NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
459970 |
1x43   |
11209 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1x43
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 1693
_Distance_constraint_stats_list.Viol_count 824
_Distance_constraint_stats_list.Viol_total 161.677
_Distance_constraint_stats_list.Viol_max 0.140
_Distance_constraint_stats_list.Viol_rms 0.0031
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0002
_Distance_constraint_stats_list.Viol_average_violations_only 0.0098
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 8 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 LEU 0.050 0.026 20 0 "[ . 1 . 2]"
1 12 LYS 0.112 0.112 18 0 "[ . 1 . 2]"
1 13 GLU 0.001 0.001 15 0 "[ . 1 . 2]"
1 17 ASN 0.001 0.001 12 0 "[ . 1 . 2]"
1 18 ARG 0.055 0.029 11 0 "[ . 1 . 2]"
1 19 LYS 0.155 0.019 9 0 "[ . 1 . 2]"
1 20 ALA 0.090 0.012 9 0 "[ . 1 . 2]"
1 21 ARG 0.367 0.140 20 0 "[ . 1 . 2]"
1 22 VAL 0.355 0.035 10 0 "[ . 1 . 2]"
1 23 LEU 0.059 0.006 5 0 "[ . 1 . 2]"
1 24 TYR 0.015 0.005 5 0 "[ . 1 . 2]"
1 25 ASP 0.042 0.006 15 0 "[ . 1 . 2]"
1 26 TYR 0.182 0.040 13 0 "[ . 1 . 2]"
1 27 ASP 0.444 0.057 6 0 "[ . 1 . 2]"
1 28 ALA 0.031 0.007 15 0 "[ . 1 . 2]"
1 29 ALA 0.013 0.007 19 0 "[ . 1 . 2]"
1 30 ASN 0.065 0.049 18 0 "[ . 1 . 2]"
1 31 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 THR 0.155 0.049 18 0 "[ . 1 . 2]"
1 33 GLU 1.609 0.077 18 0 "[ . 1 . 2]"
1 34 LEU 1.603 0.077 18 0 "[ . 1 . 2]"
1 35 SER 0.128 0.013 14 0 "[ . 1 . 2]"
1 36 LEU 0.060 0.013 14 0 "[ . 1 . 2]"
1 37 LEU 0.178 0.013 8 0 "[ . 1 . 2]"
1 38 ALA 0.152 0.018 9 0 "[ . 1 . 2]"
1 39 ASP 0.186 0.013 6 0 "[ . 1 . 2]"
1 40 GLU 0.280 0.018 9 0 "[ . 1 . 2]"
1 41 VAL 0.422 0.035 10 0 "[ . 1 . 2]"
1 42 ILE 0.070 0.009 3 0 "[ . 1 . 2]"
1 43 THR 0.083 0.007 17 0 "[ . 1 . 2]"
1 44 VAL 0.085 0.029 11 0 "[ . 1 . 2]"
1 45 PHE 0.439 0.026 11 0 "[ . 1 . 2]"
1 46 SER 0.028 0.013 10 0 "[ . 1 . 2]"
1 47 VAL 0.136 0.017 8 0 "[ . 1 . 2]"
1 48 VAL 0.092 0.017 8 0 "[ . 1 . 2]"
1 49 GLY 0.047 0.013 20 0 "[ . 1 . 2]"
1 50 MET 1.773 0.126 19 0 "[ . 1 . 2]"
1 51 ASP 1.650 0.126 19 0 "[ . 1 . 2]"
1 52 SER 0.032 0.016 11 0 "[ . 1 . 2]"
1 53 ASP 0.099 0.011 20 0 "[ . 1 . 2]"
1 54 TRP 0.836 0.023 15 0 "[ . 1 . 2]"
1 55 LEU 0.011 0.003 1 0 "[ . 1 . 2]"
1 56 MET 0.288 0.026 11 0 "[ . 1 . 2]"
1 57 GLY 0.164 0.026 15 0 "[ . 1 . 2]"
1 58 GLU 0.143 0.031 17 0 "[ . 1 . 2]"
1 59 ARG 0.134 0.032 17 0 "[ . 1 . 2]"
1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 GLN 0.069 0.032 17 0 "[ . 1 . 2]"
1 63 LYS 0.153 0.031 17 0 "[ . 1 . 2]"
1 64 GLY 0.102 0.012 5 0 "[ . 1 . 2]"
1 65 LYS 0.445 0.023 15 0 "[ . 1 . 2]"
1 66 VAL 0.025 0.009 14 0 "[ . 1 . 2]"
1 67 PRO 0.367 0.013 15 0 "[ . 1 . 2]"
1 68 ILE 0.323 0.019 14 0 "[ . 1 . 2]"
1 69 THR 0.118 0.020 9 0 "[ . 1 . 2]"
1 70 TYR 0.051 0.008 5 0 "[ . 1 . 2]"
1 71 LEU 0.194 0.017 14 0 "[ . 1 . 2]"
1 72 GLU 0.026 0.004 5 0 "[ . 1 . 2]"
1 73 LEU 0.016 0.003 13 0 "[ . 1 . 2]"
1 74 LEU 0.008 0.004 20 0 "[ . 1 . 2]"
1 77 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 LEU H 1 8 LEU HG . . 5.020 3.290 1.929 4.666 . 0 0 "[ . 1 . 2]" 1
2 1 10 ASP HA 1 11 LEU H . . 3.300 2.329 2.139 2.773 . 0 0 "[ . 1 . 2]" 1
3 1 10 ASP HA 1 11 LEU QD . . 4.740 3.963 2.599 4.628 . 0 0 "[ . 1 . 2]" 1
4 1 10 ASP QB 1 11 LEU H . . 4.080 3.199 2.049 3.904 . 0 0 "[ . 1 . 2]" 1
5 1 10 ASP HB2 1 11 LEU H . . 4.690 3.745 2.069 4.570 . 0 0 "[ . 1 . 2]" 1
6 1 10 ASP HB3 1 11 LEU H . . 4.690 3.768 2.502 4.495 . 0 0 "[ . 1 . 2]" 1
7 1 11 LEU H 1 11 LEU HB2 . . 3.860 2.508 2.187 3.427 . 0 0 "[ . 1 . 2]" 1
8 1 11 LEU H 1 11 LEU QB . . 3.190 2.462 2.166 3.214 0.024 20 0 "[ . 1 . 2]" 1
9 1 11 LEU H 1 11 LEU HB3 . . 3.860 3.661 3.497 3.886 0.026 20 0 "[ . 1 . 2]" 1
10 1 11 LEU H 1 11 LEU MD1 . . 5.120 3.228 1.966 4.110 . 0 0 "[ . 1 . 2]" 1
11 1 11 LEU H 1 11 LEU QD . . 4.470 2.959 1.962 3.616 . 0 0 "[ . 1 . 2]" 1
12 1 11 LEU H 1 11 LEU MD2 . . 5.120 4.010 2.843 4.513 . 0 0 "[ . 1 . 2]" 1
13 1 11 LEU H 1 11 LEU HG . . 4.220 3.248 2.411 4.204 . 0 0 "[ . 1 . 2]" 1
14 1 11 LEU HA 1 11 LEU MD1 . . 4.630 3.560 2.899 3.951 . 0 0 "[ . 1 . 2]" 1
15 1 11 LEU HA 1 11 LEU QD . . 3.100 2.480 2.026 3.075 . 0 0 "[ . 1 . 2]" 1
16 1 11 LEU HA 1 11 LEU MD2 . . 4.630 2.780 2.032 3.684 . 0 0 "[ . 1 . 2]" 1
17 1 11 LEU HA 1 11 LEU HG . . 3.470 2.722 2.296 3.208 . 0 0 "[ . 1 . 2]" 1
18 1 11 LEU HA 1 12 LYS H . . 3.390 2.329 2.141 2.810 . 0 0 "[ . 1 . 2]" 1
19 1 11 LEU QB 1 12 LYS H . . 4.370 3.250 2.240 3.864 . 0 0 "[ . 1 . 2]" 1
20 1 11 LEU HB2 1 12 LYS H . . 5.040 4.186 3.409 4.567 . 0 0 "[ . 1 . 2]" 1
21 1 11 LEU HB3 1 12 LYS H . . 5.040 3.448 2.265 4.471 . 0 0 "[ . 1 . 2]" 1
22 1 12 LYS H 1 12 LYS QB . . 3.560 2.587 2.235 3.248 . 0 0 "[ . 1 . 2]" 1
23 1 12 LYS H 1 12 LYS QD . . 5.390 4.112 2.284 4.708 . 0 0 "[ . 1 . 2]" 1
24 1 12 LYS H 1 12 LYS QG . . 4.440 3.061 1.982 4.301 . 0 0 "[ . 1 . 2]" 1
25 1 12 LYS HA 1 12 LYS QD . . 4.310 3.459 2.071 4.280 . 0 0 "[ . 1 . 2]" 1
26 1 12 LYS HA 1 12 LYS HG2 . . 4.070 3.061 2.267 3.921 . 0 0 "[ . 1 . 2]" 1
27 1 12 LYS HA 1 12 LYS QG . . 3.530 2.691 2.212 3.383 . 0 0 "[ . 1 . 2]" 1
28 1 12 LYS HA 1 12 LYS HG3 . . 4.070 3.295 2.252 4.182 0.112 18 0 "[ . 1 . 2]" 1
29 1 13 GLU HA 1 13 GLU QG . . 3.520 2.764 2.235 3.521 0.001 15 0 "[ . 1 . 2]" 1
30 1 13 GLU QB 1 13 GLU QG . . 2.280 2.049 1.981 2.087 . 0 0 "[ . 1 . 2]" 1
31 1 13 GLU HB2 1 13 GLU QG . . 2.750 2.303 2.142 2.471 . 0 0 "[ . 1 . 2]" 1
32 1 13 GLU HB3 1 13 GLU QG . . 2.750 2.325 2.159 2.465 . 0 0 "[ . 1 . 2]" 1
33 1 17 ASN H 1 18 ARG H . . 5.470 4.422 4.253 4.613 . 0 0 "[ . 1 . 2]" 1
34 1 17 ASN HA 1 18 ARG H . . 2.810 2.450 2.271 2.615 . 0 0 "[ . 1 . 2]" 1
35 1 17 ASN HA 1 18 ARG QG . . 4.460 4.126 3.788 4.256 . 0 0 "[ . 1 . 2]" 1
36 1 17 ASN HA 1 43 THR MG . . 4.350 3.990 3.731 4.272 . 0 0 "[ . 1 . 2]" 1
37 1 17 ASN HA 1 45 PHE HB3 . . 3.560 3.051 2.620 3.532 . 0 0 "[ . 1 . 2]" 1
38 1 17 ASN QB 1 18 ARG QB . . 5.180 4.195 3.906 4.448 . 0 0 "[ . 1 . 2]" 1
39 1 17 ASN QB 1 43 THR HB . . 4.670 4.314 4.187 4.402 . 0 0 "[ . 1 . 2]" 1
40 1 17 ASN QB 1 43 THR MG . . 3.190 1.792 1.711 1.847 . 0 0 "[ . 1 . 2]" 1
41 1 17 ASN HB2 1 18 ARG H . . 3.890 2.872 2.227 3.569 . 0 0 "[ . 1 . 2]" 1
42 1 17 ASN HB2 1 43 THR HB . . 5.480 4.591 4.502 4.729 . 0 0 "[ . 1 . 2]" 1
43 1 17 ASN HB2 1 43 THR MG . . 3.700 1.850 1.780 1.926 . 0 0 "[ . 1 . 2]" 1
44 1 17 ASN HB2 1 45 PHE HB3 . . 4.840 3.820 3.409 4.343 . 0 0 "[ . 1 . 2]" 1
45 1 17 ASN HB2 1 45 PHE QD . . 5.250 4.062 3.805 4.424 . 0 0 "[ . 1 . 2]" 1
46 1 17 ASN HB2 1 45 PHE QE . . 5.500 5.439 5.205 5.501 0.001 12 0 "[ . 1 . 2]" 1
47 1 17 ASN HB3 1 18 ARG H . . 3.890 2.970 2.114 3.771 . 0 0 "[ . 1 . 2]" 1
48 1 17 ASN HB3 1 43 THR HB . . 5.480 5.265 4.835 5.467 . 0 0 "[ . 1 . 2]" 1
49 1 17 ASN HB3 1 43 THR MG . . 3.700 2.485 1.935 2.810 . 0 0 "[ . 1 . 2]" 1
50 1 17 ASN HB3 1 45 PHE HB3 . . 4.840 2.964 2.011 3.968 . 0 0 "[ . 1 . 2]" 1
51 1 17 ASN HB3 1 45 PHE QD . . 5.250 3.650 2.846 4.461 . 0 0 "[ . 1 . 2]" 1
52 1 17 ASN HB3 1 45 PHE QE . . 5.500 5.080 4.609 5.495 . 0 0 "[ . 1 . 2]" 1
53 1 17 ASN QD 1 43 THR MG . . 4.120 2.659 1.842 3.430 . 0 0 "[ . 1 . 2]" 1
54 1 18 ARG H 1 18 ARG HB2 . . 3.880 2.290 2.214 2.489 . 0 0 "[ . 1 . 2]" 1
55 1 18 ARG H 1 18 ARG QB . . 3.260 2.263 2.192 2.448 . 0 0 "[ . 1 . 2]" 1
56 1 18 ARG H 1 18 ARG HB3 . . 3.880 3.538 3.497 3.635 . 0 0 "[ . 1 . 2]" 1
57 1 18 ARG H 1 18 ARG QD . . 4.740 4.527 4.292 4.717 . 0 0 "[ . 1 . 2]" 1
58 1 18 ARG H 1 18 ARG QG . . 3.550 3.116 2.755 3.416 . 0 0 "[ . 1 . 2]" 1
59 1 18 ARG H 1 43 THR HA . . 5.220 4.932 4.301 5.220 0.000 9 0 "[ . 1 . 2]" 1
60 1 18 ARG H 1 43 THR MG . . 4.010 3.366 2.830 3.672 . 0 0 "[ . 1 . 2]" 1
61 1 18 ARG H 1 44 VAL MG2 . . 4.010 3.421 3.178 3.618 . 0 0 "[ . 1 . 2]" 1
62 1 18 ARG H 1 45 PHE HB3 . . 4.810 3.032 2.746 3.264 . 0 0 "[ . 1 . 2]" 1
63 1 18 ARG HA 1 18 ARG QD . . 3.740 3.200 1.996 3.743 0.003 11 0 "[ . 1 . 2]" 1
64 1 18 ARG HA 1 18 ARG QG . . 3.150 2.280 2.129 2.583 . 0 0 "[ . 1 . 2]" 1
65 1 18 ARG HA 1 19 LYS H . . 2.720 2.405 2.329 2.489 . 0 0 "[ . 1 . 2]" 1
66 1 18 ARG HA 1 19 LYS HG3 . . 5.200 4.928 4.866 5.066 . 0 0 "[ . 1 . 2]" 1
67 1 18 ARG HA 1 44 VAL MG2 . . 4.630 4.038 3.762 4.231 . 0 0 "[ . 1 . 2]" 1
68 1 18 ARG QB 1 18 ARG QD . . 3.250 2.138 2.050 2.291 . 0 0 "[ . 1 . 2]" 1
69 1 18 ARG QB 1 19 LYS H . . 3.260 2.449 2.262 2.627 . 0 0 "[ . 1 . 2]" 1
70 1 18 ARG QB 1 44 VAL H . . 4.490 3.635 3.548 3.747 . 0 0 "[ . 1 . 2]" 1
71 1 18 ARG QB 1 44 VAL MG2 . . 3.100 2.137 1.948 2.283 . 0 0 "[ . 1 . 2]" 1
72 1 18 ARG QB 1 73 LEU MD1 . . 4.570 3.790 3.691 3.983 . 0 0 "[ . 1 . 2]" 1
73 1 18 ARG QB 1 73 LEU MD2 . . 3.700 3.338 3.191 3.439 . 0 0 "[ . 1 . 2]" 1
74 1 18 ARG HB2 1 18 ARG QD . . 3.860 2.908 2.572 3.314 . 0 0 "[ . 1 . 2]" 1
75 1 18 ARG HB2 1 19 LYS H . . 3.990 3.844 3.562 3.978 . 0 0 "[ . 1 . 2]" 1
76 1 18 ARG HB2 1 44 VAL MG2 . . 3.730 2.371 2.148 2.579 . 0 0 "[ . 1 . 2]" 1
