB 1 49 LEU H 3.630 . 3.630 3.083 2.955 3.305 . 0 0 "[ . 1 . 2]" 1
1608 1 48 ALA MB 1 49 LEU QD 5.240 . 5.240 3.131 3.002 3.849 . 0 0 "[ . 1 . 2]" 1
1609 1 48 ALA MB 1 50 GLY H 4.550 . 4.550 4.183 4.091 4.321 . 0 0 "[ . 1 . 2]" 1
1610 1 49 LEU H 1 49 LEU HB2 2.570 . 2.570 2.203 2.091 2.337 . 0 0 "[ . 1 . 2]" 1
1611 1 49 LEU H 1 49 LEU HB3 3.640 . 3.640 3.486 3.400 3.589 . 0 0 "[ . 1 . 2]" 1
1612 1 49 LEU H 1 49 LEU MD1 4.630 . 4.630 3.984 3.690 4.111 . 0 0 "[ . 1 . 2]" 1
1613 1 49 LEU H 1 49 LEU QD 3.550 . 3.550 2.648 2.482 3.369 . 0 0 "[ . 1 . 2]" 1
1614 1 49 LEU H 1 49 LEU MD2 4.630 . 4.630 2.707 2.509 3.892 . 0 0 "[ . 1 . 2]" 1
1615 1 49 LEU H 1 49 LEU HG 4.590 . 4.590 4.146 2.851 4.359 . 0 0 "[ . 1 . 2]" 1
1616 1 49 LEU H 1 50 GLY H 2.760 . 2.760 2.443 2.197 2.660 . 0 0 "[ . 1 . 2]" 1
1617 1 49 LEU H 1 50 GLY HA2 4.920 . 4.920 4.706 4.481 4.923 0.003 8 0 "[ . 1 . 2]" 1
1618 1 49 LEU H 1 50 GLY HA3 5.320 . 5.320 5.089 4.881 5.275 . 0 0 "[ . 1 . 2]" 1
1619 1 49 LEU H 1 51 MET H 3.790 . 3.790 3.836 3.718 3.862 0.072 18 0 "[ . 1 . 2]" 1
1620 1 49 LEU H 1 52 THR H 5.500 . 5.500 4.709 4.425 4.989 . 0 0 "[ . 1 . 2]" 1
1621 1 49 LEU H 1 52 THR MG 4.730 . 4.730 4.404 3.978 4.642 . 0 0 "[ . 1 . 2]" 1
1622 1 49 LEU HA 1 49 LEU MD1 4.030 . 4.030 2.184 2.031 3.838 . 0 0 "[ . 1 . 2]" 1
1623 1 49 LEU HA 1 49 LEU QD 2.870 . 2.870 2.018 1.980 2.062 . 0 0 "[ . 1 . 2]" 1
1624 1 49 LEU HA 1 49 LEU MD2 4.030 . 4.030 2.614 2.071 3.108 . 0 0 "[ . 1 . 2]" 1
1625 1 49 LEU HA 1 49 LEU HG 3.750 . 3.750 3.712 2.838 3.778 0.028 19 0 "[ . 1 . 2]" 1
1626 1 49 LEU HA 1 50 GLY H 3.500 . 3.500 3.290 3.223 3.344 . 0 0 "[ . 1 . 2]" 1
1627 1 49 LEU HA 1 51 MET H 5.500 . 5.500 4.289 4.143 4.527 . 0 0 "[ . 1 . 2]" 1
1628 1 49 LEU HB2 1 50 GLY H 4.110 . 4.110 3.550 3.448 3.726 . 0 0 "[ . 1 . 2]" 1
1629 1 49 LEU HB3 1 49 LEU MD1 3.270 . 3.270 2.439 2.351 2.615 . 0 0 "[ . 1 . 2]" 1
1630 1 49 LEU HB3 1 49 LEU QD 2.760 . 2.760 2.356 2.163 2.502 . 0 0 "[ . 1 . 2]" 1
1631 1 49 LEU HB3 1 49 LEU MD2 3.270 . 3.270 3.186 2.344 3.240 . 0 0 "[ . 1 . 2]" 1
1632 1 49 LEU HB3 1 50 GLY H 5.500 . 5.500 3.988 3.891 4.155 . 0 0 "[ . 1 . 2]" 1
1633 1 49 LEU HB3 1 50 GLY HA3 5.080 . 5.080 4.980 4.924 5.083 0.003 15 0 "[ . 1 . 2]" 1
1634 1 49 LEU HB3 1 51 MET H 3.800 . 3.800 3.139 2.977 3.407 . 0 0 "[ . 1 . 2]" 1
1635 1 49 LEU HB3 1 52 THR MG 5.500 . 5.500 5.541 5.509 5.572 0.072 20 0 "[ . 1 . 2]" 1
1636 1 49 LEU QD 1 51 MET HB2 5.440 . 5.440 4.618 4.275 4.949 . 0 0 "[ . 1 . 2]" 1
1637 1 49 LEU MD1 1 50 GLY H 5.340 . 5.340 4.864 4.758 5.115 . 0 0 "[ . 1 . 2]" 1
1638 1 49 LEU MD1 1 51 MET H 5.160 . 5.160 4.932 4.810 5.174 0.014 6 0 "[ . 1 . 2]" 1
1639 1 49 LEU MD2 1 50 GLY H 5.340 . 5.340 4.473 4.379 4.814 . 0 0 "[ . 1 . 2]" 1
1640 1 49 LEU MD2 1 51 MET H 5.160 . 5.160 5.063 4.884 5.192 0.032 7 0 "[ . 1 . 2]" 1
1641 1 50 GLY H 1 50 GLY HA2 2.500 . 2.500 2.283 2.266 2.298 . 0 0 "[ . 1 . 2]" 1
1642 1 50 GLY H 1 51 MET H 2.780 . 2.780 2.683 2.447 2.818 0.038 15 0 "[ . 1 . 2]" 1
1643 1 50 GLY H 1 51 MET HA 5.500 . 5.500 5.280 5.155 5.371 . 0 0 "[ . 1 . 2]" 1
1644 1 50 GLY H 1 52 THR H 5.060 . 5.060 4.240 3.984 4.590 . 0 0 "[ . 1 . 2]" 1
1645 1 50 GLY H 1 52 THR MG 4.000 . 4.000 3.378 3.141 3.769 . 0 0 "[ . 1 . 2]" 1
1646 1 50 GLY HA2 1 51 MET H 3.320 . 3.320 3.189 2.977 3.341 0.021 15 0 "[ . 1 . 2]" 1
1647 1 50 GLY HA2 1 51 MET HA 4.820 . 4.820 4.590 4.463 4.671 . 0 0 "[ . 1 . 2]" 1
1648 1 50 GLY HA2 1 52 THR H 5.500 . 5.500 4.700 4.351 5.057 . 0 0 "[ . 1 . 2]" 1
1649 1 50 GLY HA3 1 51 MET H 3.460 . 3.460 3.243 2.958 3.394 . 0 0 "[ . 1 . 2]" 1
1650 1 51 MET H 1 51 MET HB2 2.720 . 2.720 2.505 2.275 2.729 0.009 12 0 "[ . 1 . 2]" 1
1651 1 51 MET H 1 51 MET HB3 3.540 . 3.540 2.948 2.586 3.596 0.056 6 0 "[ . 1 . 2]" 1
1652 1 51 MET H 1 52 THR HA 5.020 . 5.020 4.544 4.383 4.796 . 0 0 "[ . 1 . 2]" 1
1653 1 51 MET H 1 52 THR MG 3.300 . 3.300 3.090 2.712 3.312 0.012 13 0 "[ . 1 . 2]" 1
1654 1 51 MET H 1 53 SER H 5.500 . 5.500 4.851 4.754 4.993 . 0 0 "[ . 1 . 2]" 1
1655 1 51 MET HA 1 52 THR MG 4.230 . 4.230 4.088 3.678 4.270 0.040 20 0 "[ . 1 . 2]" 1
1656 1 51 MET HA 1 53 SER H 4.350 . 4.350 4.250 3.774 4.459 0.109 20 0 "[ . 1 . 2]" 1
1657 1 51 MET HB3 1 52 THR H 3.440 . 3.440 2.517 2.220 3.142 . 0 0 "[ . 1 . 2]" 1
1658 1 51 MET HB3 1 52 THR HA 5.500 . 5.500 4.370 4.118 4.831 . 0 0 "[ . 1 . 2]" 1
1659 1 51 MET HB3 1 52 THR MG 4.360 . 4.360 4.420 4.309 4.552 0.192 10 0 "[ . 1 . 2]" 1
1660 1 51 MET HB3 1 53 SER H 3.110 . 3.110 2.929 2.580 3.140 0.030 20 0 "[ . 1 . 2]" 1
1661 1 51 MET HB3 1 53 SER QB 4.160 . 4.160 3.763 2.780 4.182 0.022 16 0 "[ . 1 . 2]" 1
1662 1 51 MET HB3 1 56 ASP QB 5.140 . 5.140 4.812 4.444 5.144 0.004 16 0 "[ . 1 . 2]" 1
1663 1 52 THR H 1 52 THR HB 3.940 . 3.940 3.979 3.953 3.999 0.059 6 0 "[ . 1 . 2]" 1
1664 1 52 THR H 1 52 THR MG 2.730 . 2.730 2.420 2.265 2.519 . 0 0 "[ . 1 . 2]" 1
1665 1 52 THR H 1 53 SER QB 5.300 . 5.300 4.625 4.311 4.902 . 0 0 "[ . 1 . 2]" 1
1666 1 52 THR HA 1 52 THR HB 2.400 . 2.400 2.422 2.400 2.444 0.044 20 0 "[ . 1 . 2]" 1