77 1 18 ARG HB2 1 73 LEU MD2 . . 4.550 4.349 3.855 4.551 0.001 4 0 "[ . 1 . 2]" 1
78 1 18 ARG HB3 1 18 ARG QD . . 3.860 2.215 2.095 2.337 . 0 0 "[ . 1 . 2]" 1
79 1 18 ARG HB3 1 19 LYS H . . 3.990 2.478 2.282 2.665 . 0 0 "[ . 1 . 2]" 1
80 1 18 ARG HB3 1 44 VAL MG2 . . 3.730 2.460 2.143 2.886 . 0 0 "[ . 1 . 2]" 1
81 1 18 ARG HB3 1 73 LEU MD2 . . 4.550 3.471 3.304 3.567 . 0 0 "[ . 1 . 2]" 1
82 1 18 ARG QD 1 19 LYS H . . 4.190 3.366 2.516 4.013 . 0 0 "[ . 1 . 2]" 1
83 1 18 ARG QD 1 44 VAL MG2 . . 4.100 3.609 3.198 4.091 . 0 0 "[ . 1 . 2]" 1
84 1 18 ARG QD 1 73 LEU HB3 . . 5.160 3.694 3.385 4.155 . 0 0 "[ . 1 . 2]" 1
85 1 18 ARG QD 1 73 LEU MD1 . . 4.130 2.825 2.420 3.624 . 0 0 "[ . 1 . 2]" 1
86 1 18 ARG QD 1 73 LEU MD2 . . 3.970 3.477 3.109 3.928 . 0 0 "[ . 1 . 2]" 1
87 1 18 ARG QG 1 19 LYS H . . 4.120 3.672 3.346 4.037 . 0 0 "[ . 1 . 2]" 1
88 1 18 ARG QG 1 44 VAL H . . 5.500 5.488 5.403 5.529 0.029 11 0 "[ . 1 . 2]" 1
89 1 18 ARG QG 1 73 LEU MD1 . . 4.590 4.246 3.656 4.563 . 0 0 "[ . 1 . 2]" 1
90 1 18 ARG QG 1 73 LEU MD2 . . 5.000 4.645 4.190 4.909 . 0 0 "[ . 1 . 2]" 1
91 1 19 LYS H 1 19 LYS HB2 . . 3.090 2.643 2.538 2.728 . 0 0 "[ . 1 . 2]" 1
92 1 19 LYS H 1 19 LYS HB3 . . 3.810 3.777 3.704 3.829 0.019 9 0 "[ . 1 . 2]" 1
93 1 19 LYS H 1 19 LYS HD2 . . 5.440 5.159 4.608 5.327 . 0 0 "[ . 1 . 2]" 1
94 1 19 LYS H 1 19 LYS QD . . 4.640 4.486 4.285 4.546 . 0 0 "[ . 1 . 2]" 1
95 1 19 LYS H 1 19 LYS HD3 . . 5.440 4.956 4.831 5.329 . 0 0 "[ . 1 . 2]" 1
96 1 19 LYS H 1 19 LYS HG2 . . 3.770 3.235 3.067 3.354 . 0 0 "[ . 1 . 2]" 1
97 1 19 LYS H 1 19 LYS HG3 . . 4.150 4.113 4.058 4.165 0.015 11 0 "[ . 1 . 2]" 1
98 1 19 LYS H 1 20 ALA H . . 4.630 4.382 4.330 4.446 . 0 0 "[ . 1 . 2]" 1
99 1 19 LYS H 1 20 ALA HA . . 5.060 4.981 4.936 5.072 0.012 9 0 "[ . 1 . 2]" 1
100 1 19 LYS H 1 44 VAL MG2 . . 4.490 3.549 3.173 3.810 . 0 0 "[ . 1 . 2]" 1
101 1 19 LYS H 1 73 LEU MD1 . . 5.500 5.397 5.179 5.502 0.002 1 0 "[ . 1 . 2]" 1
102 1 19 LYS H 1 74 LEU MD1 . . 5.500 5.424 5.200 5.500 . 0 0 "[ . 1 . 2]" 1
103 1 19 LYS HA 1 19 LYS HD2 . . 3.530 3.092 2.259 3.438 . 0 0 "[ . 1 . 2]" 1
104 1 19 LYS HA 1 19 LYS HD3 . . 3.530 2.799 2.551 3.544 0.014 12 0 "[ . 1 . 2]" 1
105 1 19 LYS HA 1 19 LYS HG2 . . 3.590 2.663 2.568 2.851 . 0 0 "[ . 1 . 2]" 1
106 1 19 LYS HA 1 19 LYS HG3 . . 3.890 3.746 3.697 3.796 . 0 0 "[ . 1 . 2]" 1
107 1 19 LYS HA 1 20 ALA H . . 2.670 2.211 2.155 2.410 . 0 0 "[ . 1 . 2]" 1
108 1 19 LYS HA 1 20 ALA MB . . 4.100 3.847 3.797 3.933 . 0 0 "[ . 1 . 2]" 1
109 1 19 LYS HA 1 41 VAL QG . . 4.000 3.534 3.332 3.844 . 0 0 "[ . 1 . 2]" 1
110 1 19 LYS HA 1 43 THR HA . . 3.040 2.935 2.655 3.013 . 0 0 "[ . 1 . 2]" 1
111 1 19 LYS HA 1 43 THR MG . . 4.470 4.417 4.083 4.473 0.003 20 0 "[ . 1 . 2]" 1
112 1 19 LYS HA 1 44 VAL H . . 3.780 2.956 2.475 3.205 . 0 0 "[ . 1 . 2]" 1
113 1 19 LYS HA 1 44 VAL MG1 . . 4.580 4.016 3.479 4.227 . 0 0 "[ . 1 . 2]" 1
114 1 19 LYS HA 1 44 VAL MG2 . . 4.150 3.029 2.683 3.234 . 0 0 "[ . 1 . 2]" 1
115 1 19 LYS HA 1 74 LEU MD1 . . 5.240 5.100 4.721 5.239 . 0 0 "[ . 1 . 2]" 1
116 1 19 LYS HB2 1 20 ALA H . . 4.330 4.089 3.590 4.308 . 0 0 "[ . 1 . 2]" 1
117 1 19 LYS HB2 1 41 VAL QG . . 4.270 3.832 3.484 4.125 . 0 0 "[ . 1 . 2]" 1
118 1 19 LYS HB2 1 74 LEU MD1 . . 4.100 3.877 3.488 4.055 . 0 0 "[ . 1 . 2]" 1
119 1 19 LYS HB3 1 19 LYS QD . . 3.040 2.117 2.059 2.411 . 0 0 "[ . 1 . 2]" 1
120 1 19 LYS HB3 1 19 LYS HG3 . . 2.780 2.627 2.572 2.637 . 0 0 "[ . 1 . 2]" 1
121 1 19 LYS HB3 1 20 ALA H . . 3.310 3.007 2.419 3.302 . 0 0 "[ . 1 . 2]" 1
122 1 19 LYS HB3 1 20 ALA HA . . 4.930 4.283 4.170 4.353 . 0 0 "[ . 1 . 2]" 1
123 1 19 LYS HB3 1 41 VAL QG . . 2.930 2.511 2.203 2.802 . 0 0 "[ . 1 . 2]" 1
124 1 19 LYS HB3 1 43 THR HA . . 5.500 4.756 4.235 4.982 . 0 0 "[ . 1 . 2]" 1
125 1 19 LYS QD 1 19 LYS HG2 . . 2.590 2.214 2.153 2.285 . 0 0 "[ . 1 . 2]" 1
126 1 19 LYS QD 1 20 ALA H . . 3.950 3.541 3.371 3.642 . 0 0 "[ . 1 . 2]" 1
127 1 19 LYS QD 1 41 VAL QG . . 3.340 2.360 2.079 3.219 . 0 0 "[ . 1 . 2]" 1
128 1 19 LYS QD 1 43 THR HA . . 3.570 2.390 2.033 2.622 . 0 0 "[ . 1 . 2]" 1
129 1 19 LYS HD2 1 43 THR HA . . 4.370 3.803 2.094 4.267 . 0 0 "[ . 1 . 2]" 1
130 1 19 LYS HD3 1 43 THR HA . . 4.370 2.478 2.218 2.752 . 0 0 "[ . 1 . 2]" 1
131 1 19 LYS QE 1 19 LYS HG2 . . 3.780 2.829 2.613 3.475 . 0 0 "[ . 1 . 2]" 1
132 1 19 LYS QE 1 19 LYS HG3 . . 3.470 2.400 2.148 2.625 . 0 0 "[ . 1 . 2]" 1
133 1 19 LYS QE 1 41 VAL QG . . 3.710 3.439 2.211 3.676 . 0 0 "[ . 1 . 2]" 1
134 1 19 LYS QE 1 43 THR HA . . 5.030 4.058 3.664 4.359 . 0 0 "[ . 1 . 2]" 1
135 1 19 LYS QE 1 43 THR MG . . 4.480 4.279 3.821 4.487 0.007 11 0 "[ . 1 . 2]" 1
136 1 19 LYS HG2 1 20 ALA H . . 4.710 4.676 4.619 4.720 0.010 11 0 "[ . 1 . 2]" 1
137 1 19 LYS HG2 1 41 VAL QG . . 5.040 4.470 4.254 4.826 . 0 0 "[ . 1 . 2]" 1
138 1 19 LYS HG2 1 43 THR HA . . 4.280 3.600 3.259 3.777 . 0 0 "[ . 1 . 2]" 1
139 1 19 LYS HG3 1 20 ALA H . . 5.500 5.269 4.886 5.382 . 0 0 "[ . 1 . 2]" 1
140 1 19 LYS HG3 1 43 THR HA . . 5.290 4.973 4.593 5.211 . 0 0 "[ . 1 . 2]" 1
141 1 20 ALA H 1 20 ALA MB . . 3.060 2.682 2.618 2.891 . 0 0 "[ . 1 . 2]" 1
142 1 20 ALA H 1 41 VAL QG . . 3.330 2.555 2.371 3.120 . 0 0 "[ . 1 . 2]" 1
143 1 20 ALA H 1 43 THR HA . . 4.310 4.279 4.090 4.317 0.007 17 0 "[ . 1 . 2]" 1
144 1 20 ALA H 1 44 VAL MG1 . . 4.340 3.563 3.370 3.850 . 0 0 "[ . 1 . 2]" 1
145 1 20 ALA H 1 44 VAL MG2 . . 4.030 3.204 2.853 3.451 . 0 0 "[ . 1 . 2]" 1
146 1 20 ALA H 1 73 LEU HA . . 5.150 4.854 4.551 5.081 . 0 0 "[ . 1 . 2]" 1
147 1 20 ALA H 1 74 LEU MD1 . . 4.520 4.239 3.618 4.428 . 0 0 "[ . 1 . 2]" 1
148 1 20 ALA HA 1 21 ARG H . . 2.660 2.286 2.218 2.346 . 0 0 "[ . 1 . 2]" 1
149 1 20 ALA HA 1 44 VAL MG2 . . 4.450 4.353 4.196 4.458 0.008 11 0 "[ . 1 . 2]" 1
150 1 20 ALA HA 1 73 LEU H . . 4.800 4.658 4.301 4.803 0.003 14 0 "[ . 1 . 2]" 1
151 1 20 ALA HA 1 73 LEU HA . . 3.020 2.626 2.257 2.771 . 0 0 "[ . 1 . 2]" 1
152 1 20 ALA HA 1 73 LEU HB3 . . 5.280 4.847 4.490 5.008 . 0 0 "[ . 1 . 2]" 1
153 1 20 ALA HA 1 73 LEU MD2 . . 3.840 3.486 3.158 3.808 . 0 0 "[ . 1 . 2]" 1
154 1 20 ALA HA 1 74 LEU H . . 3.180 2.388 2.035 2.611 . 0 0 "[ . 1 . 2]" 1
155 1 20 ALA HA 1 74 LEU HB2 . . 4.730 4.183 3.722 4.404 . 0 0 "[ . 1 . 2]" 1
156 1 20 ALA HA 1 74 LEU HB3 . . 5.500 5.208 4.788 5.400 . 0 0 "[ . 1 . 2]" 1
157 1 20 ALA HA 1 74 LEU MD1 . . 3.690 3.111 2.912 3.409 . 0 0 "[ . 1 . 2]" 1
158 1 20 ALA HA 1 74 LEU MD2 . . 4.150 3.897 3.601 4.122 . 0 0 "[ . 1 . 2]" 1
159 1 20 ALA HA 1 74 LEU HG . . 3.180 2.417 2.024 2.657 . 0 0 "[ . 1 . 2]" 1
160 1 20 ALA MB 1 21 ARG H . . 3.200 2.735 2.587 2.897 . 0 0 "[ . 1 . 2]" 1
161 1 20 ALA MB 1 44 VAL H . . 4.780 4.645 4.527 4.781 0.001 12 0 "[ . 1 . 2]" 1
162 1 20 ALA MB 1 44 VAL MG1 . . 2.910 2.675 2.479 2.918 0.008 11 0 "[ . 1 . 2]" 1
163 1 20 ALA MB 1 44 VAL MG2 . . 2.510 2.251 2.091 2.450 . 0 0 "[ . 1 . 2]" 1
164 1 20 ALA MB 1 71 LEU H . . 5.260 5.168 5.049 5.256 . 0 0 "[ . 1 . 2]" 1
165 1 20 ALA MB 1 71 LEU HA . . 4.030 3.616 3.437 3.782 . 0 0 "[ . 1 . 2]" 1
166 1 20 ALA MB 1 71 LEU MD2 . . 3.070 2.888 2.743 3.061 . 0 0 "[ . 1 . 2]" 1
167 1 20 ALA MB 1 72 GLU H . . 3.910 2.798 2.572 2.957 . 0 0 "[ . 1 . 2]" 1
168 1 20 ALA MB 1 73 LEU H . . 4.250 2.912 2.675 3.234 . 0 0 "[ . 1 . 2]" 1
169 1 20 ALA MB 1 73 LEU HA . . 3.230 1.977 1.907 2.100 . 0 0 "[ . 1 . 2]" 1
170 1 20 ALA MB 1 73 LEU MD2 . . 2.700 1.789 1.671 1.893 . 0 0 "[ . 1 . 2]" 1
171 1 20 ALA MB 1 73 LEU HG . . 4.490 3.631 3.434 3.811 . 0 0 "[ . 1 . 2]" 1
172 1 20 ALA MB 1 74 LEU H . . 3.990 3.271 2.981 3.462 . 0 0 "[ . 1 . 2]" 1
173 1 21 ARG H 1 21 ARG HB2 . . 3.480 3.019 2.802 3.182 . 0 0 "[ . 1 . 2]" 1
174 1 21 ARG H 1 21 ARG HB3 . . 3.170 2.380 2.296 2.589 . 0 0 "[ . 1 . 2]" 1
175 1 21 ARG H 1 21 ARG QD . . 5.270 4.587 3.848 4.878 . 0 0 "[ . 1 . 2]" 1
176 1 21 ARG H 1 21 ARG QG . . 4.270 3.929 3.796 4.083 . 0 0 "[ . 1 . 2]" 1
177 1 21 ARG H 1 23 LEU MD2 . . 5.200 4.620 4.432 4.888 . 0 0 "[ . 1 . 2]" 1
178 1 21 ARG H 1 41 VAL QG . . 5.030 3.382 3.014 4.180 . 0 0 "[ . 1 . 2]" 1
179 1 21 ARG H 1 71 LEU MD2 . . 5.500 4.951 4.585 5.151 . 0 0 "[ . 1 . 2]" 1
180 1 21 ARG H 1 72 GLU H . . 3.570 2.956 2.690 3.099 . 0 0 "[ . 1 . 2]" 1
181 1 21 ARG H 1 72 GLU HB2 . . 5.220 5.125 4.908 5.221 0.001 2 0 "[ . 1 . 2]" 1
182 1 21 ARG H 1 72 GLU HB3 . . 3.890 3.549 3.382 3.661 . 0 0 "[ . 1 . 2]" 1
183 1 21 ARG H 1 72 GLU HG2 . . 4.930 4.309 4.165 4.441 . 0 0 "[ . 1 . 2]" 1
184 1 21 ARG H 1 72 GLU HG3 . . 5.500 5.424 5.280 5.503 0.003 17 0 "[ . 1 . 2]" 1
185 1 21 ARG H 1 73 LEU HA . . 4.240 3.984 3.678 4.136 . 0 0 "[ . 1 . 2]" 1
186 1 21 ARG H 1 74 LEU H . . 4.080 3.673 3.255 3.899 . 0 0 "[ . 1 . 2]" 1
187 1 21 ARG H 1 74 LEU MD1 . . 3.730 3.310 3.096 3.406 . 0 0 "[ . 1 . 2]" 1
188 1 21 ARG H 1 74 LEU MD2 . . 3.790 3.066 2.790 3.339 . 0 0 "[ . 1 . 2]" 1
189 1 21 ARG H 1 74 LEU HG . . 3.760 2.653 2.361 2.881 . 0 0 "[ . 1 . 2]" 1
190 1 21 ARG HA 1 21 ARG HD2 . . 5.160 4.742 3.861 4.983 . 0 0 "[ . 1 . 2]" 1
191 1 21 ARG HA 1 21 ARG QD . . 4.420 4.278 3.649 4.404 . 0 0 "[ . 1 . 2]" 1
192 1 21 ARG HA 1 21 ARG HD3 . . 5.160 4.895 4.451 5.038 . 0 0 "[ . 1 . 2]" 1
193 1 21 ARG HA 1 21 ARG QG . . 3.180 2.620 2.414 2.735 . 0 0 "[ . 1 . 2]" 1
194 1 21 ARG HA 1 22 VAL H . . 2.580 2.186 2.155 2.280 . 0 0 "[ . 1 . 2]" 1
195 1 21 ARG HA 1 22 VAL HB . . 4.690 4.599 4.554 4.652 . 0 0 "[ . 1 . 2]" 1
196 1 21 ARG HA 1 22 VAL MG2 . . 3.970 3.678 3.570 3.875 . 0 0 "[ . 1 . 2]" 1
197 1 21 ARG HA 1 23 LEU MD2 . . 5.500 5.116 4.975 5.265 . 0 0 "[ . 1 . 2]" 1
198 1 21 ARG HA 1 40 GLU H . . 5.200 4.398 4.172 4.650 . 0 0 "[ . 1 . 2]" 1
199 1 21 ARG HA 1 41 VAL H . . 4.840 4.339 4.145 4.706 . 0 0 "[ . 1 . 2]" 1
200 1 21 ARG HA 1 41 VAL QG . . 3.440 2.189 1.844 3.373 . 0 0 "[ . 1 . 2]" 1
201 1 21 ARG HA 1 71 LEU MD2 . . 5.500 4.693 4.390 4.894 . 0 0 "[ . 1 . 2]" 1
202 1 21 ARG HB2 1 21 ARG HD2 . . 4.060 3.309 3.122 3.675 . 0 0 "[ . 1 . 2]" 1
203 1 21 ARG HB2 1 21 ARG QD . . 3.410 3.017 2.388 3.376 . 0 0 "[ . 1 . 2]" 1
204 1 21 ARG HB2 1 21 ARG HD3 . . 4.060 3.633 2.426 4.200 0.140 20 0 "[ . 1 . 2]" 1
205 1 21 ARG HB2 1 21 ARG HE . . 5.180 2.396 1.900 3.840 . 0 0 "[ . 1 . 2]" 1
206 1 21 ARG HB2 1 22 VAL H . . 4.110 4.015 3.935 4.098 . 0 0 "[ . 1 . 2]" 1
207 1 21 ARG HB2 1 23 LEU MD2 . . 5.190 5.033 4.918 5.193 0.003 20 0 "[ . 1 . 2]" 1
208 1 21 ARG HB2 1 39 ASP HA . . 5.500 5.506 5.500 5.513 0.013 6 0 "[ . 1 . 2]" 1
209 1 21 ARG HB2 1 41 VAL QG . . 3.340 2.223 1.812 3.353 0.013 12 0 "[ . 1 . 2]" 1
210 1 21 ARG HB2 1 72 GLU H . . 5.500 5.359 4.942 5.503 0.003 8 0 "[ . 1 . 2]" 1
211 1 21 ARG HB2 1 72 GLU HB3 . . 5.500 5.059 4.679 5.257 . 0 0 "[ . 1 . 2]" 1
212 1 21 ARG HB2 1 74 LEU MD1 . . 3.670 2.538 2.190 2.666 . 0 0 "[ . 1 . 2]" 1
213 1 21 ARG HB2 1 74 LEU MD2 . . 4.020 2.635 2.095 3.021 . 0 0 "[ . 1 . 2]" 1
214 1 21 ARG HB3 1 21 ARG HD2 . . 3.900 2.594 2.279 3.700 . 0 0 "[ . 1 . 2]" 1
215 1 21 ARG HB3 1 21 ARG HD3 . . 3.900 3.552 2.633 3.761 . 0 0 "[ . 1 . 2]" 1
216 1 21 ARG HB3 1 21 ARG HE . . 4.690 2.842 2.361 3.124 . 0 0 "[ . 1 . 2]" 1
217 1 21 ARG HB3 1 22 VAL H . . 4.330 4.195 3.826 4.338 0.008 6 0 "[ . 1 . 2]" 1
218 1 21 ARG HB3 1 23 LEU MD2 . . 4.740 3.752 3.512 3.987 . 0 0 "[ . 1 . 2]" 1
219 1 21 ARG HB3 1 41 VAL QG . . 4.900 3.466 3.087 4.600 . 0 0 "[ . 1 . 2]" 1
220 1 21 ARG HB3 1 72 GLU H . . 4.640 4.086 3.840 4.242 . 0 0 "[ . 1 . 2]" 1
221 1 21 ARG HB3 1 74 LEU MD2 . . 3.440 2.346 1.967 2.750 . 0 0 "[ . 1 . 2]" 1
222 1 21 ARG QD 1 22 VAL H . . 4.780 4.490 3.522 4.761 . 0 0 "[ . 1 . 2]" 1
223 1 21 ARG QD 1 23 LEU MD2 . . 4.250 3.314 2.002 3.922 . 0 0 "[ . 1 . 2]" 1
224 1 21 ARG QD 1 39 ASP H . . 5.340 4.557 3.617 4.957 . 0 0 "[ . 1 . 2]" 1
225 1 21 ARG QD 1 39 ASP HA . . 3.800 3.134 2.463 3.536 . 0 0 "[ . 1 . 2]" 1
226 1 21 ARG QD 1 41 VAL QG . . 4.320 3.974 3.310 4.325 0.005 5 0 "[ . 1 . 2]" 1
227 1 21 ARG QD 1 74 LEU MD2 . . 4.010 3.293 2.892 3.624 . 0 0 "[ . 1 . 2]" 1
228 1 21 ARG HD2 1 22 VAL H . . 5.500 5.106 3.885 5.446 . 0 0 "[ . 1 . 2]" 1
229 1 21 ARG HD2 1 23 LEU MD2 . . 4.880 3.479 2.062 4.228 . 0 0 "[ . 1 . 2]" 1
230 1 21 ARG HD2 1 74 LEU MD2 . . 4.660 3.526 3.193 4.548 . 0 0 "[ . 1 . 2]" 1
231 1 21 ARG HD3 1 22 VAL H . . 5.500 4.986 4.031 5.372 . 0 0 "[ . 1 . 2]" 1
232 1 21 ARG HD3 1 23 LEU MD2 . . 4.880 4.192 2.711 4.886 0.006 5 0 "[ . 1 . 2]" 1
233 1 21 ARG HD3 1 74 LEU MD2 . . 4.660 4.400 2.934 4.664 0.004 20 0 "[ . 1 . 2]" 1
234 1 21 ARG HE 1 23 LEU MD2 . . 5.500 5.059 2.477 5.502 0.002 1 0 "[ . 1 . 2]" 1
235 1 21 ARG HE 1 39 ASP HA . . 5.450 5.275 5.060 5.450 . 0 0 "[ . 1 . 2]" 1
236 1 21 ARG HE 1 74 LEU MD1 . . 5.500 3.486 2.997 4.963 . 0 0 "[ . 1 . 2]" 1
237 1 21 ARG HE 1 74 LEU MD2 . . 5.500 2.805 2.354 3.439 . 0 0 "[ . 1 . 2]" 1
238 1 21 ARG HE 1 74 LEU HG . . 5.500 5.101 4.778 5.476 . 0 0 "[ . 1 . 2]" 1
239 1 21 ARG QG 1 22 VAL H . . 3.410 2.610 2.217 2.811 . 0 0 "[ . 1 . 2]" 1
240 1 21 ARG QG 1 22 VAL HA . . 5.000 3.992 3.895 4.429 . 0 0 "[ . 1 . 2]" 1
241 1 21 ARG QG 1 22 VAL HB . . 5.180 4.025 3.832 4.152 . 0 0 "[ . 1 . 2]" 1
242 1 21 ARG QG 1 23 LEU HA . . 4.700 4.018 3.733 4.679 . 0 0 "[ . 1 . 2]" 1
243 1 21 ARG QG 1 23 LEU MD2 . . 3.910 3.081 2.639 3.906 . 0 0 "[ . 1 . 2]" 1
244 1 21 ARG QG 1 39 ASP H . . 4.480 3.822 3.533 4.055 . 0 0 "[ . 1 . 2]" 1
245 1 21 ARG QG 1 39 ASP HA . . 3.290 2.964 2.773 3.055 . 0 0 "[ . 1 . 2]" 1
246 1 21 ARG QG 1 39 ASP HB3 . . 5.030 4.715 4.558 4.856 . 0 0 "[ . 1 . 2]" 1
247 1 21 ARG QG 1 41 VAL QG . . 3.520 2.778 2.324 3.529 0.009 12 0 "[ . 1 . 2]" 1
248 1 21 ARG QG 1 72 GLU HB3 . . 4.660 4.289 3.664 4.663 0.003 20 0 "[ . 1 . 2]" 1
249 1 21 ARG QG 1 74 LEU MD1 . . 4.380 4.278 3.741 4.382 0.002 11 0 "[ . 1 . 2]" 1
250 1 22 VAL H 1 22 VAL HB . . 2.960 2.438 2.404 2.478 . 0 0 "[ . 1 . 2]" 1
251 1 22 VAL H 1 22 VAL MG2 . . 2.900 2.342 2.208 2.615 . 0 0 "[ . 1 . 2]" 1
252 1 22 VAL H 1 23 LEU MD2 . . 5.040 4.658 4.443 4.848 . 0 0 "[ . 1 . 2]" 1
253 1 22 VAL H 1 38 ALA HA . . 5.500 5.371 5.084 5.505 0.005 10 0 "[ . 1 . 2]" 1
254 1 22 VAL H 1 39 ASP HA . . 4.630 4.514 4.279 4.642 0.012 3 0 "[ . 1 . 2]" 1
255 1 22 VAL H 1 40 GLU H . . 3.550 2.761 2.450 3.040 . 0 0 "[ . 1 . 2]" 1
256 1 22 VAL H 1 40 GLU HA . . 4.890 4.493 4.372 4.593 . 0 0 "[ . 1 . 2]" 1
257 1 22 VAL H 1 40 GLU HB2 . . 5.500 5.312 5.097 5.440 . 0 0 "[ . 1 . 2]" 1
258 1 22 VAL H 1 40 GLU HB3 . . 5.270 4.955 4.613 5.105 . 0 0 "[ . 1 . 2]" 1
259 1 22 VAL H 1 40 GLU HG2 . . 5.180 3.614 3.188 3.802 . 0 0 "[ . 1 . 2]" 1
260 1 22 VAL H 1 40 GLU HG3 . . 4.810 3.754 3.413 3.897 . 0 0 "[ . 1 . 2]" 1
261 1 22 VAL H 1 41 VAL HA . . 3.600 3.194 3.061 3.553 . 0 0 "[ . 1 . 2]" 1
262 1 22 VAL H 1 41 VAL HB . . 5.500 5.344 4.459 5.535 0.035 10 0 "[ . 1 . 2]" 1
263 1 22 VAL H 1 41 VAL QG . . 5.250 3.546 3.127 4.785 . 0 0 "[ . 1 . 2]" 1
264 1 22 VAL H 1 71 LEU MD2 . . 5.250 4.195 3.917 4.351 . 0 0 "[ . 1 . 2]" 1
265 1 22 VAL HA 1 22 VAL MG1 . . 3.060 2.397 2.342 2.449 . 0 0 "[ . 1 . 2]" 1
266 1 22 VAL HA 1 22 VAL MG2 . . 2.910 2.355 2.200 2.410 . 0 0 "[ . 1 . 2]" 1
267 1 22 VAL HA 1 23 LEU H . . 2.640 2.187 2.151 2.249 . 0 0 "[ . 1 . 2]" 1
268 1 22 VAL HA 1 23 LEU HB2 . . 5.100 4.832 4.786 4.863 . 0 0 "[ . 1 . 2]" 1
269 1 22 VAL HA 1 23 LEU HG . . 4.040 3.564 3.476 3.694 . 0 0 "[ . 1 . 2]" 1
270 1 22 VAL HA 1 24 TYR H . . 4.010 3.815 3.714 3.903 . 0 0 "[ . 1 . 2]" 1
271 1 22 VAL HA 1 36 LEU QB . . 4.830 4.701 4.550 4.835 0.005 20 0 "[ . 1 . 2]" 1
272 1 22 VAL HA 1 36 LEU MD1 . . 4.480 4.296 4.040 4.472 . 0 0 "[ . 1 . 2]" 1
273 1 22 VAL HA 1 38 ALA HA . . 5.430 5.258 5.052 5.346 . 0 0 "[ . 1 . 2]" 1
274 1 22 VAL HA 1 71 LEU HA . . 3.250 2.546 2.342 2.705 . 0 0 "[ . 1 . 2]" 1
275 1 22 VAL HA 1 71 LEU MD2 . . 3.170 2.935 2.634 3.077 . 0 0 "[ . 1 . 2]" 1
276 1 22 VAL HA 1 71 LEU HG . . 4.710 4.540 4.385 4.703 . 0 0 "[ . 1 . 2]" 1
277 1 22 VAL HA 1 72 GLU H . . 4.050 3.859 3.654 4.050 . 0 0 "[ . 1 . 2]" 1
278 1 22 VAL HB 1 23 LEU H . . 4.850 4.113 3.955 4.219 . 0 0 "[ . 1 . 2]" 1
279 1 22 VAL HB 1 24 TYR H . . 5.080 4.473 4.258 4.744 . 0 0 "[ . 1 . 2]" 1
280 1 22 VAL HB 1 37 LEU H . . 5.060 4.052 3.700 4.312 . 0 0 "[ . 1 . 2]" 1
281 1 22 VAL HB 1 38 ALA H . . 5.340 5.089 4.781 5.157 . 0 0 "[ . 1 . 2]" 1
282 1 22 VAL HB 1 38 ALA HA . . 3.440 3.328 3.165 3.373 . 0 0 "[ . 1 . 2]" 1
283 1 22 VAL HB 1 38 ALA MB . . 4.840 4.820 4.686 4.852 0.012 11 0 "[ . 1 . 2]" 1
284 1 22 VAL HB 1 39 ASP H . . 3.650 3.140 2.942 3.252 . 0 0 "[ . 1 . 2]" 1
285 1 22 VAL HB 1 39 ASP HA . . 4.610 4.480 4.209 4.614 0.004 5 0 "[ . 1 . 2]" 1
286 1 22 VAL HB 1 40 GLU H . . 3.230 2.222 1.972 2.428 . 0 0 "[ . 1 . 2]" 1
287 1 22 VAL HB 1 40 GLU HG3 . . 3.760 3.511 3.360 3.655 . 0 0 "[ . 1 . 2]" 1
288 1 22 VAL HB 1 71 LEU MD2 . . 4.960 4.473 4.287 4.683 . 0 0 "[ . 1 . 2]" 1
289 1 22 VAL MG1 1 23 LEU H . . 3.260 2.308 2.032 2.574 . 0 0 "[ . 1 . 2]" 1
290 1 22 VAL MG1 1 23 LEU HA . . 4.310 3.791 3.664 3.963 . 0 0 "[ . 1 . 2]" 1
291 1 22 VAL MG1 1 24 TYR H . . 2.900 2.011 1.861 2.137 . 0 0 "[ . 1 . 2]" 1
292 1 22 VAL MG1 1 24 TYR HA . . 4.230 3.441 3.359 3.532 . 0 0 "[ . 1 . 2]" 1
293 1 22 VAL MG1 1 24 TYR HB2 . . 4.280 4.117 3.964 4.237 . 0 0 "[ . 1 . 2]" 1
294 1 22 VAL MG1 1 24 TYR QD . . 5.060 4.183 3.985 4.344 . 0 0 "[ . 1 . 2]" 1
295 1 22 VAL MG1 1 25 ASP HA . . 4.010 3.003 2.897 3.143 . 0 0 "[ . 1 . 2]" 1
296 1 22 VAL MG1 1 26 TYR H . . 4.250 3.609 3.358 4.207 . 0 0 "[ . 1 . 2]" 1
297 1 22 VAL MG1 1 26 TYR HB2 . . 4.780 4.394 4.090 4.604 . 0 0 "[ . 1 . 2]" 1
298 1 22 VAL MG1 1 26 TYR HB3 . . 4.910 4.411 4.226 4.645 . 0 0 "[ . 1 . 2]" 1
299 1 22 VAL MG1 1 36 LEU H . . 5.250 5.052 4.928 5.147 . 0 0 "[ . 1 . 2]" 1
300 1 22 VAL MG1 1 36 LEU QB . . 2.850 2.330 2.148 2.503 . 0 0 "[ . 1 . 2]" 1
301 1 22 VAL MG1 1 37 LEU HA . . 4.470 3.876 3.671 4.069 . 0 0 "[ . 1 . 2]" 1
302 1 22 VAL MG1 1 38 ALA H . . 4.130 3.902 3.582 4.133 0.003 3 0 "[ . 1 . 2]" 1
303 1 22 VAL MG1 1 38 ALA HA . . 2.890 2.192 1.979 2.437 . 0 0 "[ . 1 . 2]" 1
304 1 22 VAL MG1 1 39 ASP H . . 3.280 3.138 2.903 3.257 . 0 0 "[ . 1 . 2]" 1