1667 1 52 THR HA 1 52 THR MG 2.700 . 2.700 2.439 2.347 2.562 . 0 0 "[ . 1 . 2]" 1
1668 1 52 THR MG 1 53 SER H 4.280 . 4.280 4.245 4.048 4.324 0.044 11 0 "[ . 1 . 2]" 1
1669 1 53 SER H 1 53 SER HB2 3.310 . 3.310 2.484 2.266 2.729 . 0 0 "[ . 1 . 2]" 1
1670 1 53 SER H 1 53 SER QB 2.730 . 2.730 2.279 2.114 2.498 . 0 0 "[ . 1 . 2]" 1
1671 1 53 SER H 1 53 SER HB3 3.310 . 3.310 2.901 2.245 3.450 0.140 19 0 "[ . 1 . 2]" 1
1672 1 53 SER H 1 54 SER HA 5.500 . 5.500 5.478 5.327 5.564 0.064 8 0 "[ . 1 . 2]" 1
1673 1 53 SER H 1 56 ASP HB2 5.500 . 5.500 4.109 3.649 5.517 0.017 4 0 "[ . 1 . 2]" 1
1674 1 53 SER H 1 56 ASP QB 4.730 . 4.730 3.889 3.565 4.601 . 0 0 "[ . 1 . 2]" 1
1675 1 53 SER H 1 56 ASP HB3 5.500 . 5.500 5.219 4.737 5.508 0.008 8 0 "[ . 1 . 2]" 1
1676 1 53 SER H 1 57 ARG H 5.110 . 5.110 4.835 4.595 5.167 0.057 4 0 "[ . 1 . 2]" 1
1677 1 53 SER HA 1 55 GLN H 4.680 . 4.680 4.217 3.643 4.708 0.028 4 0 "[ . 1 . 2]" 1
1678 1 53 SER HA 1 56 ASP H 5.500 . 5.500 4.745 4.262 5.357 . 0 0 "[ . 1 . 2]" 1
1679 1 53 SER QB 1 55 GLN QB 4.690 . 4.690 4.106 3.404 4.799 0.109 16 0 "[ . 1 . 2]" 1
1680 1 53 SER QB 1 56 ASP H 3.030 . 3.030 2.966 2.465 3.084 0.054 1 0 "[ . 1 . 2]" 1
1681 1 53 SER QB 1 56 ASP QB 3.110 . 3.110 2.278 1.937 3.142 0.032 11 0 "[ . 1 . 2]" 1
1682 1 53 SER HB2 1 57 ARG H 5.500 . 5.500 4.660 3.685 5.550 0.050 20 0 "[ . 1 . 2]" 1
1683 1 53 SER HB3 1 57 ARG H 5.500 . 5.500 4.311 3.589 5.196 . 0 0 "[ . 1 . 2]" 1
1684 1 54 SER H 1 55 GLN H 4.430 . 4.430 2.714 1.883 3.000 . 0 0 "[ . 1 . 2]" 1
1685 1 54 SER HA 1 56 ASP H 4.650 . 4.650 4.488 4.178 4.661 0.011 12 0 "[ . 1 . 2]" 1
1686 1 54 SER HA 1 57 ARG HB2 4.070 . 4.070 2.630 1.985 3.331 . 0 0 "[ . 1 . 2]" 1
1687 1 54 SER HA 1 57 ARG HB3 5.190 . 5.190 4.168 3.513 4.878 . 0 0 "[ . 1 . 2]" 1
1688 1 55 GLN H 1 55 GLN QB 2.810 . 2.810 2.290 2.138 2.693 . 0 0 "[ . 1 . 2]" 1
1689 1 55 GLN H 1 55 GLN QE 5.340 . 5.340 4.814 3.990 5.305 . 0 0 "[ . 1 . 2]" 1
1690 1 55 GLN H 1 55 GLN QG 4.210 . 4.210 3.619 2.197 4.094 . 0 0 "[ . 1 . 2]" 1
1691 1 55 GLN H 1 56 ASP H 2.970 . 2.970 2.611 2.300 2.786 . 0 0 "[ . 1 . 2]" 1
1692 1 55 GLN H 1 57 ARG H 4.770 . 4.770 4.066 3.849 4.351 . 0 0 "[ . 1 . 2]" 1
1693 1 55 GLN H 1 58 ALA H 5.500 . 5.500 5.080 4.784 5.376 . 0 0 "[ . 1 . 2]" 1
1694 1 55 GLN H 1 58 ALA MB 5.500 . 5.500 5.348 4.910 5.552 0.052 11 0 "[ . 1 . 2]" 1
1695 1 55 GLN HA 1 55 GLN QB 2.570 . 2.570 2.279 2.145 2.342 . 0 0 "[ . 1 . 2]" 1
1696 1 55 GLN HA 1 55 GLN QG 3.390 . 3.390 2.806 2.503 3.527 0.137 16 0 "[ . 1 . 2]" 1
1697 1 55 GLN HA 1 57 ARG H 4.790 . 4.790 4.562 4.304 4.682 . 0 0 "[ . 1 . 2]" 1
1698 1 55 GLN QB 1 56 ASP H 3.610 . 3.610 2.563 2.035 3.575 . 0 0 "[ . 1 . 2]" 1
1699 1 55 GLN HB2 1 56 ASP H 4.160 . 4.160 3.764 3.519 4.119 . 0 0 "[ . 1 . 2]" 1
1700 1 55 GLN HB2 1 56 ASP HA 5.500 . 5.500 5.197 4.149 5.527 0.027 5 0 "[ . 1 . 2]" 1
1701 1 55 GLN HB3 1 56 ASP H 4.160 . 4.160 2.673 2.048 3.989 . 0 0 "[ . 1 . 2]" 1
1702 1 55 GLN HB3 1 56 ASP HA 5.500 . 5.500 4.466 3.946 5.582 0.082 6 0 "[ . 1 . 2]" 1
1703 1 55 GLN QE 1 56 ASP H 4.820 . 4.820 3.308 2.509 4.145 . 0 0 "[ . 1 . 2]" 1
1704 1 55 GLN QE 1 56 ASP QB 3.960 . 3.960 3.511 2.378 3.965 0.005 7 0 "[ . 1 . 2]" 1
1705 1 55 GLN QE 1 59 LEU HB2 4.710 . 4.710 4.084 2.784 4.775 0.065 17 0 "[ . 1 . 2]" 1
1706 1 55 GLN QE 1 59 LEU QD 4.760 . 4.760 3.422 2.675 4.789 0.029 17 0 "[ . 1 . 2]" 1
1707 1 55 GLN QE 1 59 LEU HG 5.340 . 5.340 5.009 4.075 5.366 0.026 5 0 "[ . 1 . 2]" 1
1708 1 55 GLN QE 1 60 VAL MG1 5.340 . 5.340 5.360 4.634 5.466 0.126 18 0 "[ . 1 . 2]" 1
1709 1 55 GLN QG 1 56 ASP H 5.500 . 5.500 3.055 1.797 3.979 0.003 2 0 "[ . 1 . 2]" 1
1710 1 55 GLN QG 1 56 ASP HA 3.900 . 3.900 3.338 2.824 3.975 0.075 20 0 "[ . 1 . 2]" 1
1711 1 55 GLN QG 1 58 ALA MB 5.490 . 5.490 4.642 4.095 5.536 0.046 6 0 "[ . 1 . 2]" 1
1712 1 55 GLN QG 1 59 LEU H 5.500 . 5.500 4.556 3.645 5.557 0.057 4 0 "[ . 1 . 2]" 1
1713 1 56 ASP H 1 56 ASP QB 2.670 . 2.670 2.411 2.364 2.493 . 0 0 "[ . 1 . 2]" 1
1714 1 56 ASP H 1 57 ARG H 2.930 . 2.930 2.553 2.352 2.710 . 0 0 "[ . 1 . 2]" 1
1715 1 56 ASP H 1 58 ALA H 4.100 . 4.100 4.042 3.765 4.144 0.044 8 0 "[ . 1 . 2]" 1
1716 1 56 ASP H 1 58 ALA MB 5.280 . 5.280 5.108 4.677 5.297 0.017 12 0 "[ . 1 . 2]" 1
1717 1 56 ASP H 1 59 LEU HB3 5.500 . 5.500 5.106 4.733 5.516 0.016 3 0 "[ . 1 . 2]" 1
1718 1 56 ASP HA 1 58 ALA H 4.770 . 4.770 3.865 3.541 4.242 . 0 0 "[ . 1 . 2]" 1
1719 1 56 ASP HA 1 58 ALA MB 5.260 . 5.260 4.910 4.687 5.118 . 0 0 "[ . 1 . 2]" 1
1720 1 56 ASP HA 1 59 LEU H 3.600 . 3.600 3.117 2.776 3.479 . 0 0 "[ . 1 . 2]" 1
1721 1 56 ASP HA 1 59 LEU HB2 3.640 . 3.640 3.574 2.991 3.754 0.114 11 0 "[ . 1 . 2]" 1
1722 1 56 ASP HA 1 59 LEU HB3 4.160 . 4.160 2.583 2.329 2.973 . 0 0 "[ . 1 . 2]" 1
1723 1 56 ASP HA 1 59 LEU MD1 5.500 . 5.500 5.003 3.881 5.459 . 0 0 "[ . 1 . 2]" 1
1724 1 56 ASP HA 1 59 LEU QD 4.160 . 4.160 3.814 3.519 4.160 . 0 0 "[ . 1 . 2]" 1
1725 1 56 ASP HA 1 59 LEU MD2 5.500 . 5.500 4.147 3.583 5.133 . 0 0 "[ . 1 . 2]" 1