305 1 22 VAL MG1 1 39 ASP HA . . 5.040 4.958 4.709 5.051 0.011 11 0 "[ . 1 . 2]" 1
306 1 22 VAL MG1 1 40 GLU H . . 4.110 3.660 3.439 3.869 . 0 0 "[ . 1 . 2]" 1
307 1 22 VAL MG1 1 70 TYR HA . . 4.620 4.406 4.095 4.602 . 0 0 "[ . 1 . 2]" 1
308 1 22 VAL MG1 1 70 TYR HB2 . . 5.080 4.212 3.883 4.462 . 0 0 "[ . 1 . 2]" 1
309 1 22 VAL MG1 1 70 TYR HB3 . . 3.740 2.891 2.539 3.154 . 0 0 "[ . 1 . 2]" 1
310 1 22 VAL MG1 1 70 TYR QD . . 4.650 3.594 3.349 3.879 . 0 0 "[ . 1 . 2]" 1
311 1 22 VAL MG1 1 71 LEU HA . . 4.510 4.160 3.943 4.336 . 0 0 "[ . 1 . 2]" 1
312 1 22 VAL MG1 1 71 LEU MD2 . . 3.480 3.362 3.167 3.483 0.003 9 0 "[ . 1 . 2]" 1
313 1 22 VAL MG2 1 36 LEU QB . . 3.120 2.086 1.966 2.227 . 0 0 "[ . 1 . 2]" 1
314 1 22 VAL MG2 1 37 LEU H . . 3.840 2.863 2.557 3.115 . 0 0 "[ . 1 . 2]" 1
315 1 22 VAL MG2 1 38 ALA HA . . 4.720 4.530 4.436 4.583 . 0 0 "[ . 1 . 2]" 1
316 1 22 VAL MG2 1 40 GLU H . . 3.930 3.530 3.370 3.682 . 0 0 "[ . 1 . 2]" 1
317 1 22 VAL MG2 1 40 GLU HB2 . . 4.600 4.417 4.238 4.605 0.005 13 0 "[ . 1 . 2]" 1
318 1 22 VAL MG2 1 40 GLU HB3 . . 4.280 4.085 3.915 4.254 . 0 0 "[ . 1 . 2]" 1
319 1 22 VAL MG2 1 40 GLU HG2 . . 3.580 2.006 1.923 2.151 . 0 0 "[ . 1 . 2]" 1
320 1 22 VAL MG2 1 40 GLU HG3 . . 3.550 2.497 2.304 2.747 . 0 0 "[ . 1 . 2]" 1
321 1 22 VAL MG2 1 42 ILE H . . 4.100 3.783 3.553 4.088 . 0 0 "[ . 1 . 2]" 1
322 1 22 VAL MG2 1 42 ILE MD . . 3.710 3.604 3.495 3.709 . 0 0 "[ . 1 . 2]" 1
323 1 22 VAL MG2 1 71 LEU MD2 . . 2.730 2.046 1.861 2.178 . 0 0 "[ . 1 . 2]" 1
324 1 23 LEU H 1 23 LEU HB2 . . 3.210 2.689 2.644 2.718 . 0 0 "[ . 1 . 2]" 1
325 1 23 LEU H 1 23 LEU HB3 . . 3.730 3.667 3.635 3.707 . 0 0 "[ . 1 . 2]" 1
326 1 23 LEU H 1 23 LEU MD2 . . 3.330 3.096 2.971 3.252 . 0 0 "[ . 1 . 2]" 1
327 1 23 LEU H 1 23 LEU HG . . 3.140 2.249 2.155 2.431 . 0 0 "[ . 1 . 2]" 1
328 1 23 LEU H 1 24 TYR H . . 3.010 2.187 2.063 2.299 . 0 0 "[ . 1 . 2]" 1
329 1 23 LEU H 1 24 TYR QD . . 5.500 3.812 3.563 3.947 . 0 0 "[ . 1 . 2]" 1
330 1 23 LEU H 1 36 LEU QB . . 5.500 5.458 5.312 5.505 0.005 4 0 "[ . 1 . 2]" 1
331 1 23 LEU H 1 70 TYR HA . . 4.470 3.744 3.510 3.939 . 0 0 "[ . 1 . 2]" 1
332 1 23 LEU H 1 70 TYR HB2 . . 5.400 4.970 4.794 5.101 . 0 0 "[ . 1 . 2]" 1
333 1 23 LEU H 1 70 TYR HB3 . . 4.590 3.589 3.382 3.771 . 0 0 "[ . 1 . 2]" 1
334 1 23 LEU H 1 71 LEU HA . . 3.700 3.397 3.148 3.594 . 0 0 "[ . 1 . 2]" 1
335 1 23 LEU H 1 71 LEU MD2 . . 4.580 4.290 4.012 4.525 . 0 0 "[ . 1 . 2]" 1
336 1 23 LEU H 1 71 LEU HG . . 5.500 5.322 5.144 5.418 . 0 0 "[ . 1 . 2]" 1
337 1 23 LEU H 1 72 GLU HB2 . . 5.500 5.477 5.345 5.504 0.004 5 0 "[ . 1 . 2]" 1
338 1 23 LEU HA 1 23 LEU MD1 . . 4.480 3.903 3.851 3.940 . 0 0 "[ . 1 . 2]" 1
339 1 23 LEU HA 1 23 LEU MD2 . . 2.630 2.289 2.033 2.391 . 0 0 "[ . 1 . 2]" 1
340 1 23 LEU HA 1 23 LEU HG . . 3.410 3.372 3.306 3.410 0.000 19 0 "[ . 1 . 2]" 1
341 1 23 LEU HA 1 38 ALA HA . . 4.800 4.497 4.115 4.731 . 0 0 "[ . 1 . 2]" 1
342 1 23 LEU HA 1 38 ALA MB . . 5.110 4.667 4.314 4.936 . 0 0 "[ . 1 . 2]" 1
343 1 23 LEU HA 1 39 ASP H . . 4.210 3.788 3.448 3.980 . 0 0 "[ . 1 . 2]" 1
344 1 23 LEU HB2 1 23 LEU MD1 . . 3.080 2.391 2.319 2.454 . 0 0 "[ . 1 . 2]" 1
345 1 23 LEU HB2 1 24 TYR H . . 3.490 2.913 2.751 3.050 . 0 0 "[ . 1 . 2]" 1
346 1 23 LEU HB2 1 24 TYR QD . . 4.020 2.277 2.146 2.335 . 0 0 "[ . 1 . 2]" 1
347 1 23 LEU HB2 1 24 TYR QE . . 4.110 2.407 2.279 2.517 . 0 0 "[ . 1 . 2]" 1
348 1 23 LEU HB2 1 70 TYR HA . . 3.730 3.303 3.186 3.438 . 0 0 "[ . 1 . 2]" 1
349 1 23 LEU HB2 1 71 LEU HA . . 5.500 5.243 4.955 5.448 . 0 0 "[ . 1 . 2]" 1
350 1 23 LEU HB3 1 23 LEU MD1 . . 3.220 2.297 2.217 2.354 . 0 0 "[ . 1 . 2]" 1
351 1 23 LEU HB3 1 23 LEU MD2 . . 3.060 2.316 2.244 2.424 . 0 0 "[ . 1 . 2]" 1
352 1 23 LEU HB3 1 24 TYR H . . 4.130 4.067 3.965 4.135 0.005 5 0 "[ . 1 . 2]" 1
353 1 23 LEU HB3 1 24 TYR QD . . 4.250 3.693 3.524 3.790 . 0 0 "[ . 1 . 2]" 1
354 1 23 LEU HB3 1 24 TYR QE . . 4.160 3.057 2.812 3.170 . 0 0 "[ . 1 . 2]" 1
355 1 23 LEU HB3 1 70 TYR HA . . 5.160 4.994 4.869 5.114 . 0 0 "[ . 1 . 2]" 1
356 1 23 LEU MD1 1 24 TYR H . . 4.980 4.665 4.522 4.864 . 0 0 "[ . 1 . 2]" 1
357 1 23 LEU MD1 1 24 TYR QD . . 4.360 3.673 3.557 3.827 . 0 0 "[ . 1 . 2]" 1
358 1 23 LEU MD1 1 24 TYR QE . . 3.640 2.515 2.384 2.630 . 0 0 "[ . 1 . 2]" 1
359 1 23 LEU MD1 1 69 THR HA . . 5.050 4.730 4.494 4.994 . 0 0 "[ . 1 . 2]" 1
360 1 23 LEU MD1 1 70 TYR HA . . 3.660 3.245 2.946 3.615 . 0 0 "[ . 1 . 2]" 1
361 1 23 LEU MD1 1 70 TYR QD . . 5.500 5.268 5.028 5.502 0.002 5 0 "[ . 1 . 2]" 1
362 1 23 LEU MD1 1 71 LEU H . . 4.620 4.321 4.048 4.619 . 0 0 "[ . 1 . 2]" 1
363 1 23 LEU MD1 1 72 GLU HA . . 4.380 3.911 3.757 4.063 . 0 0 "[ . 1 . 2]" 1
364 1 23 LEU MD1 1 72 GLU HB2 . . 3.600 2.361 2.171 2.540 . 0 0 "[ . 1 . 2]" 1
365 1 23 LEU MD1 1 72 GLU HB3 . . 4.440 3.618 3.392 3.925 . 0 0 "[ . 1 . 2]" 1
366 1 23 LEU MD1 1 72 GLU HG3 . . 4.690 4.478 4.298 4.651 . 0 0 "[ . 1 . 2]" 1
367 1 23 LEU MD2 1 24 TYR H . . 4.690 4.523 4.440 4.611 . 0 0 "[ . 1 . 2]" 1
368 1 23 LEU MD2 1 24 TYR QD . . 4.930 4.897 4.822 4.931 0.001 16 0 "[ . 1 . 2]" 1
369 1 23 LEU MD2 1 24 TYR QE . . 4.510 4.436 4.268 4.512 0.002 5 0 "[ . 1 . 2]" 1
370 1 23 LEU MD2 1 71 LEU HA . . 4.510 3.961 3.746 4.119 . 0 0 "[ . 1 . 2]" 1
371 1 23 LEU MD2 1 72 GLU H . . 3.790 3.445 3.283 3.599 . 0 0 "[ . 1 . 2]" 1
372 1 23 LEU MD2 1 72 GLU HA . . 4.440 4.063 3.990 4.150 . 0 0 "[ . 1 . 2]" 1
373 1 23 LEU MD2 1 72 GLU HB2 . . 2.990 2.050 1.980 2.313 . 0 0 "[ . 1 . 2]" 1
374 1 23 LEU MD2 1 72 GLU HB3 . . 3.450 2.237 1.993 2.484 . 0 0 "[ . 1 . 2]" 1
375 1 23 LEU MD2 1 72 GLU HG3 . . 4.340 4.099 4.010 4.173 . 0 0 "[ . 1 . 2]" 1
376 1 23 LEU HG 1 24 TYR H . . 4.190 4.031 3.943 4.171 . 0 0 "[ . 1 . 2]" 1
377 1 23 LEU HG 1 24 TYR QD . . 4.970 4.269 4.171 4.358 . 0 0 "[ . 1 . 2]" 1
378 1 23 LEU HG 1 24 TYR QE . . 5.060 4.233 4.088 4.387 . 0 0 "[ . 1 . 2]" 1
379 1 23 LEU HG 1 70 TYR HA . . 4.530 3.702 3.465 3.904 . 0 0 "[ . 1 . 2]" 1
380 1 23 LEU HG 1 71 LEU H . . 4.460 4.420 4.331 4.465 0.005 20 0 "[ . 1 . 2]" 1
381 1 23 LEU HG 1 71 LEU HA . . 3.720 3.260 3.050 3.478 . 0 0 "[ . 1 . 2]" 1
382 1 23 LEU HG 1 72 GLU H . . 3.970 3.779 3.542 3.971 0.001 3 0 "[ . 1 . 2]" 1
383 1 23 LEU HG 1 72 GLU HA . . 4.930 4.816 4.705 4.925 . 0 0 "[ . 1 . 2]" 1
384 1 23 LEU HG 1 72 GLU HB2 . . 4.320 3.434 3.302 3.545 . 0 0 "[ . 1 . 2]" 1
385 1 23 LEU HG 1 72 GLU HB3 . . 4.760 3.838 3.635 4.141 . 0 0 "[ . 1 . 2]" 1
386 1 24 TYR H 1 24 TYR HB2 . . 3.590 3.059 3.016 3.117 . 0 0 "[ . 1 . 2]" 1
387 1 24 TYR H 1 24 TYR HB3 . . 4.030 3.962 3.934 3.993 . 0 0 "[ . 1 . 2]" 1
388 1 24 TYR H 1 25 ASP H . . 4.530 4.333 4.288 4.387 . 0 0 "[ . 1 . 2]" 1
389 1 24 TYR H 1 38 ALA HA . . 4.040 3.858 3.601 4.036 . 0 0 "[ . 1 . 2]" 1
390 1 24 TYR H 1 38 ALA MB . . 4.500 4.281 4.006 4.470 . 0 0 "[ . 1 . 2]" 1
391 1 24 TYR H 1 39 ASP H . . 4.940 4.756 4.538 4.930 . 0 0 "[ . 1 . 2]" 1
392 1 24 TYR H 1 70 TYR HA . . 4.250 3.967 3.706 4.154 . 0 0 "[ . 1 . 2]" 1
393 1 24 TYR H 1 70 TYR HB2 . . 5.150 5.022 4.891 5.151 0.001 11 0 "[ . 1 . 2]" 1
394 1 24 TYR H 1 70 TYR HB3 . . 4.320 3.286 3.167 3.413 . 0 0 "[ . 1 . 2]" 1
395 1 24 TYR H 1 70 TYR QD . . 4.130 3.421 3.195 3.568 . 0 0 "[ . 1 . 2]" 1
396 1 24 TYR H 1 71 LEU MD2 . . 5.470 5.266 5.005 5.473 0.003 5 0 "[ . 1 . 2]" 1
397 1 24 TYR HA 1 24 TYR HB3 . . 2.950 2.345 2.323 2.365 . 0 0 "[ . 1 . 2]" 1
398 1 24 TYR HA 1 24 TYR QD . . 3.340 3.098 3.045 3.137 . 0 0 "[ . 1 . 2]" 1
399 1 24 TYR HA 1 25 ASP H . . 2.720 2.246 2.207 2.292 . 0 0 "[ . 1 . 2]" 1
400 1 24 TYR HA 1 25 ASP QB . . 4.890 4.470 4.079 4.751 . 0 0 "[ . 1 . 2]" 1
401 1 24 TYR HA 1 38 ALA MB . . 3.020 2.344 2.119 2.773 . 0 0 "[ . 1 . 2]" 1
402 1 24 TYR HB2 1 25 ASP H . . 3.890 3.688 3.565 3.791 . 0 0 "[ . 1 . 2]" 1
403 1 24 TYR HB2 1 70 TYR HA . . 4.600 4.478 4.211 4.601 0.001 20 0 "[ . 1 . 2]" 1
404 1 24 TYR HB2 1 70 TYR QD . . 3.700 2.402 2.248 2.647 . 0 0 "[ . 1 . 2]" 1
405 1 24 TYR HB2 1 70 TYR QE . . 3.640 2.864 2.549 3.018 . 0 0 "[ . 1 . 2]" 1
406 1 24 TYR HB3 1 25 ASP H . . 3.440 2.925 2.801 3.069 . 0 0 "[ . 1 . 2]" 1
407 1 24 TYR HB3 1 25 ASP HA . . 5.320 5.152 5.094 5.246 . 0 0 "[ . 1 . 2]" 1
408 1 24 TYR HB3 1 38 ALA MB . . 4.750 4.230 4.014 4.698 . 0 0 "[ . 1 . 2]" 1
409 1 24 TYR HB3 1 70 TYR QD . . 4.140 4.015 3.880 4.122 . 0 0 "[ . 1 . 2]" 1
410 1 24 TYR HB3 1 70 TYR QE . . 4.080 3.906 3.615 4.071 . 0 0 "[ . 1 . 2]" 1
411 1 24 TYR QD 1 25 ASP H . . 4.720 4.418 4.353 4.549 . 0 0 "[ . 1 . 2]" 1
412 1 24 TYR QD 1 38 ALA MB . . 4.920 4.448 4.281 4.861 . 0 0 "[ . 1 . 2]" 1
413 1 24 TYR QD 1 70 TYR HA . . 3.130 2.683 2.510 2.811 . 0 0 "[ . 1 . 2]" 1
414 1 24 TYR QD 1 70 TYR HB2 . . 5.100 4.909 4.813 4.970 . 0 0 "[ . 1 . 2]" 1
415 1 24 TYR QD 1 70 TYR HB3 . . 4.800 3.665 3.552 3.757 . 0 0 "[ . 1 . 2]" 1
416 1 24 TYR QD 1 70 TYR QD . . 4.460 3.282 2.977 3.653 . 0 0 "[ . 1 . 2]" 1
417 1 24 TYR QE 1 70 TYR HA . . 3.750 3.660 3.418 3.751 0.001 15 0 "[ . 1 . 2]" 1