1726 1 56 ASP HA 1 60 VAL H 3.970 . 3.970 3.070 2.482 3.738 . 0 0 "[ . 1 . 2]" 1
1727 1 56 ASP HA 1 60 VAL MG1 5.110 . 5.110 3.418 2.652 4.028 . 0 0 "[ . 1 . 2]" 1
1728 1 56 ASP QB 1 57 ARG H 3.390 . 3.390 2.636 2.308 3.317 . 0 0 "[ . 1 . 2]" 1
1729 1 56 ASP QB 1 59 LEU H 4.800 . 4.800 4.568 4.291 4.730 . 0 0 "[ . 1 . 2]" 1
1730 1 56 ASP QB 1 59 LEU QD 5.060 . 5.060 4.820 4.643 4.990 . 0 0 "[ . 1 . 2]" 1
1731 1 56 ASP QB 1 60 VAL MG1 4.370 . 4.370 2.792 2.074 3.559 . 0 0 "[ . 1 . 2]" 1
1732 1 56 ASP HB2 1 57 ARG H 4.180 . 4.180 2.735 2.340 3.705 . 0 0 "[ . 1 . 2]" 1
1733 1 56 ASP HB3 1 57 ARG H 4.180 . 4.180 3.665 3.506 3.785 . 0 0 "[ . 1 . 2]" 1
1734 1 57 ARG H 1 57 ARG HA 2.880 . 2.880 2.771 2.736 2.814 . 0 0 "[ . 1 . 2]" 1
1735 1 57 ARG H 1 57 ARG HB2 3.260 . 3.260 2.403 2.246 2.583 . 0 0 "[ . 1 . 2]" 1
1736 1 57 ARG H 1 57 ARG HB3 3.840 . 3.840 3.586 3.527 3.664 . 0 0 "[ . 1 . 2]" 1
1737 1 57 ARG H 1 57 ARG HD2 5.500 . 5.500 4.256 3.523 4.943 . 0 0 "[ . 1 . 2]" 1
1738 1 57 ARG H 1 57 ARG HD3 4.950 . 4.950 4.759 4.249 4.967 0.017 3 0 "[ . 1 . 2]" 1
1739 1 57 ARG H 1 57 ARG HG2 3.920 . 3.920 2.610 2.061 3.349 . 0 0 "[ . 1 . 2]" 1
1740 1 57 ARG H 1 57 ARG QG 3.220 . 3.220 2.421 2.048 2.669 . 0 0 "[ . 1 . 2]" 1
1741 1 57 ARG H 1 57 ARG HG3 3.920 . 3.920 3.381 2.447 3.755 . 0 0 "[ . 1 . 2]" 1
1742 1 57 ARG H 1 58 ALA H 2.800 . 2.800 2.788 2.670 2.832 0.032 19 0 "[ . 1 . 2]" 1
1743 1 57 ARG H 1 58 ALA MB 5.500 . 5.500 4.522 4.369 4.592 . 0 0 "[ . 1 . 2]" 1
1744 1 57 ARG H 1 60 VAL MG1 4.750 . 4.750 3.918 3.592 4.071 . 0 0 "[ . 1 . 2]" 1
1745 1 57 ARG HA 1 57 ARG HD3 5.500 . 5.500 3.809 3.437 4.677 . 0 0 "[ . 1 . 2]" 1
1746 1 57 ARG HA 1 57 ARG HG2 3.800 . 3.800 2.630 2.280 3.023 . 0 0 "[ . 1 . 2]" 1
1747 1 57 ARG HA 1 57 ARG QG 3.210 . 3.210 2.567 2.238 2.908 . 0 0 "[ . 1 . 2]" 1
1748 1 57 ARG HA 1 57 ARG HG3 3.800 . 3.800 3.610 3.129 3.779 . 0 0 "[ . 1 . 2]" 1
1749 1 57 ARG HA 1 60 VAL MG1 3.690 . 3.690 2.809 1.786 3.339 0.014 18 0 "[ . 1 . 2]" 1
1750 1 57 ARG HA 1 60 VAL MG2 5.500 . 5.500 5.195 4.229 5.587 0.087 11 0 "[ . 1 . 2]" 1
1751 1 57 ARG HA 1 61 LYS H 4.860 . 4.860 4.375 3.802 4.753 . 0 0 "[ . 1 . 2]" 1
1752 1 57 ARG HB2 1 57 ARG HD2 3.890 . 3.890 3.611 3.064 3.771 . 0 0 "[ . 1 . 2]" 1
1753 1 57 ARG HB2 1 58 ALA H 3.270 . 3.270 3.075 2.690 3.291 0.021 18 0 "[ . 1 . 2]" 1
1754 1 57 ARG HB2 1 58 ALA HA 5.340 . 5.340 4.731 4.449 4.959 . 0 0 "[ . 1 . 2]" 1
1755 1 57 ARG HB3 1 58 ALA H 4.320 . 4.320 3.785 3.459 4.057 . 0 0 "[ . 1 . 2]" 1
1756 1 57 ARG HD2 1 60 VAL MG1 4.250 . 4.250 4.197 3.949 4.425 0.175 5 0 "[ . 1 . 2]" 1
1757 1 58 ALA H 1 58 ALA MB 2.400 . 2.400 2.320 2.262 2.375 . 0 0 "[ . 1 . 2]" 1
1758 1 58 ALA H 1 59 LEU H 2.550 . 2.550 2.200 1.985 2.524 . 0 0 "[ . 1 . 2]" 1
1759 1 58 ALA H 1 59 LEU HB3 5.060 . 5.060 4.561 4.320 4.894 . 0 0 "[ . 1 . 2]" 1
1760 1 58 ALA HA 1 59 LEU H 3.460 . 3.460 3.456 3.272 3.517 0.057 11 0 "[ . 1 . 2]" 1
1761 1 58 ALA HA 1 60 VAL H 5.500 . 5.500 5.119 4.838 5.450 . 0 0 "[ . 1 . 2]" 1
1762 1 58 ALA HA 1 61 LYS H 4.460 . 4.460 4.098 3.779 4.472 0.012 17 0 "[ . 1 . 2]" 1
1763 1 58 ALA HA 1 61 LYS QB 3.420 . 3.420 2.769 2.440 3.253 . 0 0 "[ . 1 . 2]" 1
1764 1 58 ALA HA 1 61 LYS QE 5.500 . 5.500 5.371 4.358 5.579 0.079 11 0 "[ . 1 . 2]" 1
1765 1 58 ALA HA 1 61 LYS QG 5.340 . 5.340 3.711 3.425 4.548 . 0 0 "[ . 1 . 2]" 1
1766 1 58 ALA MB 1 59 LEU QD 4.720 . 4.720 4.344 4.147 4.505 . 0 0 "[ . 1 . 2]" 1
1767 1 58 ALA MB 1 60 VAL H 5.500 . 5.500 4.942 4.742 5.169 . 0 0 "[ . 1 . 2]" 1
1768 1 58 ALA MB 1 61 LYS H 5.500 . 5.500 4.890 4.617 5.216 . 0 0 "[ . 1 . 2]" 1
1769 1 59 LEU H 1 59 LEU HB2 3.010 . 3.010 2.661 2.385 2.973 . 0 0 "[ . 1 . 2]" 1
1770 1 59 LEU H 1 59 LEU HB3 2.910 . 2.910 2.606 2.525 2.711 . 0 0 "[ . 1 . 2]" 1
1771 1 59 LEU H 1 59 LEU HG 5.500 . 5.500 4.543 4.425 4.808 . 0 0 "[ . 1 . 2]" 1
1772 1 59 LEU H 1 60 VAL H 2.770 . 2.770 2.611 2.111 2.786 0.016 11 0 "[ . 1 . 2]" 1
1773 1 59 LEU H 1 60 VAL HA 5.300 . 5.300 5.164 4.741 5.328 0.028 1 0 "[ . 1 . 2]" 1
1774 1 59 LEU H 1 60 VAL MG1 3.940 . 3.940 3.698 3.087 3.953 0.013 4 0 "[ . 1 . 2]" 1
1775 1 59 LEU H 1 61 LYS H 4.050 . 4.050 3.541 3.180 3.685 . 0 0 "[ . 1 . 2]" 1
1776 1 59 LEU H 1 61 LYS QB 4.160 . 4.160 4.161 4.018 4.216 0.056 3 0 "[ . 1 . 2]" 1
1777 1 59 LEU HA 1 59 LEU QD 2.730 . 2.730 2.015 1.937 2.086 . 0 0 "[ . 1 . 2]" 1
1778 1 59 LEU HA 1 59 LEU HG 3.720 . 3.720 3.244 2.987 3.790 0.070 15 0 "[ . 1 . 2]" 1
1779 1 59 LEU HA 1 60 VAL HA 5.500 . 5.500 4.681 4.609 4.770 . 0 0 "[ . 1 . 2]" 1
1780 1 59 LEU HA 1 61 LYS H 4.970 . 4.970 3.858 3.732 4.155 . 0 0 "[ . 1 . 2]" 1
1781 1 59 LEU HA 1 61 LYS QB 5.500 . 5.500 4.519 4.239 4.851 . 0 0 "[ . 1 . 2]" 1
1782 1 59 LEU HA 1 62 LYS H 4.110 . 4.110 3.556 3.374 3.906 . 0 0 "[ . 1 . 2]" 1
1783 1 59 LEU HA 1 62 LYS QB 3.740 . 3.740 3.145 2.715 3.802 0.062 14 0 "[ . 1 . 2]" 1
1784 1 59 LEU HA 1 62 LYS QD 5.290 . 5.290 4.128 3.012 5.231 . 0 0 "[ . 1 . 2]" 1
1785 1 59 LEU HA 1 62 LYS QG 5.340 . 5.340 4.756 2.424 5.358 0.018 12 0 "[ . 1 . 2]" 1