418 1 25 ASP H 1 25 ASP HB2 . . 3.600 3.305 2.211 3.595 . 0 0 "[ . 1 . 2]" 1
419 1 25 ASP H 1 25 ASP QB . . 2.950 2.610 2.146 2.763 . 0 0 "[ . 1 . 2]" 1
420 1 25 ASP H 1 25 ASP HB3 . . 3.600 2.855 2.556 3.541 . 0 0 "[ . 1 . 2]" 1
421 1 25 ASP H 1 38 ALA H . . 4.000 3.791 3.554 3.999 . 0 0 "[ . 1 . 2]" 1
422 1 25 ASP H 1 38 ALA MB . . 3.280 2.633 2.290 2.918 . 0 0 "[ . 1 . 2]" 1
423 1 25 ASP HA 1 26 TYR H . . 2.710 2.160 2.139 2.267 . 0 0 "[ . 1 . 2]" 1
424 1 25 ASP HA 1 26 TYR HB2 . . 4.990 4.635 4.389 4.786 . 0 0 "[ . 1 . 2]" 1
425 1 25 ASP HA 1 26 TYR HB3 . . 4.980 4.500 4.372 4.635 . 0 0 "[ . 1 . 2]" 1
426 1 25 ASP HA 1 36 LEU H . . 4.800 4.495 4.383 4.683 . 0 0 "[ . 1 . 2]" 1
427 1 25 ASP HA 1 36 LEU QB . . 4.300 3.344 3.181 3.607 . 0 0 "[ . 1 . 2]" 1
428 1 25 ASP HA 1 37 LEU HA . . 3.090 2.493 2.175 2.933 . 0 0 "[ . 1 . 2]" 1
429 1 25 ASP HA 1 37 LEU MD2 . . 4.270 3.952 3.649 4.253 . 0 0 "[ . 1 . 2]" 1
430 1 25 ASP HA 1 38 ALA H . . 3.330 3.273 2.867 3.335 0.005 3 0 "[ . 1 . 2]" 1
431 1 25 ASP HA 1 38 ALA MB . . 3.970 3.853 3.642 3.976 0.006 15 0 "[ . 1 . 2]" 1
432 1 25 ASP QB 1 26 TYR H . . 3.430 3.327 3.163 3.417 . 0 0 "[ . 1 . 2]" 1
433 1 25 ASP QB 1 37 LEU HA . . 3.970 2.500 2.007 3.636 . 0 0 "[ . 1 . 2]" 1
434 1 25 ASP QB 1 37 LEU MD2 . . 3.870 2.764 2.288 3.819 . 0 0 "[ . 1 . 2]" 1
435 1 25 ASP QB 1 38 ALA H . . 3.980 2.474 2.118 3.318 . 0 0 "[ . 1 . 2]" 1
436 1 25 ASP HB2 1 26 TYR H . . 4.280 3.631 3.280 4.201 . 0 0 "[ . 1 . 2]" 1
437 1 25 ASP HB2 1 37 LEU HA . . 4.760 3.199 2.773 4.086 . 0 0 "[ . 1 . 2]" 1
438 1 25 ASP HB2 1 37 LEU MD2 . . 4.720 3.307 2.707 4.074 . 0 0 "[ . 1 . 2]" 1
439 1 25 ASP HB2 1 38 ALA H . . 4.700 3.806 2.780 4.518 . 0 0 "[ . 1 . 2]" 1
440 1 25 ASP HB3 1 26 TYR H . . 4.280 4.040 3.596 4.264 . 0 0 "[ . 1 . 2]" 1
441 1 25 ASP HB3 1 37 LEU HA . . 4.760 2.748 2.059 4.727 . 0 0 "[ . 1 . 2]" 1
442 1 25 ASP HB3 1 37 LEU MD2 . . 4.720 3.058 2.392 4.723 0.003 9 0 "[ . 1 . 2]" 1
443 1 25 ASP HB3 1 38 ALA H . . 4.700 2.741 2.128 4.634 . 0 0 "[ . 1 . 2]" 1
444 1 26 TYR H 1 26 TYR HB2 . . 3.780 3.032 2.915 3.323 . 0 0 "[ . 1 . 2]" 1
445 1 26 TYR H 1 26 TYR HB3 . . 3.530 2.502 2.368 2.789 . 0 0 "[ . 1 . 2]" 1
446 1 26 TYR H 1 26 TYR QD . . 4.520 4.221 4.089 4.401 . 0 0 "[ . 1 . 2]" 1
447 1 26 TYR H 1 36 LEU H . . 3.400 2.737 2.604 2.828 . 0 0 "[ . 1 . 2]" 1
448 1 26 TYR H 1 36 LEU QB . . 3.410 2.169 1.912 2.724 . 0 0 "[ . 1 . 2]" 1
449 1 26 TYR H 1 36 LEU MD2 . . 5.500 4.777 4.521 5.165 . 0 0 "[ . 1 . 2]" 1
450 1 26 TYR H 1 37 LEU HA . . 3.990 3.781 3.607 3.928 . 0 0 "[ . 1 . 2]" 1
451 1 26 TYR H 1 37 LEU MD2 . . 5.500 4.872 4.317 5.268 . 0 0 "[ . 1 . 2]" 1
452 1 26 TYR H 1 70 TYR QE . . 5.500 5.281 5.149 5.444 . 0 0 "[ . 1 . 2]" 1
453 1 26 TYR HA 1 26 TYR QD . . 3.140 2.618 2.390 2.959 . 0 0 "[ . 1 . 2]" 1
454 1 26 TYR HA 1 27 ASP H . . 2.710 2.263 2.155 2.320 . 0 0 "[ . 1 . 2]" 1
455 1 26 TYR HA 1 27 ASP QB . . 4.420 4.126 3.919 4.460 0.040 13 0 "[ . 1 . 2]" 1
456 1 26 TYR HA 1 36 LEU QB . . 4.870 4.252 4.009 4.386 . 0 0 "[ . 1 . 2]" 1
457 1 26 TYR HA 1 70 TYR QE . . 3.840 3.615 3.397 3.750 . 0 0 "[ . 1 . 2]" 1
458 1 26 TYR HB2 1 27 ASP H . . 4.280 3.919 3.780 4.103 . 0 0 "[ . 1 . 2]" 1
459 1 26 TYR HB2 1 35 SER HA . . 5.500 5.492 5.446 5.508 0.008 17 0 "[ . 1 . 2]" 1
460 1 26 TYR HB2 1 36 LEU H . . 4.340 4.229 4.132 4.344 0.004 11 0 "[ . 1 . 2]" 1
461 1 26 TYR HB2 1 36 LEU QB . . 3.670 3.024 2.572 3.265 . 0 0 "[ . 1 . 2]" 1
462 1 26 TYR HB2 1 36 LEU MD1 . . 3.710 2.888 2.444 3.311 . 0 0 "[ . 1 . 2]" 1
463 1 26 TYR HB2 1 36 LEU HG . . 4.400 3.897 3.407 4.301 . 0 0 "[ . 1 . 2]" 1
464 1 26 TYR HB2 1 67 PRO HG2 . . 5.400 3.662 3.362 3.904 . 0 0 "[ . 1 . 2]" 1
465 1 26 TYR HB2 1 70 TYR HB3 . . 4.560 3.801 3.623 4.073 . 0 0 "[ . 1 . 2]" 1
466 1 26 TYR HB2 1 70 TYR QD . . 3.930 2.840 2.591 3.063 . 0 0 "[ . 1 . 2]" 1
467 1 26 TYR HB2 1 70 TYR QE . . 3.710 3.612 3.338 3.711 0.001 11 0 "[ . 1 . 2]" 1
468 1 26 TYR HB3 1 27 ASP H . . 4.570 3.950 3.704 4.300 . 0 0 "[ . 1 . 2]" 1
469 1 26 TYR HB3 1 35 SER HA . . 4.380 3.900 3.792 4.046 . 0 0 "[ . 1 . 2]" 1
470 1 26 TYR HB3 1 36 LEU H . . 3.670 2.622 2.503 2.831 . 0 0 "[ . 1 . 2]" 1
471 1 26 TYR HB3 1 36 LEU QB . . 3.410 2.044 1.990 2.180 . 0 0 "[ . 1 . 2]" 1
472 1 26 TYR HB3 1 36 LEU MD1 . . 3.560 2.491 2.184 2.882 . 0 0 "[ . 1 . 2]" 1
473 1 26 TYR HB3 1 36 LEU HG . . 3.980 2.378 1.997 2.711 . 0 0 "[ . 1 . 2]" 1
474 1 26 TYR HB3 1 67 PRO HG2 . . 5.310 4.340 4.124 4.670 . 0 0 "[ . 1 . 2]" 1
475 1 26 TYR HB3 1 70 TYR QD . . 4.640 4.278 4.083 4.408 . 0 0 "[ . 1 . 2]" 1
476 1 26 TYR HB3 1 70 TYR QE . . 5.400 5.201 4.999 5.302 . 0 0 "[ . 1 . 2]" 1
477 1 26 TYR QD 1 27 ASP H . . 3.830 2.883 2.366 3.254 . 0 0 "[ . 1 . 2]" 1
478 1 26 TYR QD 1 28 ALA H . . 4.600 3.787 3.495 4.248 . 0 0 "[ . 1 . 2]" 1
479 1 26 TYR QD 1 28 ALA HA . . 4.670 3.806 3.562 4.127 . 0 0 "[ . 1 . 2]" 1
480 1 26 TYR QD 1 28 ALA MB . . 5.110 3.868 3.484 4.172 . 0 0 "[ . 1 . 2]" 1
481 1 26 TYR QD 1 34 LEU H . . 4.860 4.481 4.312 4.693 . 0 0 "[ . 1 . 2]" 1
482 1 26 TYR QD 1 35 SER HA . . 3.550 2.934 2.477 3.308 . 0 0 "[ . 1 . 2]" 1
483 1 26 TYR QD 1 36 LEU H . . 4.140 3.180 2.682 3.688 . 0 0 "[ . 1 . 2]" 1
484 1 26 TYR QD 1 36 LEU QB . . 4.650 3.723 3.410 3.899 . 0 0 "[ . 1 . 2]" 1
485 1 26 TYR QD 1 36 LEU MD1 . . 4.030 3.185 2.685 3.588 . 0 0 "[ . 1 . 2]" 1
486 1 26 TYR QD 1 36 LEU MD2 . . 4.680 3.851 3.562 4.076 . 0 0 "[ . 1 . 2]" 1
487 1 26 TYR QD 1 36 LEU HG . . 4.220 2.419 2.096 2.657 . 0 0 "[ . 1 . 2]" 1
488 1 26 TYR QD 1 66 VAL MG1 . . 4.900 4.231 3.718 4.556 . 0 0 "[ . 1 . 2]" 1
489 1 26 TYR QD 1 67 PRO HD2 . . 4.610 3.606 3.074 3.907 . 0 0 "[ . 1 . 2]" 1
490 1 26 TYR QD 1 67 PRO HD3 . . 4.450 3.741 3.485 3.996 . 0 0 "[ . 1 . 2]" 1
491 1 26 TYR QD 1 67 PRO HG3 . . 5.120 3.270 2.647 3.511 . 0 0 "[ . 1 . 2]" 1
492 1 26 TYR QD 1 70 TYR QD . . 5.000 4.081 3.732 4.551 . 0 0 "[ . 1 . 2]" 1
493 1 26 TYR QE 1 27 ASP H . . 4.520 3.840 3.537 4.299 . 0 0 "[ . 1 . 2]" 1
494 1 26 TYR QE 1 28 ALA H . . 4.920 3.996 3.468 4.421 . 0 0 "[ . 1 . 2]" 1
495 1 26 TYR QE 1 28 ALA HA . . 2.970 2.325 2.016 2.845 . 0 0 "[ . 1 . 2]" 1
496 1 26 TYR QE 1 28 ALA MB . . 3.780 3.184 2.452 3.731 . 0 0 "[ . 1 . 2]" 1
497 1 26 TYR QE 1 29 ALA H . . 3.820 3.706 3.366 3.827 0.007 19 0 "[ . 1 . 2]" 1
498 1 26 TYR QE 1 29 ALA MB . . 4.820 4.440 4.045 4.742 . 0 0 "[ . 1 . 2]" 1
499 1 26 TYR QE 1 33 GLU HA . . 5.210 4.562 4.122 4.965 . 0 0 "[ . 1 . 2]" 1
500 1 26 TYR QE 1 33 GLU HB2 . . 4.300 3.935 3.507 4.304 0.004 9 0 "[ . 1 . 2]" 1
501 1 26 TYR QE 1 33 GLU HB3 . . 3.620 2.494 2.241 2.798 . 0 0 "[ . 1 . 2]" 1
502 1 26 TYR QE 1 33 GLU HG2 . . 4.920 3.832 3.536 4.364 . 0 0 "[ . 1 . 2]" 1
503 1 26 TYR QE 1 33 GLU HG3 . . 5.340 5.022 4.834 5.203 . 0 0 "[ . 1 . 2]" 1
504 1 26 TYR QE 1 34 LEU H . . 4.440 3.627 2.931 4.238 . 0 0 "[ . 1 . 2]" 1
505 1 26 TYR QE 1 36 LEU MD1 . . 5.210 4.577 4.192 5.056 . 0 0 "[ . 1 . 2]" 1
506 1 26 TYR QE 1 36 LEU MD2 . . 5.500 5.227 4.795 5.498 . 0 0 "[ . 1 . 2]" 1
507 1 26 TYR QE 1 36 LEU HG . . 5.490 4.522 4.138 4.843 . 0 0 "[ . 1 . 2]" 1
508 1 26 TYR QE 1 54 TRP HH2 . . 4.600 3.279 2.773 3.502 . 0 0 "[ . 1 . 2]" 1
509 1 26 TYR QE 1 66 VAL HA . . 4.690 4.350 3.619 4.668 . 0 0 "[ . 1 . 2]" 1
510 1 26 TYR QE 1 67 PRO HD2 . . 4.440 4.253 3.747 4.441 0.001 5 0 "[ . 1 . 2]" 1
511 1 26 TYR QE 1 67 PRO HD3 . . 4.130 3.410 3.049 3.718 . 0 0 "[ . 1 . 2]" 1
512 1 26 TYR QE 1 67 PRO HG2 . . 5.080 4.884 4.669 5.070 . 0 0 "[ . 1 . 2]" 1
513 1 26 TYR QE 1 67 PRO HG3 . . 4.130 3.531 3.108 3.791 . 0 0 "[ . 1 . 2]" 1
514 1 27 ASP H 1 27 ASP HB2 . . 3.590 2.917 2.393 3.647 0.057 6 0 "[ . 1 . 2]" 1
515 1 27 ASP H 1 27 ASP QB . . 2.920 2.568 2.359 2.927 0.007 17 0 "[ . 1 . 2]" 1
516 1 27 ASP H 1 27 ASP HB3 . . 3.590 3.161 2.618 3.606 0.016 11 0 "[ . 1 . 2]" 1
517 1 27 ASP H 1 70 TYR QE . . 5.340 5.270 4.998 5.342 0.002 5 0 "[ . 1 . 2]" 1
518 1 27 ASP HA 1 28 ALA H . . 2.650 2.164 2.143 2.172 . 0 0 "[ . 1 . 2]" 1
519 1 27 ASP HA 1 28 ALA MB . . 4.050 3.993 3.956 4.010 . 0 0 "[ . 1 . 2]" 1
520 1 27 ASP HA 1 35 SER HA . . 3.520 3.143 2.739 3.520 0.000 19 0 "[ . 1 . 2]" 1
521 1 27 ASP HA 1 35 SER QB . . 3.910 3.336 2.713 3.850 . 0 0 "[ . 1 . 2]" 1
522 1 27 ASP HA 1 36 LEU H . . 4.440 3.853 3.574 4.193 . 0 0 "[ . 1 . 2]" 1
523 1 27 ASP QB 1 28 ALA H . . 4.020 3.712 3.518 3.956 . 0 0 "[ . 1 . 2]" 1
524 1 27 ASP HB2 1 28 ALA H . . 4.610 4.340 3.722 4.578 . 0 0 "[ . 1 . 2]" 1
525 1 27 ASP HB3 1 28 ALA H . . 4.610 4.124 3.710 4.422 . 0 0 "[ . 1 . 2]" 1
526 1 28 ALA H 1 28 ALA MB . . 2.750 2.203 2.092 2.260 . 0 0 "[ . 1 . 2]" 1
527 1 28 ALA H 1 35 SER HA . . 3.250 2.346 2.184 2.623 . 0 0 "[ . 1 . 2]" 1
528 1 28 ALA H 1 35 SER HB2 . . 4.410 3.732 3.007 4.396 . 0 0 "[ . 1 . 2]" 1
529 1 28 ALA H 1 35 SER QB . . 3.700 3.197 2.614 3.702 0.002 8 0 "[ . 1 . 2]" 1
530 1 28 ALA H 1 35 SER HB3 . . 4.410 3.656 2.820 4.417 0.007 9 0 "[ . 1 . 2]" 1
531 1 28 ALA H 1 36 LEU H . . 4.630 4.155 4.010 4.487 . 0 0 "[ . 1 . 2]" 1
532 1 28 ALA HA 1 29 ALA H . . 2.650 2.167 2.144 2.209 . 0 0 "[ . 1 . 2]" 1
533 1 28 ALA HA 1 29 ALA MB . . 3.940 3.912 3.875 3.943 0.003 1 0 "[ . 1 . 2]" 1
534 1 28 ALA HA 1 30 ASN H . . 4.050 3.892 3.727 4.028 . 0 0 "[ . 1 . 2]" 1
535 1 28 ALA HA 1 33 GLU HB2 . . 3.550 3.050 2.536 3.316 . 0 0 "[ . 1 . 2]" 1
536 1 28 ALA HA 1 33 GLU HB3 . . 3.610 2.587 2.431 2.844 . 0 0 "[ . 1 . 2]" 1
537 1 28 ALA MB 1 29 ALA H . . 3.400 3.034 2.855 3.192 . 0 0 "[ . 1 . 2]" 1
538 1 28 ALA MB 1 30 ASN H . . 3.240 3.067 2.863 3.240 . 0 0 "[ . 1 . 2]" 1
539 1 28 ALA MB 1 30 ASN HA . . 4.820 4.546 4.227 4.686 . 0 0 "[ . 1 . 2]" 1
540 1 28 ALA MB 1 31 SER HA . . 4.630 4.462 4.319 4.595 . 0 0 "[ . 1 . 2]" 1
541 1 28 ALA MB 1 33 GLU H . . 3.820 3.628 3.274 3.764 . 0 0 "[ . 1 . 2]" 1
542 1 28 ALA MB 1 33 GLU HA . . 4.460 3.851 3.650 3.987 . 0 0 "[ . 1 . 2]" 1
543 1 28 ALA MB 1 33 GLU HB2 . . 2.990 2.423 2.137 2.561 . 0 0 "[ . 1 . 2]" 1
544 1 28 ALA MB 1 33 GLU HB3 . . 3.340 2.609 2.244 2.959 . 0 0 "[ . 1 . 2]" 1
545 1 28 ALA MB 1 33 GLU HG2 . . 4.720 4.542 4.203 4.711 . 0 0 "[ . 1 . 2]" 1
546 1 28 ALA MB 1 33 GLU HG3 . . 4.690 4.576 4.312 4.695 0.005 17 0 "[ . 1 . 2]" 1
547 1 28 ALA MB 1 34 LEU H . . 3.570 3.052 2.716 3.307 . 0 0 "[ . 1 . 2]" 1
548 1 28 ALA MB 1 34 LEU HA . . 3.790 2.513 2.310 2.662 . 0 0 "[ . 1 . 2]" 1
549 1 28 ALA MB 1 35 SER H . . 3.540 2.903 2.745 3.150 . 0 0 "[ . 1 . 2]" 1
550 1 28 ALA MB 1 35 SER HA . . 3.690 3.027 2.802 3.372 . 0 0 "[ . 1 . 2]" 1
551 1 28 ALA MB 1 35 SER HB2 . . 4.630 3.884 2.967 4.466 . 0 0 "[ . 1 . 2]" 1
552 1 28 ALA MB 1 35 SER HB3 . . 4.630 4.075 2.935 4.630 0.000 12 0 "[ . 1 . 2]" 1
553 1 28 ALA MB 1 65 LYS H . . 5.500 5.332 5.136 5.507 0.007 15 0 "[ . 1 . 2]" 1
554 1 29 ALA H 1 29 ALA MB . . 2.780 2.126 2.038 2.222 . 0 0 "[ . 1 . 2]" 1
555 1 29 ALA H 1 30 ASN H . . 3.000 2.398 2.208 2.579 . 0 0 "[ . 1 . 2]" 1
556 1 29 ALA H 1 33 GLU HB2 . . 3.750 2.658 2.136 2.920 . 0 0 "[ . 1 . 2]" 1
557 1 29 ALA H 1 33 GLU HB3 . . 4.140 3.188 3.077 3.376 . 0 0 "[ . 1 . 2]" 1
558 1 29 ALA H 1 33 GLU HG2 . . 4.700 4.414 4.134 4.641 . 0 0 "[ . 1 . 2]" 1
559 1 29 ALA H 1 33 GLU HG3 . . 4.620 4.411 3.852 4.614 . 0 0 "[ . 1 . 2]" 1
560 1 29 ALA MB 1 30 ASN H . . 3.380 2.775 2.638 2.944 . 0 0 "[ . 1 . 2]" 1
561 1 29 ALA MB 1 30 ASN HA . . 4.560 4.179 4.067 4.291 . 0 0 "[ . 1 . 2]" 1
562 1 29 ALA MB 1 30 ASN HB2 . . 5.000 4.794 4.366 4.927 . 0 0 "[ . 1 . 2]" 1
563 1 29 ALA MB 1 30 ASN QB . . 4.270 3.647 3.306 3.984 . 0 0 "[ . 1 . 2]" 1
564 1 29 ALA MB 1 30 ASN HB3 . . 5.000 3.801 3.376 4.597 . 0 0 "[ . 1 . 2]" 1
565 1 29 ALA MB 1 30 ASN HD21 . . 4.230 3.615 1.996 4.230 . 14 0 "[ . 1 . 2]" 1
566 1 29 ALA MB 1 30 ASN HD22 . . 4.230 3.545 2.534 4.099 . 0 0 "[ . 1 . 2]" 1
567 1 29 ALA MB 1 54 TRP HH2 . . 5.380 4.991 4.153 5.332 . 0 0 "[ . 1 . 2]" 1
568 1 30 ASN H 1 33 GLU HB2 . . 3.510 2.266 2.153 2.503 . 0 0 "[ . 1 . 2]" 1
569 1 30 ASN H 1 33 GLU HB3 . . 4.210 3.847 3.630 4.202 . 0 0 "[ . 1 . 2]" 1
570 1 30 ASN H 1 33 GLU HG2 . . 4.890 4.782 4.564 4.885 . 0 0 "[ . 1 . 2]" 1
571 1 30 ASN H 1 33 GLU HG3 . . 4.140 3.886 3.307 4.068 . 0 0 "[ . 1 . 2]" 1
572 1 30 ASN QB 1 32 THR H . . 4.180 2.957 2.140 3.475 . 0 0 "[ . 1 . 2]" 1
573 1 30 ASN QB 1 32 THR MG . . 5.340 3.912 3.249 4.231 . 0 0 "[ . 1 . 2]" 1
574 1 30 ASN HB2 1 32 THR H . . 4.800 2.998 2.158 3.568 . 0 0 "[ . 1 . 2]" 1
575 1 30 ASN HB3 1 32 THR H . . 4.800 4.602 3.534 4.803 0.003 1 0 "[ . 1 . 2]" 1
576 1 30 ASN QD 1 32 THR H . . 4.420 3.502 1.965 4.421 0.001 3 0 "[ . 1 . 2]" 1
577 1 30 ASN QD 1 32 THR MG . . 4.820 3.962 3.467 4.235 . 0 0 "[ . 1 . 2]" 1
578 1 30 ASN QD 1 33 GLU HG2 . . 5.340 3.774 3.206 5.304 . 0 0 "[ . 1 . 2]" 1
579 1 30 ASN QD 1 33 GLU HG3 . . 4.700 2.436 1.788 3.929 . 0 0 "[ . 1 . 2]" 1
580 1 30 ASN HD21 1 32 THR H . . 5.150 3.787 1.978 4.971 . 0 0 "[ . 1 . 2]" 1
581 1 30 ASN HD21 1 33 GLU HG3 . . 5.500 3.265 2.191 5.365 . 0 0 "[ . 1 . 2]" 1
582 1 30 ASN HD22 1 32 THR H . . 5.150 4.529 3.389 5.199 0.049 18 0 "[ . 1 . 2]" 1
583 1 30 ASN HD22 1 33 GLU HG3 . . 5.500 2.571 1.896 4.552 . 0 0 "[ . 1 . 2]" 1
584 1 31 SER HA 1 31 SER QB . . 2.640 2.368 2.177 2.481 . 0 0 "[ . 1 . 2]" 1
585 1 31 SER HA 1 33 GLU H . . 4.070 3.905 3.407 4.058 . 0 0 "[ . 1 . 2]" 1
586 1 31 SER HB2 1 32 THR H . . 5.160 3.307 2.194 4.289 . 0 0 "[ . 1 . 2]" 1
587 1 31 SER HB3 1 32 THR H . . 5.160 3.042 2.166 4.370 . 0 0 "[ . 1 . 2]" 1
588 1 32 THR H 1 32 THR MG . . 3.140 2.398 1.919 2.948 . 0 0 "[ . 1 . 2]" 1
589 1 32 THR H 1 33 GLU H . . 3.170 2.835 2.202 2.959 . 0 0 "[ . 1 . 2]" 1
590 1 32 THR H 1 33 GLU HG3 . . 5.260 4.857 3.750 5.257 . 0 0 "[ . 1 . 2]" 1
591 1 32 THR HA 1 32 THR HB . . 2.620 2.538 2.421 2.606 . 0 0 "[ . 1 . 2]" 1
592 1 32 THR HA 1 32 THR MG . . 2.850 2.227 2.101 2.418 . 0 0 "[ . 1 . 2]" 1
593 1 32 THR HB 1 33 GLU H . . 4.910 3.776 3.540 4.372 . 0 0 "[ . 1 . 2]" 1
594 1 32 THR HB 1 33 GLU HG3 . . 4.830 3.766 3.537 4.156 . 0 0 "[ . 1 . 2]" 1
595 1 32 THR HB 1 65 LYS H . . 4.790 4.200 3.906 4.659 . 0 0 "[ . 1 . 2]" 1
596 1 32 THR HB 1 65 LYS HD2 . . 5.500 5.481 5.116 5.508 0.008 1 0 "[ . 1 . 2]" 1
597 1 32 THR HB 1 65 LYS HD3 . . 4.750 4.256 3.979 4.575 . 0 0 "[ . 1 . 2]" 1
598 1 32 THR HB 1 65 LYS HE2 . . 4.550 3.404 2.741 3.806 . 0 0 "[ . 1 . 2]" 1
599 1 32 THR HB 1 65 LYS HE3 . . 5.500 5.120 4.477 5.474 . 0 0 "[ . 1 . 2]" 1
600 1 32 THR HB 1 65 LYS HG3 . . 4.700 2.993 2.822 3.363 . 0 0 "[ . 1 . 2]" 1
601 1 32 THR MG 1 33 GLU H . . 4.350 4.088 3.870 4.376 0.026 11 0 "[ . 1 . 2]" 1
602 1 32 THR MG 1 33 GLU HG3 . . 5.220 4.796 4.532 5.011 . 0 0 "[ . 1 . 2]" 1
603 1 32 THR MG 1 65 LYS HE2 . . 5.500 4.632 4.133 5.070 . 0 0 "[ . 1 . 2]" 1
604 1 33 GLU H 1 33 GLU HB2 . . 3.290 2.453 2.294 2.935 . 0 0 "[ . 1 . 2]" 1
605 1 33 GLU H 1 33 GLU HB3 . . 3.910 3.657 3.564 3.940 0.030 11 0 "[ . 1 . 2]" 1
606 1 33 GLU H 1 33 GLU HG2 . . 4.180 4.094 3.950 4.224 0.044 11 0 "[ . 1 . 2]" 1
607 1 33 GLU H 1 33 GLU HG3 . . 3.540 2.882 2.644 3.397 . 0 0 "[ . 1 . 2]" 1
608 1 33 GLU H 1 65 LYS H . . 4.880 4.164 3.692 4.328 . 0 0 "[ . 1 . 2]" 1
609 1 33 GLU HA 1 33 GLU HG2 . . 3.400 2.662 2.490 2.855 . 0 0 "[ . 1 . 2]" 1
610 1 33 GLU HA 1 33 GLU HG3 . . 3.640 2.795 2.699 3.129 . 0 0 "[ . 1 . 2]" 1
611 1 33 GLU HA 1 34 LEU H . . 2.830 2.303 2.256 2.333 . 0 0 "[ . 1 . 2]" 1
612 1 33 GLU HA 1 34 LEU HB2 . . 4.760 4.169 4.155 4.182 . 0 0 "[ . 1 . 2]" 1
613 1 33 GLU HA 1 34 LEU HB3 . . 5.500 5.568 5.560 5.577 0.077 18 0 "[ . 1 . 2]" 1
614 1 33 GLU HA 1 34 LEU HG . . 4.900 4.429 4.384 4.483 . 0 0 "[ . 1 . 2]" 1
615 1 33 GLU HA 1 64 GLY HA2 . . 4.260 4.125 3.792 4.262 0.002 16 0 "[ . 1 . 2]" 1
616 1 33 GLU HA 1 64 GLY HA3 . . 4.040 3.285 3.015 3.404 . 0 0 "[ . 1 . 2]" 1
617 1 33 GLU HA 1 65 LYS H . . 2.840 1.976 1.896 2.108 . 0 0 "[ . 1 . 2]" 1
618 1 33 GLU HA 1 65 LYS HB2 . . 3.510 2.774 2.649 2.896 . 0 0 "[ . 1 . 2]" 1
619 1 33 GLU HA 1 65 LYS HG2 . . 5.380 4.878 4.728 5.063 . 0 0 "[ . 1 . 2]" 1
620 1 33 GLU HB2 1 34 LEU H . . 4.020 3.890 3.742 4.011 . 0 0 "[ . 1 . 2]" 1
621 1 33 GLU HB3 1 34 LEU H . . 3.270 2.690 2.598 2.819 . 0 0 "[ . 1 . 2]" 1
622 1 33 GLU HB3 1 54 TRP HZ3 . . 5.060 3.556 3.164 3.840 . 0 0 "[ . 1 . 2]" 1
623 1 33 GLU HB3 1 65 LYS H . . 4.650 4.437 4.288 4.630 . 0 0 "[ . 1 . 2]" 1
624 1 33 GLU HG2 1 34 LEU H . . 4.200 3.969 3.735 4.190 . 0 0 "[ . 1 . 2]" 1
625 1 33 GLU HG2 1 54 TRP HE3 . . 5.370 3.898 3.723 4.175 . 0 0 "[ . 1 . 2]" 1
626 1 33 GLU HG2 1 54 TRP HH2 . . 5.040 3.691 3.457 4.037 . 0 0 "[ . 1 . 2]" 1
627 1 33 GLU HG2 1 54 TRP HZ2 . . 5.500 5.358 5.029 5.510 0.010 11 0 "[ . 1 . 2]" 1
628 1 33 GLU HG2 1 54 TRP HZ3 . . 4.640 2.644 2.450 2.878 . 0 0 "[ . 1 . 2]" 1
629 1 33 GLU HG2 1 65 LYS H . . 4.490 3.990 3.535 4.382 . 0 0 "[ . 1 . 2]" 1
630 1 33 GLU HG2 1 65 LYS HB2 . . 3.930 2.645 2.156 3.051 . 0 0 "[ . 1 . 2]" 1
631 1 33 GLU HG3 1 34 LEU H . . 4.930 4.706 4.594 4.951 0.021 11 0 "[ . 1 . 2]" 1
632 1 33 GLU HG3 1 54 TRP HE3 . . 5.500 5.320 5.081 5.493 . 0 0 "[ . 1 . 2]" 1
633 1 33 GLU HG3 1 54 TRP HH2 . . 5.500 5.090 4.811 5.413 . 0 0 "[ . 1 . 2]" 1
634 1 33 GLU HG3 1 54 TRP HZ3 . . 4.950 4.367 4.180 4.523 . 0 0 "[ . 1 . 2]" 1
635 1 33 GLU HG3 1 65 LYS H . . 4.200 4.100 3.983 4.210 0.010 11 0 "[ . 1 . 2]" 1
636 1 33 GLU HG3 1 65 LYS HB2 . . 4.110 3.223 3.006 3.531 . 0 0 "[ . 1 . 2]" 1
637 1 34 LEU H 1 34 LEU HB2 . . 3.220 2.404 2.357 2.452 . 0 0 "[ . 1 . 2]" 1
638 1 34 LEU H 1 34 LEU HB3 . . 3.750 3.551 3.528 3.577 . 0 0 "[ . 1 . 2]" 1
639 1 34 LEU H 1 34 LEU MD1 . . 4.420 4.271 4.207 4.330 . 0 0 "[ . 1 . 2]" 1
640 1 34 LEU H 1 34 LEU MD2 . . 4.210 4.166 4.122 4.216 0.006 18 0 "[ . 1 . 2]" 1
641 1 34 LEU H 1 34 LEU HG . . 3.690 3.640 3.592 3.681 . 0 0 "[ . 1 . 2]" 1
642 1 34 LEU H 1 36 LEU MD2 . . 4.820 4.563 4.201 4.815 . 0 0 "[ . 1 . 2]" 1
643 1 34 LEU H 1 64 GLY HA2 . . 5.110 4.985 4.716 5.110 . 0 0 "[ . 1 . 2]" 1
644 1 34 LEU H 1 64 GLY HA3 . . 4.070 3.492 3.228 3.628 . 0 0 "[ . 1 . 2]" 1