1786 1 59 LEU HB2 1 59 LEU MD1 3.240 . 3.240 2.632 2.329 3.230 . 0 0 "[ . 1 . 2]" 1
1787 1 59 LEU HB2 1 59 LEU MD2 3.240 . 3.240 2.425 2.368 2.516 . 0 0 "[ . 1 . 2]" 1
1788 1 59 LEU HB2 1 60 VAL H 3.750 . 3.750 3.718 3.505 3.801 0.051 13 0 "[ . 1 . 2]" 1
1789 1 59 LEU HB3 1 59 LEU MD1 3.320 . 3.320 2.994 2.339 3.201 . 0 0 "[ . 1 . 2]" 1
1790 1 59 LEU HB3 1 59 LEU QD 2.810 . 2.810 2.313 2.268 2.378 . 0 0 "[ . 1 . 2]" 1
1791 1 59 LEU HB3 1 59 LEU MD2 3.320 . 3.320 2.577 2.322 3.221 . 0 0 "[ . 1 . 2]" 1
1792 1 59 LEU HB3 1 60 VAL H 3.340 . 3.340 2.342 2.091 2.557 . 0 0 "[ . 1 . 2]" 1
1793 1 59 LEU HB3 1 60 VAL HA 4.740 . 4.740 4.115 3.905 4.256 . 0 0 "[ . 1 . 2]" 1
1794 1 59 LEU QD 1 60 VAL H 4.460 . 4.460 3.588 2.907 3.927 . 0 0 "[ . 1 . 2]" 1
1795 1 59 LEU QD 1 63 LYS H 3.850 . 3.850 3.838 3.477 3.968 0.118 8 0 "[ . 1 . 2]" 1
1796 1 59 LEU QD 1 63 LYS HE3 3.220 . 3.220 2.638 2.033 2.917 . 0 0 "[ . 1 . 2]" 1
1797 1 59 LEU MD1 1 63 LYS HD2 5.500 . 5.500 4.474 4.093 4.676 . 0 0 "[ . 1 . 2]" 1
1798 1 59 LEU MD1 1 63 LYS HE2 3.590 . 3.590 2.328 1.863 2.568 . 0 0 "[ . 1 . 2]" 1
1799 1 59 LEU MD1 1 63 LYS HE3 3.790 . 3.790 2.816 2.068 3.200 . 0 0 "[ . 1 . 2]" 1
1800 1 59 LEU MD2 1 63 LYS HD2 5.500 . 5.500 5.309 4.600 5.511 0.011 4 0 "[ . 1 . 2]" 1
1801 1 59 LEU MD2 1 63 LYS HE2 3.590 . 3.590 3.547 2.642 3.732 0.142 1 0 "[ . 1 . 2]" 1
1802 1 59 LEU MD2 1 63 LYS HE3 3.790 . 3.790 3.358 2.957 3.803 0.013 4 0 "[ . 1 . 2]" 1
1803 1 59 LEU HG 1 60 VAL H 4.440 . 4.440 3.776 3.349 4.466 0.026 12 0 "[ . 1 . 2]" 1
1804 1 59 LEU HG 1 60 VAL HA 5.040 . 5.040 3.905 3.294 5.139 0.099 12 0 "[ . 1 . 2]" 1
1805 1 59 LEU HG 1 63 LYS HE2 4.280 . 4.280 3.127 2.523 4.529 0.249 2 0 "[ . 1 . 2]" 1
1806 1 60 VAL H 1 60 VAL HA 2.890 . 2.890 2.798 2.735 2.833 . 0 0 "[ . 1 . 2]" 1
1807 1 60 VAL H 1 60 VAL HB 2.700 . 2.700 2.736 2.674 2.768 0.068 11 0 "[ . 1 . 2]" 1
1808 1 60 VAL H 1 60 VAL MG1 2.560 . 2.560 2.035 1.933 2.141 . 0 0 "[ . 1 . 2]" 1
1809 1 60 VAL H 1 60 VAL MG2 3.810 . 3.810 3.751 3.720 3.783 . 0 0 "[ . 1 . 2]" 1
1810 1 60 VAL H 1 61 LYS H 2.840 . 2.840 2.488 2.371 2.629 . 0 0 "[ . 1 . 2]" 1
1811 1 60 VAL H 1 61 LYS QB 4.730 . 4.730 4.173 4.003 4.489 . 0 0 "[ . 1 . 2]" 1
1812 1 60 VAL H 1 63 LYS H 5.500 . 5.500 4.770 4.649 4.968 . 0 0 "[ . 1 . 2]" 1
1813 1 60 VAL H 1 63 LYS HB2 5.130 . 5.130 4.858 4.747 5.005 . 0 0 "[ . 1 . 2]" 1
1814 1 60 VAL HA 1 60 VAL MG1 3.190 . 3.190 3.219 3.207 3.233 0.043 13 0 "[ . 1 . 2]" 1
1815 1 60 VAL HA 1 60 VAL MG2 3.030 . 3.030 2.387 2.315 2.481 . 0 0 "[ . 1 . 2]" 1
1816 1 60 VAL HA 1 61 LYS HA 5.320 . 5.320 4.797 4.740 4.870 . 0 0 "[ . 1 . 2]" 1
1817 1 60 VAL HA 1 62 LYS H 4.910 . 4.910 3.857 3.698 4.063 . 0 0 "[ . 1 . 2]" 1
1818 1 60 VAL HA 1 63 LYS H 3.470 . 3.470 3.129 2.947 3.313 . 0 0 "[ . 1 . 2]" 1
1819 1 60 VAL HA 1 63 LYS HB2 4.010 . 4.010 2.547 2.387 2.742 . 0 0 "[ . 1 . 2]" 1
1820 1 60 VAL HA 1 63 LYS HG2 4.720 . 4.720 4.337 4.201 4.541 . 0 0 "[ . 1 . 2]" 1
1821 1 60 VAL HA 1 63 LYS HG3 5.500 . 5.500 5.225 5.054 5.415 . 0 0 "[ . 1 . 2]" 1
1822 1 60 VAL HA 1 64 LEU H 3.860 . 3.860 3.707 3.592 3.900 0.040 12 0 "[ . 1 . 2]" 1
1823 1 60 VAL HB 1 61 LYS H 4.360 . 4.360 4.167 4.073 4.260 . 0 0 "[ . 1 . 2]" 1
1824 1 60 VAL MG1 1 61 LYS H 3.470 . 3.470 2.592 2.448 2.710 . 0 0 "[ . 1 . 2]" 1
1825 1 60 VAL MG1 1 61 LYS HA 4.030 . 4.030 3.370 3.057 3.631 . 0 0 "[ . 1 . 2]" 1
1826 1 60 VAL MG1 1 61 LYS QE 5.500 . 5.500 5.241 3.975 5.663 0.163 15 0 "[ . 1 . 2]" 1
1827 1 60 VAL MG2 1 61 LYS H 3.830 . 3.830 3.701 3.630 3.777 . 0 0 "[ . 1 . 2]" 1
1828 1 60 VAL MG2 1 61 LYS HA 3.700 . 3.700 3.630 3.469 3.733 0.033 20 0 "[ . 1 . 2]" 1
1829 1 60 VAL MG2 1 62 LYS H 4.610 . 4.610 4.713 4.673 4.775 0.165 8 0 "[ . 1 . 2]" 1
1830 1 60 VAL MG2 1 63 LYS H 4.640 . 4.640 4.308 4.162 4.428 . 0 0 "[ . 1 . 2]" 1
1831 1 60 VAL MG2 1 64 LEU H 3.910 . 3.910 3.396 3.249 3.503 . 0 0 "[ . 1 . 2]" 1
1832 1 60 VAL MG2 1 64 LEU HG 5.500 . 5.500 3.986 3.764 4.234 . 0 0 "[ . 1 . 2]" 1
1833 1 60 VAL MG2 1 65 LYS H 5.500 . 5.500 5.452 5.345 5.528 0.028 18 0 "[ . 1 . 2]" 1
1834 1 61 LYS H 1 61 LYS HA 2.870 . 2.870 2.871 2.831 2.890 0.020 3 0 "[ . 1 . 2]" 1
1835 1 61 LYS H 1 61 LYS QB 2.590 . 2.590 2.221 2.092 2.321 . 0 0 "[ . 1 . 2]" 1
1836 1 61 LYS H 1 61 LYS QD 4.400 . 4.400 4.243 3.887 4.460 0.060 9 0 "[ . 1 . 2]" 1
1837 1 61 LYS H 1 61 LYS HG2 4.750 . 4.750 4.332 2.775 4.702 . 0 0 "[ . 1 . 2]" 1
1838 1 61 LYS H 1 61 LYS QG 4.110 . 4.110 3.848 2.723 4.108 . 0 0 "[ . 1 . 2]" 1
1839 1 61 LYS H 1 61 LYS HG3 4.750 . 4.750 4.389 3.954 4.569 . 0 0 "[ . 1 . 2]" 1
1840 1 61 LYS H 1 62 LYS H 3.050 . 3.050 2.329 2.218 2.540 . 0 0 "[ . 1 . 2]" 1
1841 1 61 LYS H 1 63 LYS HE2 5.500 . 5.500 5.663 5.608 5.711 0.211 3 0 "[ . 1 . 2]" 1
1842 1 61 LYS HA 1 61 LYS QD 3.380 . 3.380 2.092 1.958 2.216 . 0 0 "[ . 1 . 2]" 1
1843 1 61 LYS HA 1 61 LYS HG2 3.850 . 3.850 3.558 2.529 3.883 0.033 9 0 "[ . 1 . 2]" 1
1844 1 61 LYS HA 1 61 LYS QG 3.070 . 3.070 2.899 2.484 3.115 0.045 17 0 "[ . 1 . 2]" 1
1845 1 61 LYS HA 1 61 LYS HG3 3.850 . 3.850 3.218 2.981 3.659 . 0 0 "[ . 1 . 2]" 1
1846 1 61 LYS HA 1 62 LYS H 3.430 . 3.430 3.385 3.334 3.437 0.007 8 0 "[ . 1 . 2]" 1
1847 1 61 LYS HA 1 63 LYS H 4.890 . 4.890 4.405 4.202 4.577 . 0 0 "[ . 1 . 2]" 1
1848 1 61 LYS HA 1 64 LEU H 4.300 . 4.300 3.750 3.598 3.986 . 0 0 "[ . 1 . 2]" 1
1849 1 61 LYS HA 1 64 LEU HB3 4.460 . 4.460 4.014 3.836 4.154 . 0 0 "[ . 1 . 2]" 1
1850 1 61 LYS HA 1 64 LEU QD 3.750 . 3.750 1.953 1.869 2.065 . 0 0 "[ . 1 . 2]" 1
1851 1 61 LYS HA 1 64 LEU HG 3.510 . 3.510 2.591 2.283 3.055 . 0 0 "[ . 1 . 2]" 1
1852 1 61 LYS QB 1 61 LYS QE 4.130 . 4.130 2.973 1.948 3.664 . 0 0 "[ . 1 . 2]" 1
1853 1 61 LYS QB 1 62 LYS HA 5.500 . 5.500 4.109 3.819 4.379 . 0 0 "[ . 1 . 2]" 1
1854 1 61 LYS QD 1 65 LYS H 5.500 . 5.500 5.259 4.800 5.552 0.052 3 0 "[ . 1 . 2]" 1
1855 1 61 LYS QG 1 62 LYS H 4.900 . 4.900 3.959 3.420 4.556 . 0 0 "[ . 1 . 2]" 1
1856 1 62 LYS H 1 62 LYS QB 2.410 . 2.410 2.267 2.158 2.483 0.073 8 0 "[ . 1 . 2]" 1
1857 1 62 LYS H 1 62 LYS QD 5.480 . 5.480 4.523 3.956 4.899 . 0 0 "[ . 1 . 2]" 1
1858 1 62 LYS H 1 63 LYS H 2.540 . 2.540 2.184 2.075 2.293 . 0 0 "[ . 1 . 2]" 1
1859 1 62 LYS H 1 63 LYS HA 5.270 . 5.270 4.860 4.744 4.948 . 0 0 "[ . 1 . 2]" 1
1860 1 62 LYS H 1 64 LEU H 3.910 . 3.910 3.817 3.695 3.887 . 0 0 "[ . 1 . 2]" 1
1861 1 62 LYS HA 1 62 LYS QB 2.670 . 2.670 2.303 2.158 2.340 . 0 0 "[ . 1 . 2]" 1
1862 1 62 LYS HA 1 63 LYS H 3.530 . 3.530 3.431 3.384 3.485 . 0 0 "[ . 1 . 2]" 1
1863 1 62 LYS HA 1 63 LYS HB2 5.500 . 5.500 5.453 5.415 5.498 . 0 0 "[ . 1 . 2]" 1
1864 1 62 LYS HA 1 65 LYS H 3.880 . 3.880 3.819 3.515 3.952 0.072 16 0 "[ . 1 . 2]" 1
1865 1 62 LYS HA 1 65 LYS HG2 4.760 . 4.760 2.503 2.242 2.768 . 0 0 "[ . 1 . 2]" 1
1866 1 62 LYS QB 1 62 LYS QD 3.430 . 3.430 2.249 2.081 2.392 . 0 0 "[ . 1 . 2]" 1
1867 1 62 LYS QB 1 63 LYS H 3.700 . 3.700 2.662 2.331 3.612 . 0 0 "[ . 1 . 2]" 1
1868 1 62 LYS QE 1 62 LYS QG 3.270 . 3.270 2.386 2.099 2.806 . 0 0 "[ . 1 . 2]" 1
1869 1 62 LYS QG 1 63 LYS H 3.760 . 3.760 3.353 2.357 3.639 . 0 0 "[ . 1 . 2]" 1
1870 1 62 LYS QG 1 63 LYS HA 4.070 . 4.070 3.358 3.087 3.584 . 0 0 "[ . 1 . 2]" 1
1871 1 62 LYS QG 1 66 GLU HG3 5.340 . 5.340 4.980 4.275 5.360 0.020 20 0 "[ . 1 . 2]" 1
1872 1 62 LYS HG2 1 63 LYS H 4.470 . 4.470 3.492 2.561 3.830 . 0 0 "[ . 1 . 2]" 1
1873 1 62 LYS HG2 1 63 LYS HA 4.740 . 4.740 3.543 3.270 4.530 . 0 0 "[ . 1 . 2]" 1
1874 1 62 LYS HG3 1 63 LYS H 4.470 . 4.470 4.356 2.755 4.562 0.092 9 0 "[ . 1 . 2]" 1
1875 1 62 LYS HG3 1 63 LYS HA 4.740 . 4.740 4.629 3.165 4.816 0.076 13 0 "[ . 1 . 2]" 1
1876 1 63 LYS H 1 63 LYS HA 2.910 . 2.910 2.819 2.786 2.870 . 0 0 "[ . 1 . 2]" 1
1877 1 63 LYS H 1 63 LYS HB2 2.780 . 2.780 2.101 2.037 2.189 . 0 0 "[ . 1 . 2]" 1
1878 1 63 LYS H 1 63 LYS HB3 3.460 . 3.460 3.056 2.926 3.201 . 0 0 "[ . 1 . 2]" 1
1879 1 63 LYS H 1 63 LYS HE2 4.730 . 4.730 3.186 2.962 3.385 . 0 0 "[ . 1 . 2]" 1
1880 1 63 LYS H 1 63 LYS HE3 4.800 . 4.800 4.669 4.478 4.831 0.031 17 0 "[ . 1 . 2]" 1
1881 1 63 LYS H 1 63 LYS HG2 4.590 . 4.590 4.517 4.413 4.604 0.014 9 0 "[ . 1 . 2]" 1
1882 1 63 LYS H 1 63 LYS HG3 4.600 . 4.600 4.429 4.378 4.478 . 0 0 "[ . 1 . 2]" 1
1883 1 63 LYS H 1 64 LEU H 2.740 . 2.740 2.586 2.431 2.665 . 0 0 "[ . 1 . 2]" 1
1884 1 63 LYS H 1 65 LYS H 4.040 . 4.040 4.084 3.921 4.126 0.086 13 0 "[ . 1 . 2]" 1
1885 1 63 LYS H 1 66 GLU H 5.120 . 5.120 5.033 4.791 5.150 0.030 10 0 "[ . 1 . 2]" 1
1886 1 63 LYS HA 1 63 LYS HD2 3.680 . 3.680 3.461 3.409 3.534 . 0 0 "[ . 1 . 2]" 1
1887 1 63 LYS HA 1 63 LYS HD3 3.590 . 3.590 2.020 1.956 2.134 . 0 0 "[ . 1 . 2]" 1
1888 1 63 LYS HA 1 63 LYS HE2 4.600 . 4.600 3.509 3.343 3.711 . 0 0 "[ . 1 . 2]" 1
1889 1 63 LYS HA 1 63 LYS HG3 2.910 . 2.910 2.450 2.388 2.503 . 0 0 "[ . 1 . 2]" 1
1890 1 63 LYS HA 1 66 GLU H 3.610 . 3.610 3.529 3.402 3.635 0.025 1 0 "[ . 1 . 2]" 1
1891 1 63 LYS HA 1 66 GLU HG2 4.850 . 4.850 2.142 1.925 2.373 . 0 0 "[ . 1 . 2]" 1
1892 1 63 LYS HA 1 66 GLU HG3 4.460 . 4.460 3.056 2.775 3.375 . 0 0 "[ . 1 . 2]" 1
1893 1 63 LYS HA 1 67 MET H 5.500 . 5.500 4.624 4.059 5.022 . 0 0 "[ . 1 . 2]" 1
1894 1 63 LYS HA 1 70 SER QB 5.500 . 5.500 4.936 3.957 5.570 0.070 5 0 "[ . 1 . 2]" 1
1895 1 63 LYS HB2 1 64 LEU H 3.330 . 3.330 3.362 3.336 3.401 0.071 19 0 "[ . 1 . 2]" 1
1896 1 63 LYS HB3 1 64 LEU H 3.350 . 3.350 2.769 2.574 3.070 . 0 0 "[ . 1 . 2]" 1
1897 1 63 LYS HD3 1 66 GLU H 5.500 . 5.500 5.357 5.147 5.505 0.005 1 0 "[ . 1 . 2]" 1
1898 1 63 LYS HE2 1 63 LYS HG2 3.800 . 3.800 3.149 3.053 3.208 . 0 0 "[ . 1 . 2]" 1
1899 1 63 LYS HE2 1 66 GLU HG2 5.500 . 5.500 5.513 5.321 5.599 0.099 2 0 "[ . 1 . 2]" 1
1900 1 63 LYS HE3 1 63 LYS HG2 3.370 . 3.370 2.482 2.355 2.578 . 0 0 "[ . 1 . 2]" 1
1901 1 63 LYS HE3 1 63 LYS HG3 3.790 . 3.790 3.683 3.608 3.741 . 0 0 "[ . 1 . 2]" 1
1902 1 63 LYS HG3 1 64 LEU H 5.500 . 5.500 4.647 4.485 4.920 . 0 0 "[ . 1 . 2]" 1
1903 1 63 LYS HG3 1 66 GLU H 5.500 . 5.500 5.027 4.654 5.499 . 0 0 "[ . 1 . 2]" 1
1904 1 64 LEU H 1 64 LEU HB2 3.580 . 3.580 3.591 3.578 3.619 0.039 19 0 "[ . 1 . 2]" 1