645 1 34 LEU H 1 65 LYS H . . 3.840 3.338 3.034 3.642 . 0 0 "[ . 1 . 2]" 1
646 1 34 LEU H 1 65 LYS HB2 . . 5.240 4.352 4.149 4.619 . 0 0 "[ . 1 . 2]" 1
647 1 34 LEU H 1 66 VAL HA . . 4.710 4.010 3.821 4.206 . 0 0 "[ . 1 . 2]" 1
648 1 34 LEU H 1 66 VAL MG1 . . 3.740 3.418 3.053 3.523 . 0 0 "[ . 1 . 2]" 1
649 1 34 LEU HA 1 34 LEU MD1 . . 3.880 3.793 3.783 3.806 . 0 0 "[ . 1 . 2]" 1
650 1 34 LEU HA 1 34 LEU MD2 . . 3.110 2.009 1.942 2.096 . 0 0 "[ . 1 . 2]" 1
651 1 34 LEU HA 1 34 LEU HG . . 3.770 2.826 2.772 2.860 . 0 0 "[ . 1 . 2]" 1
652 1 34 LEU HA 1 35 SER H . . 2.620 2.271 2.254 2.303 . 0 0 "[ . 1 . 2]" 1
653 1 34 LEU HA 1 66 VAL MG1 . . 5.060 4.927 4.708 5.064 0.004 10 0 "[ . 1 . 2]" 1
654 1 34 LEU HB2 1 34 LEU MD1 . . 3.390 2.372 2.336 2.429 . 0 0 "[ . 1 . 2]" 1
655 1 34 LEU HB2 1 34 LEU MD2 . . 3.670 3.180 3.177 3.190 . 0 0 "[ . 1 . 2]" 1
656 1 34 LEU HB2 1 35 SER H . . 4.170 4.119 4.056 4.149 . 0 0 "[ . 1 . 2]" 1
657 1 34 LEU HB2 1 36 LEU MD2 . . 3.930 3.656 3.488 3.904 . 0 0 "[ . 1 . 2]" 1
658 1 34 LEU HB2 1 57 GLY H . . 5.500 4.559 4.426 4.699 . 0 0 "[ . 1 . 2]" 1
659 1 34 LEU HB2 1 63 LYS HA . . 5.390 5.023 4.773 5.237 . 0 0 "[ . 1 . 2]" 1
660 1 34 LEU HB2 1 64 GLY H . . 4.110 3.961 3.694 4.096 . 0 0 "[ . 1 . 2]" 1
661 1 34 LEU HB2 1 64 GLY HA2 . . 4.980 4.729 4.620 4.817 . 0 0 "[ . 1 . 2]" 1
662 1 34 LEU HB2 1 64 GLY HA3 . . 3.780 3.126 3.025 3.227 . 0 0 "[ . 1 . 2]" 1
663 1 34 LEU HB2 1 65 LYS H . . 5.050 4.196 3.944 4.609 . 0 0 "[ . 1 . 2]" 1
664 1 34 LEU HB2 1 66 VAL HA . . 5.040 4.665 4.461 4.923 . 0 0 "[ . 1 . 2]" 1
665 1 34 LEU HB3 1 34 LEU MD1 . . 3.440 2.324 2.257 2.369 . 0 0 "[ . 1 . 2]" 1
666 1 34 LEU HB3 1 34 LEU MD2 . . 3.460 2.349 2.313 2.381 . 0 0 "[ . 1 . 2]" 1
667 1 34 LEU HB3 1 35 SER H . . 3.370 2.864 2.764 2.915 . 0 0 "[ . 1 . 2]" 1
668 1 34 LEU HB3 1 64 GLY H . . 5.180 5.065 4.882 5.183 0.003 17 0 "[ . 1 . 2]" 1
669 1 34 LEU HB3 1 64 GLY HA3 . . 4.570 4.467 4.398 4.551 . 0 0 "[ . 1 . 2]" 1
670 1 34 LEU MD1 1 35 SER H . . 4.420 4.415 4.372 4.429 0.009 19 0 "[ . 1 . 2]" 1
671 1 34 LEU MD1 1 57 GLY H . . 4.880 3.738 3.598 3.893 . 0 0 "[ . 1 . 2]" 1
672 1 34 LEU MD1 1 58 GLU HA . . 3.850 2.814 2.681 2.944 . 0 0 "[ . 1 . 2]" 1
673 1 34 LEU MD1 1 58 GLU HB2 . . 5.500 4.644 4.481 4.865 . 0 0 "[ . 1 . 2]" 1
674 1 34 LEU MD1 1 58 GLU HB3 . . 5.500 5.174 5.045 5.304 . 0 0 "[ . 1 . 2]" 1
675 1 34 LEU MD1 1 59 ARG H . . 3.900 2.544 2.302 2.696 . 0 0 "[ . 1 . 2]" 1
676 1 34 LEU MD1 1 59 ARG HB3 . . 3.800 3.458 3.059 3.667 . 0 0 "[ . 1 . 2]" 1
677 1 34 LEU MD1 1 59 ARG HG2 . . 5.500 5.444 5.263 5.505 0.005 19 0 "[ . 1 . 2]" 1
678 1 34 LEU MD1 1 59 ARG HG3 . . 5.500 5.297 5.080 5.490 . 0 0 "[ . 1 . 2]" 1
679 1 34 LEU MD1 1 59 ARG QH1 . . 5.340 5.274 5.168 5.342 0.002 18 0 "[ . 1 . 2]" 1
680 1 34 LEU MD1 1 62 GLN HB2 . . 3.950 3.342 3.054 3.547 . 0 0 "[ . 1 . 2]" 1
681 1 34 LEU MD1 1 62 GLN QB . . 3.300 2.681 2.541 2.784 . 0 0 "[ . 1 . 2]" 1
682 1 34 LEU MD1 1 62 GLN HB3 . . 3.950 2.830 2.632 2.936 . 0 0 "[ . 1 . 2]" 1
683 1 34 LEU MD1 1 62 GLN HG2 . . 5.170 5.025 4.918 5.152 . 0 0 "[ . 1 . 2]" 1
684 1 34 LEU MD1 1 62 GLN HG3 . . 5.350 5.197 5.096 5.333 . 0 0 "[ . 1 . 2]" 1
685 1 34 LEU MD1 1 63 LYS H . . 4.300 2.920 2.727 3.306 . 0 0 "[ . 1 . 2]" 1
686 1 34 LEU MD1 1 63 LYS HA . . 3.650 1.962 1.867 2.060 . 0 0 "[ . 1 . 2]" 1
687 1 34 LEU MD1 1 64 GLY H . . 3.580 2.084 1.922 2.293 . 0 0 "[ . 1 . 2]" 1
688 1 34 LEU MD1 1 64 GLY HA2 . . 4.490 3.889 3.727 3.989 . 0 0 "[ . 1 . 2]" 1
689 1 34 LEU MD1 1 64 GLY HA3 . . 4.520 2.998 2.807 3.102 . 0 0 "[ . 1 . 2]" 1
690 1 34 LEU MD2 1 35 SER H . . 3.700 2.403 2.340 2.608 . 0 0 "[ . 1 . 2]" 1
691 1 34 LEU MD2 1 58 GLU HA . . 4.850 4.814 4.727 4.854 0.004 15 0 "[ . 1 . 2]" 1
692 1 34 LEU MD2 1 59 ARG H . . 3.910 3.842 3.656 3.915 0.005 12 0 "[ . 1 . 2]" 1
693 1 34 LEU MD2 1 59 ARG QH1 . . 5.210 4.736 4.496 5.119 . 0 0 "[ . 1 . 2]" 1
694 1 34 LEU MD2 1 62 GLN HB2 . . 3.960 2.669 2.488 2.964 . 0 0 "[ . 1 . 2]" 1
695 1 34 LEU MD2 1 62 GLN QB . . 3.300 1.937 1.856 2.168 . 0 0 "[ . 1 . 2]" 1
696 1 34 LEU MD2 1 62 GLN HB3 . . 3.960 1.993 1.915 2.292 . 0 0 "[ . 1 . 2]" 1
697 1 34 LEU MD2 1 62 GLN HG2 . . 4.360 3.999 3.631 4.284 . 0 0 "[ . 1 . 2]" 1
698 1 34 LEU MD2 1 62 GLN HG3 . . 4.770 4.184 4.075 4.284 . 0 0 "[ . 1 . 2]" 1
699 1 34 LEU MD2 1 63 LYS H . . 4.280 3.325 3.006 3.690 . 0 0 "[ . 1 . 2]" 1
700 1 34 LEU MD2 1 63 LYS HA . . 3.990 3.932 3.818 3.998 0.008 13 0 "[ . 1 . 2]" 1
701 1 34 LEU MD2 1 64 GLY H . . 4.410 4.398 4.344 4.421 0.011 17 0 "[ . 1 . 2]" 1
702 1 34 LEU MD2 1 64 GLY HA2 . . 4.840 4.834 4.806 4.852 0.012 5 0 "[ . 1 . 2]" 1
703 1 34 LEU MD2 1 64 GLY HA3 . . 3.900 3.648 3.618 3.685 . 0 0 "[ . 1 . 2]" 1
704 1 34 LEU HG 1 35 SER H . . 4.640 4.607 4.539 4.647 0.007 4 0 "[ . 1 . 2]" 1
705 1 34 LEU HG 1 64 GLY H . . 4.450 3.271 3.134 3.386 . 0 0 "[ . 1 . 2]" 1
706 1 34 LEU HG 1 64 GLY HA2 . . 3.930 3.538 3.493 3.583 . 0 0 "[ . 1 . 2]" 1
707 1 34 LEU HG 1 64 GLY HA3 . . 3.670 2.000 1.994 2.020 . 0 0 "[ . 1 . 2]" 1
708 1 34 LEU HG 1 65 LYS H . . 5.120 4.240 4.038 4.536 . 0 0 "[ . 1 . 2]" 1
709 1 35 SER H 1 35 SER HB2 . . 3.720 2.685 2.205 3.614 . 0 0 "[ . 1 . 2]" 1
710 1 35 SER H 1 35 SER QB . . 3.010 2.337 2.183 2.459 . 0 0 "[ . 1 . 2]" 1
711 1 35 SER H 1 35 SER HB3 . . 3.720 3.139 2.367 3.624 . 0 0 "[ . 1 . 2]" 1
712 1 35 SER H 1 36 LEU MD2 . . 4.890 4.324 3.929 4.580 . 0 0 "[ . 1 . 2]" 1
713 1 35 SER HA 1 36 LEU H . . 2.820 2.223 2.168 2.320 . 0 0 "[ . 1 . 2]" 1
714 1 35 SER HA 1 36 LEU QB . . 4.660 4.460 4.361 4.521 . 0 0 "[ . 1 . 2]" 1
715 1 35 SER HA 1 36 LEU MD2 . . 4.460 4.017 3.548 4.298 . 0 0 "[ . 1 . 2]" 1
716 1 35 SER HA 1 36 LEU HG . . 4.140 3.544 3.324 3.723 . 0 0 "[ . 1 . 2]" 1
717 1 35 SER QB 1 36 LEU H . . 3.360 3.041 2.824 3.373 0.013 14 0 "[ . 1 . 2]" 1
718 1 35 SER QB 1 36 LEU MD2 . . 4.740 4.562 4.383 4.745 0.005 5 0 "[ . 1 . 2]" 1
719 1 35 SER HB2 1 36 LEU MD2 . . 5.480 5.157 4.822 5.436 . 0 0 "[ . 1 . 2]" 1
720 1 35 SER HB3 1 36 LEU MD2 . . 5.480 5.122 4.689 5.470 . 0 0 "[ . 1 . 2]" 1
721 1 36 LEU H 1 36 LEU QB . . 3.490 2.681 2.584 2.824 . 0 0 "[ . 1 . 2]" 1
722 1 36 LEU H 1 36 LEU MD1 . . 4.880 4.026 3.849 4.194 . 0 0 "[ . 1 . 2]" 1
723 1 36 LEU H 1 36 LEU MD2 . . 3.910 3.536 3.226 3.807 . 0 0 "[ . 1 . 2]" 1
724 1 36 LEU H 1 36 LEU HG . . 3.690 2.775 2.643 3.008 . 0 0 "[ . 1 . 2]" 1
725 1 36 LEU HA 1 36 LEU MD1 . . 4.450 3.889 3.793 3.956 . 0 0 "[ . 1 . 2]" 1
726 1 36 LEU HA 1 36 LEU MD2 . . 2.850 2.172 1.991 2.410 . 0 0 "[ . 1 . 2]" 1
727 1 36 LEU HA 1 36 LEU HG . . 3.760 3.291 3.175 3.449 . 0 0 "[ . 1 . 2]" 1
728 1 36 LEU HA 1 37 LEU H . . 2.880 2.277 2.193 2.346 . 0 0 "[ . 1 . 2]" 1
729 1 36 LEU HA 1 37 LEU HG . . 4.300 4.123 3.969 4.292 . 0 0 "[ . 1 . 2]" 1
730 1 36 LEU HA 1 59 ARG HH11 . . 4.450 2.868 2.433 3.361 . 0 0 "[ . 1 . 2]" 1
731 1 36 LEU HA 1 59 ARG QH1 . . 3.870 2.737 2.205 3.211 . 0 0 "[ . 1 . 2]" 1
732 1 36 LEU HA 1 59 ARG HH12 . . 4.450 3.518 2.523 4.258 . 0 0 "[ . 1 . 2]" 1
733 1 36 LEU QB 1 36 LEU MD1 . . 3.090 2.088 2.058 2.100 . 0 0 "[ . 1 . 2]" 1
734 1 36 LEU QB 1 37 LEU H . . 3.480 2.702 2.510 2.952 . 0 0 "[ . 1 . 2]" 1
735 1 36 LEU MD1 1 66 VAL HA . . 4.090 3.081 2.909 3.283 . 0 0 "[ . 1 . 2]" 1
736 1 36 LEU MD1 1 66 VAL HB . . 3.380 2.124 1.970 2.432 . 0 0 "[ . 1 . 2]" 1
737 1 36 LEU MD1 1 67 PRO HD2 . . 3.420 2.028 1.865 2.240 . 0 0 "[ . 1 . 2]" 1
738 1 36 LEU MD1 1 67 PRO HD3 . . 3.930 3.457 3.115 3.714 . 0 0 "[ . 1 . 2]" 1
739 1 36 LEU MD1 1 70 TYR HB2 . . 3.380 2.975 2.653 3.185 . 0 0 "[ . 1 . 2]" 1
740 1 36 LEU MD1 1 70 TYR HB3 . . 4.040 3.161 2.816 3.343 . 0 0 "[ . 1 . 2]" 1
741 1 36 LEU MD1 1 70 TYR QD . . 4.610 3.901 3.424 4.130 . 0 0 "[ . 1 . 2]" 1
742 1 36 LEU MD1 1 70 TYR QE . . 5.500 5.310 4.876 5.501 0.001 3 0 "[ . 1 . 2]" 1
743 1 36 LEU MD1 1 71 LEU H . . 4.860 4.794 4.672 4.864 0.004 10 0 "[ . 1 . 2]" 1
744 1 36 LEU MD1 1 71 LEU MD2 . . 2.820 2.097 1.905 2.502 . 0 0 "[ . 1 . 2]" 1
745 1 36 LEU MD2 1 37 LEU H . . 3.880 3.664 3.488 3.882 0.002 16 0 "[ . 1 . 2]" 1
746 1 36 LEU MD2 1 59 ARG QD . . 4.660 3.637 3.215 4.050 . 0 0 "[ . 1 . 2]" 1
747 1 36 LEU MD2 1 59 ARG QH1 . . 4.150 3.573 3.218 3.947 . 0 0 "[ . 1 . 2]" 1
748 1 36 LEU MD2 1 66 VAL HA . . 4.710 3.855 3.424 4.155 . 0 0 "[ . 1 . 2]" 1
749 1 36 LEU HG 1 37 LEU H . . 5.400 5.102 5.001 5.197 . 0 0 "[ . 1 . 2]" 1
750 1 37 LEU H 1 37 LEU HB2 . . 3.270 2.415 2.304 2.520 . 0 0 "[ . 1 . 2]" 1
751 1 37 LEU H 1 37 LEU HB3 . . 3.710 3.626 3.550 3.688 . 0 0 "[ . 1 . 2]" 1
752 1 37 LEU H 1 37 LEU MD2 . . 4.190 4.147 3.994 4.198 0.008 14 0 "[ . 1 . 2]" 1
753 1 37 LEU H 1 37 LEU HG . . 3.450 3.312 2.978 3.458 0.008 9 0 "[ . 1 . 2]" 1
754 1 37 LEU H 1 40 GLU H . . 5.390 5.120 4.905 5.294 . 0 0 "[ . 1 . 2]" 1
755 1 37 LEU H 1 40 GLU HB2 . . 4.660 4.546 4.404 4.660 . 0 0 "[ . 1 . 2]" 1
756 1 37 LEU H 1 40 GLU HB3 . . 4.210 3.843 3.635 4.012 . 0 0 "[ . 1 . 2]" 1
757 1 37 LEU H 1 40 GLU HG2 . . 4.360 2.630 2.474 3.002 . 0 0 "[ . 1 . 2]" 1