1905 1 64 LEU H 1 64 LEU HB3 2.400 . 2.400 2.400 2.327 2.444 0.044 12 0 "[ . 1 . 2]" 1
1906 1 64 LEU H 1 64 LEU MD1 4.190 . 4.190 3.838 3.690 4.002 . 0 0 "[ . 1 . 2]" 1
1907 1 64 LEU H 1 64 LEU QD 3.330 . 3.330 3.076 2.989 3.153 . 0 0 "[ . 1 . 2]" 1
1908 1 64 LEU H 1 64 LEU MD2 4.190 . 4.190 3.240 3.127 3.320 . 0 0 "[ . 1 . 2]" 1
1909 1 64 LEU H 1 64 LEU HG 3.800 . 3.800 2.494 2.305 2.685 . 0 0 "[ . 1 . 2]" 1
1910 1 64 LEU H 1 65 LYS H 2.740 . 2.740 2.623 2.486 2.712 . 0 0 "[ . 1 . 2]" 1
1911 1 64 LEU H 1 65 LYS HG2 4.420 . 4.420 4.153 4.058 4.325 . 0 0 "[ . 1 . 2]" 1
1912 1 64 LEU H 1 66 GLU H 4.160 . 4.160 4.090 3.908 4.176 0.016 9 0 "[ . 1 . 2]" 1
1913 1 64 LEU H 1 67 MET H 5.040 . 5.040 4.921 4.574 5.133 0.093 11 0 "[ . 1 . 2]" 1
1914 1 64 LEU HA 1 64 LEU HB3 2.820 . 2.820 2.461 2.400 2.529 . 0 0 "[ . 1 . 2]" 1
1915 1 64 LEU HA 1 64 LEU MD1 4.420 . 4.420 3.623 3.547 3.668 . 0 0 "[ . 1 . 2]" 1
1916 1 64 LEU HA 1 64 LEU QD 3.410 . 3.410 3.399 3.356 3.427 0.017 6 0 "[ . 1 . 2]" 1
1917 1 64 LEU HA 1 64 LEU MD2 4.420 . 4.420 4.118 4.054 4.141 . 0 0 "[ . 1 . 2]" 1
1918 1 64 LEU HA 1 65 LYS HG2 5.500 . 5.500 5.514 5.408 5.564 0.064 18 0 "[ . 1 . 2]" 1
1919 1 64 LEU HB2 1 65 LYS H 4.450 . 4.450 4.114 4.020 4.298 . 0 0 "[ . 1 . 2]" 1
1920 1 64 LEU HB2 1 67 MET H 5.500 . 5.500 5.315 4.883 5.501 0.001 16 0 "[ . 1 . 2]" 1
1921 1 64 LEU HB3 1 65 LYS H 3.960 . 3.960 4.000 3.970 4.023 0.063 19 0 "[ . 1 . 2]" 1
1922 1 64 LEU QD 1 65 LYS H 3.810 . 3.810 2.857 2.642 3.275 . 0 0 "[ . 1 . 2]" 1
1923 1 64 LEU QD 1 65 LYS HA 2.980 . 2.980 2.667 2.511 2.965 . 0 0 "[ . 1 . 2]" 1
1924 1 64 LEU QD 1 65 LYS QE 5.430 . 5.430 4.481 3.097 5.441 0.011 8 0 "[ . 1 . 2]" 1
1925 1 64 LEU QD 1 67 MET H 5.280 . 5.280 4.785 4.579 5.006 . 0 0 "[ . 1 . 2]" 1
1926 1 64 LEU MD1 1 65 LYS H 4.400 . 4.400 2.911 2.673 3.392 . 0 0 "[ . 1 . 2]" 1
1927 1 64 LEU MD2 1 65 LYS H 4.400 . 4.400 4.201 4.089 4.328 . 0 0 "[ . 1 . 2]" 1
1928 1 64 LEU HG 1 65 LYS H 2.710 . 2.710 2.591 2.463 2.769 0.059 16 0 "[ . 1 . 2]" 1
1929 1 65 LYS H 1 65 LYS HB2 3.770 . 3.770 3.718 3.655 3.776 0.006 16 0 "[ . 1 . 2]" 1
1930 1 65 LYS H 1 65 LYS QB 3.100 . 3.100 2.769 2.643 2.920 . 0 0 "[ . 1 . 2]" 1
1931 1 65 LYS H 1 65 LYS HB3 3.770 . 3.770 2.858 2.702 3.040 . 0 0 "[ . 1 . 2]" 1
1932 1 65 LYS H 1 65 LYS HG2 3.650 . 3.650 2.132 2.031 2.334 . 0 0 "[ . 1 . 2]" 1
1933 1 65 LYS H 1 65 LYS HG3 4.730 . 4.730 3.182 2.979 3.522 . 0 0 "[ . 1 . 2]" 1
1934 1 65 LYS H 1 66 GLU HG2 5.500 . 5.500 3.788 3.611 3.988 . 0 0 "[ . 1 . 2]" 1
1935 1 65 LYS H 1 66 GLU HG3 5.500 . 5.500 5.234 5.043 5.441 . 0 0 "[ . 1 . 2]" 1
1936 1 65 LYS HA 1 65 LYS QB 2.610 . 2.610 2.172 2.155 2.200 . 0 0 "[ . 1 . 2]" 1
1937 1 65 LYS HA 1 65 LYS HG2 3.880 . 3.880 3.737 3.704 3.807 . 0 0 "[ . 1 . 2]" 1
1938 1 65 LYS HA 1 65 LYS HG3 4.040 . 4.040 3.767 3.705 3.812 . 0 0 "[ . 1 . 2]" 1
1939 1 65 LYS HA 1 67 MET QB 5.340 . 5.340 4.774 3.924 5.379 0.039 19 0 "[ . 1 . 2]" 1
1940 1 65 LYS HA 1 68 LYS H 5.500 . 5.500 4.918 4.298 5.534 0.034 8 0 "[ . 1 . 2]" 1
1941 1 65 LYS QB 1 65 LYS HG3 2.540 . 2.540 2.340 2.312 2.378 . 0 0 "[ . 1 . 2]" 1
1942 1 65 LYS QD 1 66 GLU H 5.500 . 5.500 4.817 4.371 5.265 . 0 0 "[ . 1 . 2]" 1
1943 1 65 LYS QE 1 65 LYS HG2 3.810 . 3.810 2.778 2.343 3.532 . 0 0 "[ . 1 . 2]" 1
1944 1 65 LYS HG2 1 66 GLU H 5.010 . 5.010 3.313 2.832 3.858 . 0 0 "[ . 1 . 2]" 1
1945 1 65 LYS HG3 1 66 GLU H 5.500 . 5.500 3.094 2.393 3.582 . 0 0 "[ . 1 . 2]" 1
1946 1 65 LYS HG3 1 66 GLU HG3 5.500 . 5.500 5.353 4.570 5.565 0.065 15 0 "[ . 1 . 2]" 1
1947 1 65 LYS HG3 1 67 MET H 5.500 . 5.500 4.989 4.489 5.328 . 0 0 "[ . 1 . 2]" 1
1948 1 66 GLU H 1 66 GLU HB2 4.010 . 4.010 3.740 3.633 3.868 . 0 0 "[ . 1 . 2]" 1
1949 1 66 GLU H 1 66 GLU HB3 3.240 . 3.240 2.966 2.656 3.264 0.024 8 0 "[ . 1 . 2]" 1
1950 1 66 GLU H 1 66 GLU HG2 2.680 . 2.680 2.120 1.958 2.329 . 0 0 "[ . 1 . 2]" 1
1951 1 66 GLU H 1 66 GLU HG3 3.600 . 3.600 3.170 2.928 3.401 . 0 0 "[ . 1 . 2]" 1
1952 1 66 GLU H 1 67 MET H 2.770 . 2.770 2.114 1.734 2.432 0.066 4 0 "[ . 1 . 2]" 1
1953 1 66 GLU H 1 67 MET QG 4.410 . 4.410 4.152 3.488 4.655 0.245 4 0 "[ . 1 . 2]" 1
1954 1 66 GLU H 1 68 LYS H 5.500 . 5.500 4.364 4.020 4.728 . 0 0 "[ . 1 . 2]" 1
1955 1 66 GLU H 1 68 LYS HG2 5.500 . 5.500 4.882 4.351 5.390 . 0 0 "[ . 1 . 2]" 1
1956 1 66 GLU HA 1 66 GLU HG2 3.910 . 3.910 3.721 3.652 3.806 . 0 0 "[ . 1 . 2]" 1
1957 1 66 GLU HA 1 66 GLU HG3 3.900 . 3.900 3.727 3.646 3.873 . 0 0 "[ . 1 . 2]" 1
1958 1 66 GLU HA 1 67 MET H 3.400 . 3.400 3.166 2.859 3.380 . 0 0 "[ . 1 . 2]" 1
1959 1 66 GLU HA 1 69 MET QG 4.980 . 4.980 3.200 2.238 3.767 . 0 0 "[ . 1 . 2]" 1
1960 1 66 GLU HB2 1 66 GLU HG3 2.930 . 2.930 2.396 2.310 2.517 . 0 0 "[ . 1 . 2]" 1
1961 1 66 GLU HB2 1 67 MET H 4.590 . 4.590 4.311 4.129 4.492 . 0 0 "[ . 1 . 2]" 1
1962 1 66 GLU HB2 1 67 MET HA 5.500 . 5.500 4.992 4.643 5.340 . 0 0 "[ . 1 . 2]" 1
1963 1 66 GLU HB2 1 68 LYS H 5.500 . 5.500 5.071 4.689 5.388 . 0 0 "[ . 1 . 2]" 1
1964 1 66 GLU HB2 1 70 SER H 5.500 . 5.500 4.569 4.044 5.060 . 0 0 "[ . 1 . 2]" 1
1965 1 66 GLU HB3 1 67 MET H 4.780 . 4.780 4.329 4.091 4.546 . 0 0 "[ . 1 . 2]" 1
1966 1 66 GLU HG2 1 67 MET H 4.840 . 4.840 3.456 3.141 3.843 . 0 0 "[ . 1 . 2]" 1
1967 1 66 GLU HG2 1 68 LYS H 5.500 . 5.500 5.579 5.511 5.655 0.155 15 0 "[ . 1 . 2]" 1
1968 1 66 GLU HG2 1 70 SER QB 5.090 . 5.090 4.478 3.484 5.129 0.039 8 0 "[ . 1 . 2]" 1
1969 1 66 GLU HG3 1 67 MET H 4.180 . 4.180 3.537 2.917 4.112 . 0 0 "[ . 1 . 2]" 1
1970 1 66 GLU HG3 1 68 LYS H 5.500 . 5.500 5.102 4.739 5.493 . 0 0 "[ . 1 . 2]" 1
1971 1 67 MET H 1 67 MET HA 2.940 . 2.940 2.763 2.710 2.843 . 0 0 "[ . 1 . 2]" 1
1972 1 67 MET H 1 67 MET QB 2.540 . 2.540 2.314 1.842 2.652 0.112 19 0 "[ . 1 . 2]" 1
1973 1 67 MET H 1 67 MET QG 3.540 . 3.540 2.737 2.159 3.573 0.033 10 0 "[ . 1 . 2]" 1
1974 1 67 MET H 1 68 LYS QD 5.500 . 5.500 5.223 4.542 5.582 0.082 11 0 "[ . 1 . 2]" 1
1975 1 67 MET HA 1 67 MET QG 3.480 . 3.480 3.064 2.141 3.556 0.076 3 0 "[ . 1 . 2]" 1
1976 1 67 MET HA 1 68 LYS H 3.560 . 3.560 3.352 3.246 3.423 . 0 0 "[ . 1 . 2]" 1
1977 1 67 MET HA 1 69 MET H 4.230 . 4.230 3.815 3.538 4.142 . 0 0 "[ . 1 . 2]" 1
1978 1 67 MET HA 1 70 SER H 3.420 . 3.420 3.013 2.703 3.445 0.025 6 0 "[ . 1 . 2]" 1
1979 1 67 MET HA 1 71 LEU H 4.270 . 4.270 3.307 2.980 3.528 . 0 0 "[ . 1 . 2]" 1
1980 1 67 MET QB 1 68 LYS HG2 5.340 . 5.340 4.673 3.803 5.348 0.008 14 0 "[ . 1 . 2]" 1
1981 1 67 MET QB 1 70 SER H 5.340 . 5.340 4.497 4.322 4.682 . 0 0 "[ . 1 . 2]" 1
1982 1 67 MET QB 1 70 SER QB 5.340 . 5.340 3.899 3.207 4.948 . 0 0 "[ . 1 . 2]" 1
1983 1 67 MET HB2 1 71 LEU H 5.500 . 5.500 4.808 4.040 5.564 0.064 4 0 "[ . 1 . 2]" 1
1984 1 67 MET HB3 1 71 LEU H 5.500 . 5.500 4.862 3.842 5.526 0.026 7 0 "[ . 1 . 2]" 1
1985 1 67 MET QG 1 68 LYS H 4.740 . 4.740 3.473 2.283 4.419 . 0 0 "[ . 1 . 2]" 1
1986 1 67 MET HG2 1 68 LYS H 5.500 . 5.500 4.188 2.977 4.840 . 0 0 "[ . 1 . 2]" 1
1987 1 67 MET HG3 1 68 LYS H 5.500 . 5.500 4.068 2.297 5.338 . 0 0 "[ . 1 . 2]" 1
1988 1 68 LYS H 1 68 LYS HA 2.860 . 2.860 2.827 2.776 2.886 0.026 6 0 "[ . 1 . 2]" 1
1989 1 68 LYS H 1 68 LYS HB3 2.740 . 2.740 2.583 2.337 2.775 0.035 6 0 "[ . 1 . 2]" 1
1990 1 68 LYS H 1 68 LYS HG2 2.880 . 2.880 1.964 1.789 2.339 0.011 6 0 "[ . 1 . 2]" 1
1991 1 68 LYS H 1 68 LYS HG3 3.640 . 3.640 3.287 3.083 3.622 . 0 0 "[ . 1 . 2]" 1
1992 1 68 LYS H 1 69 MET H 2.860 . 2.860 2.680 2.526 2.876 0.016 18 0 "[ . 1 . 2]" 1
1993 1 68 LYS H 1 69 MET QG 5.340 . 5.340 4.147 3.775 4.466 . 0 0 "[ . 1 . 2]" 1
1994 1 68 LYS H 1 71 LEU H 5.500 . 5.500 4.624 4.477 4.737 . 0 0 "[ . 1 . 2]" 1
1995 1 68 LYS H 1 71 LEU QD 5.440 . 5.440 4.046 3.799 4.289 . 0 0 "[ . 1 . 2]" 1
1996 1 68 LYS HA 1 68 LYS HG2 3.820 . 3.820 3.684 3.638 3.774 . 0 0 "[ . 1 . 2]" 1
1997 1 68 LYS HA 1 68 LYS HG3 3.960 . 3.960 3.846 3.801 3.904 . 0 0 "[ . 1 . 2]" 1
1998 1 68 LYS HA 1 71 LEU HB3 4.910 . 4.910 3.952 3.383 4.604 . 0 0 "[ . 1 . 2]" 1
1999 1 68 LYS HA 1 71 LEU QD 5.440 . 5.440 2.057 1.813 2.452 . 0 0 "[ . 1 . 2]" 1
2000 1 68 LYS HA 1 71 LEU HG 5.420 . 5.420 3.353 2.847 4.321 . 0 0 "[ . 1 . 2]" 1
2001 1 68 LYS HA 1 72 GLU H 5.500 . 5.500 5.514 5.299 5.638 0.138 6 0 "[ . 1 . 2]" 1
2002 1 68 LYS HB2 1 68 LYS QE 4.680 . 4.680 3.065 2.013 4.257 . 0 0 "[ . 1 . 2]" 1
2003 1 68 LYS HB2 1 69 MET H 4.100 . 4.100 4.022 3.594 4.168 0.068 6 0 "[ . 1 . 2]" 1
2004 1 68 LYS HB3 1 69 MET H 5.390 . 5.390 4.178 3.954 4.369 . 0 0 "[ . 1 . 2]" 1
2005 1 68 LYS HB3 1 70 SER H 5.500 . 5.500 5.570 5.513 5.634 0.134 4 0 "[ . 1 . 2]" 1
2006 1 68 LYS QD 1 69 MET H 5.200 . 5.200 4.623 4.043 5.131 . 0 0 "[ . 1 . 2]" 1
2007 1 68 LYS HG2 1 69 MET H 5.500 . 5.500 2.982 2.503 3.496 . 0 0 "[ . 1 . 2]" 1
2008 1 68 LYS HG2 1 69 MET QG 4.650 . 4.650 3.674 2.800 4.256 . 0 0 "[ . 1 . 2]" 1
2009 1 68 LYS HG2 1 70 SER H 5.500 . 5.500 4.708 4.152 5.243 . 0 0 "[ . 1 . 2]" 1
2010 1 68 LYS HG3 1 69 MET H 4.780 . 4.780 3.019 2.191 3.612 . 0 0 "[ . 1 . 2]" 1
2011 1 68 LYS HG3 1 69 MET HA 5.150 . 5.150 4.316 3.980 4.712 . 0 0 "[ . 1 . 2]" 1
2012 1 69 MET H 1 69 MET QB 3.160 . 3.160 2.807 2.459 3.045 . 0 0 "[ . 1 . 2]" 1
2013 1 69 MET H 1 69 MET HG2 3.300 . 3.300 2.582 2.210 3.399 0.099 2 0 "[ . 1 . 2]" 1
2014 1 69 MET H 1 69 MET QG 2.860 . 2.860 2.266 2.154 2.351 . 0 0 "[ . 1 . 2]" 1
2015 1 69 MET H 1 69 MET HG3 3.300 . 3.300 2.963 2.242 3.322 0.022 15 0 "[ . 1 . 2]" 1
2016 1 69 MET H 1 70 SER HA 5.500 . 5.500 4.607 4.454 4.689 . 0 0 "[ . 1 . 2]" 1
2017 1 69 MET H 1 70 SER QB 4.190 . 4.190 3.915 3.499 4.202 0.012 19 0 "[ . 1 . 2]" 1
2018 1 69 MET HA 1 69 MET HG2 4.060 . 4.060 3.513 2.582 3.870 . 0 0 "[ . 1 . 2]" 1
2019 1 69 MET HA 1 69 MET QG 3.510 . 3.510 3.156 2.484 3.387 . 0 0 "[ . 1 . 2]" 1
2020 1 69 MET HA 1 69 MET HG3 4.060 . 4.060 3.632 3.230 3.786 . 0 0 "[ . 1 . 2]" 1
2021 1 69 MET QB 1 71 LEU H 5.500 . 5.500 5.151 4.636 5.525 0.025 11 0 "[ . 1 . 2]" 1
2022 1 69 MET QG 1 70 SER H 4.240 . 4.240 3.057 2.388 3.913 . 0 0 "[ . 1 . 2]" 1
2023 1 69 MET HG2 1 70 SER H 5.110 . 5.110 3.638 2.755 4.871 . 0 0 "[ . 1 . 2]" 1
2024 1 69 MET HG3 1 70 SER H 5.110 . 5.110 3.322 2.562 4.123 . 0 0 "[ . 1 . 2]" 1
2025 1 70 SER H 1 70 SER QB 2.590 . 2.590 2.476 2.260 2.631 0.041 6 0 "[ . 1 . 2]" 1
2026 1 70 SER H 1 71 LEU HB3 5.500 . 5.500 4.519 4.002 4.888 . 0 0 "[ . 1 . 2]" 1
2027 1 70 SER H 1 71 LEU HG 5.500 . 5.500 4.106 3.326 5.267 . 0 0 "[ . 1 . 2]" 1
2028 1 70 SER H 1 72 GLU QB 5.340 . 5.340 5.080 4.654 5.351 0.011 11 0 "[ . 1 . 2]" 1
2029 1 70 SER HA 1 70 SER QB 2.710 . 2.710 2.362 2.305 2.423 . 0 0 "[ . 1 . 2]" 1
2030 1 70 SER HA 1 72 GLU H 5.500 . 5.500 3.845 3.483 4.162 . 0 0 "[ . 1 . 2]" 1
2031 1 70 SER HA 1 73 LYS QB 4.350 . 4.350 3.292 2.689 4.269 . 0 0 "[ . 1 . 2]" 1
2032 1 70 SER HA 1 73 LYS QD 4.660 . 4.660 3.215 2.204 4.655 . 0 0 "[ . 1 . 2]" 1
2033 1 70 SER HA 1 73 LYS QG 5.500 . 5.500 3.149 1.858 3.890 . 0 0 "[ . 1 . 2]" 1
2034 1 70 SER QB 1 71 LEU H 3.260 . 3.260 2.995 2.571 3.284 0.024 6 0 "[ . 1 . 2]" 1
2035 1 70 SER QB 1 71 LEU HA 5.500 . 5.500 4.084 3.844 4.301 . 0 0 "[ . 1 . 2]" 1
2036 1 70 SER QB 1 71 LEU HB3 4.980 . 4.980 4.578 4.134 5.000 0.020 10 0 "[ . 1 . 2]" 1
2037 1 70 SER QB 1 72 GLU H 5.500 . 5.500 4.722 4.450 4.958 . 0 0 "[ . 1 . 2]" 1
2038 1 70 SER QB 1 73 LYS H 5.500 . 5.500 4.660 4.062 5.122 . 0 0 "[ . 1 . 2]" 1
2039 1 70 SER QB 1 73 LYS QB 5.340 . 5.340 4.488 3.284 5.400 0.060 6 0 "[ . 1 . 2]" 1
2040 1 71 LEU H 1 71 LEU HB2 3.670 . 3.670 3.543 3.503 3.573 . 0 0 "[ . 1 . 2]" 1
2041 1 71 LEU H 1 71 LEU HB3 2.410 . 2.410 2.399 2.331 2.440 0.030 6 0 "[ . 1 . 2]" 1
2042 1 71 LEU H 1 71 LEU QD 3.810 . 3.810 2.941 2.103 3.095 . 0 0 "[ . 1 . 2]" 1
2043 1 71 LEU H 1 72 GLU H 2.870 . 2.870 2.704 2.469 2.916 0.046 5 0 "[ . 1 . 2]" 1
2044 1 71 LEU H 1 72 GLU QB 5.340 . 5.340 4.357 4.135 4.662 . 0 0 "[ . 1 . 2]" 1
2045 1 71 LEU H 1 73 LYS H 4.810 . 4.810 4.272 4.030 4.440 . 0 0 "[ . 1 . 2]" 1
2046 1 71 LEU H 1 73 LYS QG 5.500 . 5.500 5.231 4.489 5.557 0.057 8 0 "[ . 1 . 2]" 1
2047 1 71 LEU HA 1 71 LEU MD1 4.250 . 4.250 3.696 3.619 3.752 . 0 0 "[ . 1 . 2]" 1
2048 1 71 LEU HA 1 71 LEU QD 3.480 . 3.480 3.429 3.251 3.473 . 0 0 "[ . 1 . 2]" 1
2049 1 71 LEU HA 1 71 LEU MD2 4.250 . 4.250 4.068 3.678 4.142 . 0 0 "[ . 1 . 2]" 1
2050 1 71 LEU HB2 1 71 LEU QD 3.040 . 3.040 2.192 2.136 2.287 . 0 0 "[ . 1 . 2]" 1
2051 1 71 LEU HB2 1 72 GLU H 4.500 . 4.500 3.877 3.766 4.015 . 0 0 "[ . 1 . 2]" 1
2052 1 71 LEU HB3 1 72 GLU H 4.420 . 4.420 3.919 3.721 4.075 . 0 0 "[ . 1 . 2]" 1
2053 1 71 LEU QD 1 72 GLU H 4.330 . 4.330 2.382 1.754 2.891 0.046 7 0 "[ . 1 . 2]" 1
2054 1 71 LEU QD 1 72 GLU HA 4.690 . 4.690 2.381 2.160 2.824 . 0 0 "[ . 1 . 2]" 1
2055 1 71 LEU MD1 1 72 GLU HA 5.500 . 5.500 2.519 2.163 3.981 . 0 0 "[ . 1 . 2]" 1
2056 1 71 LEU MD2 1 72 GLU HA 5.500 . 5.500 4.821 2.500 5.459 . 0 0 "[ . 1 . 2]" 1
2057 1 71 LEU HG 1 72 GLU H 4.640 . 4.640 2.632 1.914 4.259 . 0 0 "[ . 1 . 2]" 1
2058 1 72 GLU H 1 72 GLU QB 2.700 . 2.700 2.122 2.010 2.213 . 0 0 "[ . 1 . 2]" 1
2059 1 72 GLU H 1 72 GLU HG2 4.270 . 4.270 4.079 3.892 4.351 0.081 3 0 "[ . 1 . 2]" 1
2060 1 72 GLU H 1 72 GLU HG3 4.450 . 4.450 4.457 4.107 4.513 0.063 6 0 "[ . 1 . 2]" 1
2061 1 72 GLU HA 1 72 GLU QB 2.520 . 2.520 2.220 2.176 2.258 . 0 0 "[ . 1 . 2]" 1
2062 1 72 GLU HA 1 72 GLU HG2 3.800 . 3.800 3.528 3.404 3.826 0.026 3 0 "[ . 1 . 2]" 1
2063 1 72 GLU HA 1 72 GLU HG3 2.910 . 2.910 2.833 2.688 2.950 0.040 19 0 "[ . 1 . 2]" 1
2064 1 72 GLU QB 1 72 GLU HG3 2.580 . 2.580 2.416 2.363 2.447 . 0 0 "[ . 1 . 2]" 1
2065 1 72 GLU QB 1 73 LYS H 4.070 . 4.070 2.753 2.477 3.039 . 0 0 "[ . 1 . 2]" 1
2066 1 72 GLU HG2 1 73 LYS HA 3.980 . 3.980 3.161 2.800 4.130 0.150 3 0 "[ . 1 . 2]" 1
2067 1 72 GLU HG2 1 73 LYS QG 4.580 . 4.580 2.876 2.147 4.160 . 0 0 "[ . 1 . 2]" 1
2068 1 72 GLU HG3 1 73 LYS H 5.500 . 5.500 4.203 3.510 4.446 . 0 0 "[ . 1 . 2]" 1
2069 1 72 GLU HG3 1 73 LYS HA 3.910 . 3.910 3.963 3.082 4.064 0.154 19 0 "[ . 1 . 2]" 1
2070 1 73 LYS H 1 73 LYS HB2 3.710 . 3.710 2.712 2.444 3.694 . 0 0 "[ . 1 . 2]" 1
2071 1 73 LYS H 1 73 LYS QB 2.910 . 2.910 2.548 2.404 2.871 . 0 0 "[ . 1 . 2]" 1
2072 1 73 LYS H 1 73 LYS HB3 3.710 . 3.710 3.514 2.860 3.664 . 0 0 "[ . 1 . 2]" 1
2073 1 73 LYS H 1 73 LYS QG 3.670 . 3.670 2.190 1.872 2.458 . 0 0 "[ . 1 . 2]" 1
2074 1 73 LYS H 1 74 ALA H 2.890 . 2.890 2.523 2.184 2.963 0.073 3 0 "[ . 1 . 2]" 1
2075 1 73 LYS HA 1 73 LYS QB 2.560 . 2.560 2.318 2.151 2.392 . 0 0 "[ . 1 . 2]" 1
2076 1 73 LYS HA 1 74 ALA MB 4.340 . 4.340 4.306 4.095 4.501 0.161 10 0 "[ . 1 . 2]" 1
2077 1 73 LYS QB 1 74 ALA H 4.280 . 4.280 2.694 1.763 3.946 0.037 12 0 "[ . 1 . 2]" 1
2078 1 73 LYS QB 1 74 ALA MB 4.690 . 4.690 3.869 3.058 4.732 0.042 2 0 "[ . 1 . 2]" 1
2079 1 73 LYS HB2 1 74 ALA H 5.010 . 5.010 2.796 1.772 4.360 0.028 12 0 "[ . 1 . 2]" 1
2080 1 73 LYS HB3 1 74 ALA H 5.010 . 5.010 3.741 2.761 4.507 . 0 0 "[ . 1 . 2]" 1
2081 1 73 LYS QD 1 73 LYS QG 2.400 . 2.400 2.052 2.005 2.102 . 0 0 "[ . 1 . 2]" 1
2082 1 74 ALA H 1 74 ALA MB 3.370 . 3.370 2.728 2.123 3.042 . 0 0 "[ . 1 . 2]" 1
stop_
save_
Contact the webmaster for help, if required. Tuesday, May 14, 2024 7:13:51 AM GMT (wattos1)