758 1 37 LEU H 1 40 GLU HG3 . . 3.990 3.728 3.625 4.000 0.010 10 0 "[ . 1 . 2]" 1
759 1 37 LEU H 1 59 ARG QH1 . . 4.990 3.616 2.942 4.160 . 0 0 "[ . 1 . 2]" 1
760 1 37 LEU HA 1 37 LEU MD2 . . 2.840 2.082 1.986 2.268 . 0 0 "[ . 1 . 2]" 1
761 1 37 LEU HA 1 37 LEU HG . . 3.770 2.802 2.713 2.982 . 0 0 "[ . 1 . 2]" 1
762 1 37 LEU HA 1 38 ALA H . . 2.530 2.319 2.169 2.435 . 0 0 "[ . 1 . 2]" 1
763 1 37 LEU HA 1 38 ALA HA . . 4.420 4.326 4.318 4.342 . 0 0 "[ . 1 . 2]" 1
764 1 37 LEU HA 1 38 ALA MB . . 4.030 3.988 3.953 4.040 0.010 11 0 "[ . 1 . 2]" 1
765 1 37 LEU HB2 1 37 LEU MD1 . . 3.200 2.229 2.087 2.358 . 0 0 "[ . 1 . 2]" 1
766 1 37 LEU HB2 1 38 ALA H . . 4.290 3.950 3.756 4.273 . 0 0 "[ . 1 . 2]" 1
767 1 37 LEU HB2 1 40 GLU H . . 5.120 5.032 4.547 5.125 0.005 5 0 "[ . 1 . 2]" 1
768 1 37 LEU HB2 1 40 GLU HB2 . . 4.810 3.507 3.184 3.708 . 0 0 "[ . 1 . 2]" 1
769 1 37 LEU HB2 1 40 GLU HB3 . . 4.500 2.682 2.307 2.836 . 0 0 "[ . 1 . 2]" 1
770 1 37 LEU HB2 1 40 GLU HG2 . . 3.890 3.274 3.184 3.452 . 0 0 "[ . 1 . 2]" 1
771 1 37 LEU HB2 1 40 GLU HG3 . . 4.330 4.191 4.076 4.288 . 0 0 "[ . 1 . 2]" 1
772 1 37 LEU HB3 1 37 LEU MD1 . . 3.420 2.450 2.328 2.563 . 0 0 "[ . 1 . 2]" 1
773 1 37 LEU HB3 1 37 LEU MD2 . . 3.620 2.292 2.186 2.340 . 0 0 "[ . 1 . 2]" 1
774 1 37 LEU HB3 1 38 ALA H . . 3.560 2.671 2.381 3.198 . 0 0 "[ . 1 . 2]" 1
775 1 37 LEU HB3 1 40 GLU H . . 5.310 5.182 4.832 5.315 0.005 1 0 "[ . 1 . 2]" 1
776 1 37 LEU HB3 1 40 GLU HB2 . . 5.120 4.500 4.243 4.741 . 0 0 "[ . 1 . 2]" 1
777 1 37 LEU HB3 1 40 GLU HG2 . . 4.520 4.272 4.131 4.427 . 0 0 "[ . 1 . 2]" 1
778 1 37 LEU HB3 1 40 GLU HG3 . . 5.500 5.492 5.377 5.513 0.013 8 0 "[ . 1 . 2]" 1
779 1 37 LEU MD2 1 38 ALA H . . 3.650 2.912 2.651 3.106 . 0 0 "[ . 1 . 2]" 1
780 1 37 LEU HG 1 38 ALA H . . 5.170 4.649 4.457 4.882 . 0 0 "[ . 1 . 2]" 1
781 1 38 ALA H 1 38 ALA MB . . 2.590 2.074 2.033 2.127 . 0 0 "[ . 1 . 2]" 1
782 1 38 ALA HA 1 39 ASP H . . 2.500 2.160 2.147 2.183 . 0 0 "[ . 1 . 2]" 1
783 1 38 ALA HA 1 39 ASP HA . . 4.550 4.386 4.375 4.395 . 0 0 "[ . 1 . 2]" 1
784 1 38 ALA HA 1 40 GLU H . . 3.840 3.758 3.546 3.858 0.018 9 0 "[ . 1 . 2]" 1
785 1 38 ALA MB 1 39 ASP H . . 3.480 3.108 2.997 3.178 . 0 0 "[ . 1 . 2]" 1
786 1 38 ALA MB 1 39 ASP HA . . 4.650 4.481 4.434 4.531 . 0 0 "[ . 1 . 2]" 1
787 1 38 ALA MB 1 39 ASP HB2 . . 4.070 3.924 3.671 4.063 . 0 0 "[ . 1 . 2]" 1
788 1 38 ALA MB 1 39 ASP HB3 . . 4.990 4.801 4.777 4.826 . 0 0 "[ . 1 . 2]" 1
789 1 38 ALA MB 1 40 GLU H . . 4.920 4.793 4.608 4.876 . 0 0 "[ . 1 . 2]" 1
790 1 39 ASP H 1 39 ASP HA . . 2.630 2.284 2.276 2.286 . 0 0 "[ . 1 . 2]" 1
791 1 39 ASP H 1 39 ASP HB2 . . 4.010 3.766 3.619 3.815 . 0 0 "[ . 1 . 2]" 1
792 1 39 ASP H 1 39 ASP HB3 . . 4.130 4.046 4.025 4.070 . 0 0 "[ . 1 . 2]" 1
793 1 39 ASP H 1 40 GLU H . . 3.530 2.528 2.458 2.615 . 0 0 "[ . 1 . 2]" 1
794 1 39 ASP H 1 40 GLU HB3 . . 5.500 4.605 4.543 4.671 . 0 0 "[ . 1 . 2]" 1
795 1 39 ASP HB2 1 40 GLU H . . 4.450 4.210 4.080 4.262 . 0 0 "[ . 1 . 2]" 1
796 1 39 ASP HB2 1 40 GLU HA . . 5.060 4.711 4.585 4.792 . 0 0 "[ . 1 . 2]" 1
797 1 39 ASP HB3 1 40 GLU H . . 4.570 4.524 4.478 4.552 . 0 0 "[ . 1 . 2]" 1
798 1 39 ASP HB3 1 40 GLU HA . . 5.080 5.010 4.841 5.079 . 0 0 "[ . 1 . 2]" 1
799 1 40 GLU H 1 40 GLU HB2 . . 3.890 3.861 3.757 3.899 0.009 15 0 "[ . 1 . 2]" 1
800 1 40 GLU H 1 40 GLU HB3 . . 3.540 2.854 2.668 2.925 . 0 0 "[ . 1 . 2]" 1
801 1 40 GLU H 1 40 GLU HG2 . . 3.710 2.813 2.667 2.903 . 0 0 "[ . 1 . 2]" 1
802 1 40 GLU H 1 40 GLU HG3 . . 3.970 3.632 3.564 3.702 . 0 0 "[ . 1 . 2]" 1
803 1 40 GLU HA 1 40 GLU HB3 . . 3.020 2.650 2.636 2.668 . 0 0 "[ . 1 . 2]" 1
804 1 40 GLU HA 1 40 GLU HG2 . . 4.020 3.870 3.855 3.875 . 0 0 "[ . 1 . 2]" 1
805 1 40 GLU HA 1 40 GLU HG3 . . 3.740 3.511 3.488 3.529 . 0 0 "[ . 1 . 2]" 1
806 1 40 GLU HA 1 41 VAL H . . 2.700 2.230 2.158 2.592 . 0 0 "[ . 1 . 2]" 1
807 1 40 GLU HA 1 41 VAL HB . . 5.070 4.495 4.305 4.796 . 0 0 "[ . 1 . 2]" 1
808 1 40 GLU HA 1 41 VAL QG . . 3.750 3.656 3.396 3.762 0.012 7 0 "[ . 1 . 2]" 1
809 1 40 GLU HB2 1 41 VAL H . . 3.640 3.155 2.364 3.360 . 0 0 "[ . 1 . 2]" 1
810 1 40 GLU HB2 1 42 ILE MG . . 4.210 3.872 3.613 4.041 . 0 0 "[ . 1 . 2]" 1
811 1 40 GLU HB3 1 41 VAL H . . 4.480 4.268 3.750 4.392 . 0 0 "[ . 1 . 2]" 1
812 1 40 GLU HB3 1 42 ILE MG . . 4.970 4.827 4.613 4.935 . 0 0 "[ . 1 . 2]" 1
813 1 40 GLU HG2 1 41 VAL H . . 4.850 4.624 3.885 4.793 . 0 0 "[ . 1 . 2]" 1
814 1 40 GLU HG2 1 42 ILE MG . . 3.880 3.811 3.691 3.888 0.008 12 0 "[ . 1 . 2]" 1
815 1 40 GLU HG3 1 41 VAL H . . 4.490 3.431 2.441 3.661 . 0 0 "[ . 1 . 2]" 1
816 1 40 GLU HG3 1 42 ILE MG . . 4.080 2.498 2.299 2.619 . 0 0 "[ . 1 . 2]" 1
817 1 41 VAL H 1 41 VAL HB . . 3.330 2.655 2.423 3.272 . 0 0 "[ . 1 . 2]" 1
818 1 41 VAL H 1 41 VAL MG1 . . 4.130 3.388 1.872 3.827 . 0 0 "[ . 1 . 2]" 1
819 1 41 VAL H 1 41 VAL QG . . 3.050 2.640 1.867 3.084 0.034 6 0 "[ . 1 . 2]" 1
820 1 41 VAL H 1 41 VAL MG2 . . 4.130 3.090 2.748 3.781 . 0 0 "[ . 1 . 2]" 1
821 1 41 VAL H 1 42 ILE H . . 4.800 4.321 4.119 4.464 . 0 0 "[ . 1 . 2]" 1
822 1 41 VAL H 1 42 ILE MG . . 4.200 4.045 3.509 4.197 . 0 0 "[ . 1 . 2]" 1
823 1 41 VAL HA 1 41 VAL MG1 . . 3.190 2.608 2.405 3.181 . 0 0 "[ . 1 . 2]" 1
824 1 41 VAL HA 1 41 VAL QG . . 2.740 2.176 2.091 2.414 . 0 0 "[ . 1 . 2]" 1
825 1 41 VAL HA 1 41 VAL MG2 . . 3.190 2.347 2.281 2.504 . 0 0 "[ . 1 . 2]" 1
826 1 41 VAL HA 1 42 ILE H . . 2.590 2.145 2.140 2.166 . 0 0 "[ . 1 . 2]" 1
827 1 41 VAL HA 1 42 ILE HG12 . . 4.560 4.054 3.925 4.187 . 0 0 "[ . 1 . 2]" 1
828 1 41 VAL HA 1 42 ILE MG . . 4.020 3.850 3.687 3.966 . 0 0 "[ . 1 . 2]" 1
829 1 41 VAL HB 1 42 ILE H . . 4.410 4.305 4.137 4.415 0.005 7 0 "[ . 1 . 2]" 1
830 1 41 VAL QG 1 42 ILE H . . 3.070 2.628 2.242 2.944 . 0 0 "[ . 1 . 2]" 1
831 1 41 VAL QG 1 43 THR HA . . 4.960 4.545 4.484 4.646 . 0 0 "[ . 1 . 2]" 1
832 1 41 VAL MG1 1 42 ILE H . . 4.510 2.959 2.256 4.274 . 0 0 "[ . 1 . 2]" 1
833 1 41 VAL MG2 1 42 ILE H . . 4.510 3.694 2.631 4.062 . 0 0 "[ . 1 . 2]" 1
834 1 42 ILE H 1 42 ILE MD . . 4.040 3.929 3.854 4.037 . 0 0 "[ . 1 . 2]" 1
835 1 42 ILE H 1 42 ILE HG12 . . 3.300 2.429 2.288 2.694 . 0 0 "[ . 1 . 2]" 1
836 1 42 ILE H 1 42 ILE HG13 . . 3.430 2.694 2.569 2.792 . 0 0 "[ . 1 . 2]" 1
837 1 42 ILE H 1 42 ILE MG . . 3.440 2.910 2.803 3.045 . 0 0 "[ . 1 . 2]" 1
838 1 42 ILE H 1 43 THR H . . 4.620 4.452 4.426 4.481 . 0 0 "[ . 1 . 2]" 1
839 1 42 ILE HA 1 42 ILE HB . . 2.910 2.453 2.422 2.473 . 0 0 "[ . 1 . 2]" 1
840 1 42 ILE HA 1 42 ILE MD . . 4.220 4.146 4.118 4.162 . 0 0 "[ . 1 . 2]" 1
841 1 42 ILE HA 1 42 ILE HG13 . . 4.050 3.609 3.575 3.632 . 0 0 "[ . 1 . 2]" 1
842 1 42 ILE HA 1 42 ILE MG . . 2.840 2.255 2.209 2.315 . 0 0 "[ . 1 . 2]" 1
843 1 42 ILE HA 1 43 THR H . . 2.860 2.531 2.490 2.546 . 0 0 "[ . 1 . 2]" 1
844 1 42 ILE HA 1 43 THR HB . . 5.010 4.853 4.749 4.996 . 0 0 "[ . 1 . 2]" 1
845 1 42 ILE HA 1 58 GLU H . . 5.500 5.406 5.169 5.503 0.003 5 0 "[ . 1 . 2]" 1
846 1 42 ILE HA 1 59 ARG HA . . 5.500 5.297 4.995 5.506 0.006 17 0 "[ . 1 . 2]" 1
847 1 42 ILE HB 1 42 ILE MD . . 3.000 2.329 2.261 2.364 . 0 0 "[ . 1 . 2]" 1
848 1 42 ILE HB 1 43 THR H . . 2.790 2.120 2.081 2.198 . 0 0 "[ . 1 . 2]" 1
849 1 42 ILE HB 1 43 THR HB . . 4.900 4.273 4.186 4.388 . 0 0 "[ . 1 . 2]" 1
850 1 42 ILE HB 1 58 GLU H . . 4.140 3.303 3.116 3.424 . 0 0 "[ . 1 . 2]" 1
851 1 42 ILE MD 1 43 THR H . . 3.980 3.654 3.543 3.735 . 0 0 "[ . 1 . 2]" 1
852 1 42 ILE MD 1 43 THR HB . . 5.080 4.912 4.758 5.016 . 0 0 "[ . 1 . 2]" 1
853 1 42 ILE MD 1 44 VAL HA . . 4.570 4.102 3.813 4.273 . 0 0 "[ . 1 . 2]" 1
854 1 42 ILE MD 1 57 GLY HA2 . . 3.640 2.556 2.361 2.738 . 0 0 "[ . 1 . 2]" 1
855 1 42 ILE MD 1 57 GLY HA3 . . 3.290 2.364 2.137 2.485 . 0 0 "[ . 1 . 2]" 1
856 1 42 ILE MD 1 58 GLU H . . 3.590 2.658 2.334 2.926 . 0 0 "[ . 1 . 2]" 1
857 1 42 ILE MD 1 58 GLU HB2 . . 5.500 5.336 5.123 5.502 0.002 11 0 "[ . 1 . 2]" 1
858 1 42 ILE MD 1 58 GLU HB3 . . 5.500 4.970 4.716 5.182 . 0 0 "[ . 1 . 2]" 1
859 1 42 ILE MD 1 59 ARG HG2 . . 5.500 5.438 5.067 5.509 0.009 3 0 "[ . 1 . 2]" 1
860 1 42 ILE MD 1 59 ARG HG3 . . 5.500 4.187 3.964 4.348 . 0 0 "[ . 1 . 2]" 1
861 1 42 ILE HG12 1 43 THR H . . 4.680 4.556 4.471 4.656 . 0 0 "[ . 1 . 2]" 1
862 1 42 ILE HG13 1 43 THR H . . 3.740 3.445 3.297 3.576 . 0 0 "[ . 1 . 2]" 1
863 1 42 ILE HG13 1 43 THR HA . . 4.680 4.299 4.166 4.382 . 0 0 "[ . 1 . 2]" 1
864 1 42 ILE HG13 1 44 VAL MG1 . . 3.240 2.409 2.245 2.511 . 0 0 "[ . 1 . 2]" 1
865 1 42 ILE HG13 1 58 GLU H . . 4.890 4.194 3.847 4.495 . 0 0 "[ . 1 . 2]" 1
866 1 42 ILE MG 1 43 THR H . . 3.690 3.592 3.542 3.643 . 0 0 "[ . 1 . 2]" 1
867 1 42 ILE MG 1 58 GLU H . . 4.810 4.523 4.403 4.671 . 0 0 "[ . 1 . 2]" 1
868 1 42 ILE MG 1 59 ARG HA . . 3.920 3.593 3.216 3.896 . 0 0 "[ . 1 . 2]" 1
869 1 42 ILE MG 1 59 ARG HB2 . . 3.420 2.981 2.221 3.415 . 0 0 "[ . 1 . 2]" 1
870 1 42 ILE MG 1 59 ARG HB3 . . 4.650 4.269 3.522 4.651 0.001 5 0 "[ . 1 . 2]" 1
871 1 42 ILE MG 1 59 ARG HD2 . . 3.870 3.087 2.421 3.556 . 0 0 "[ . 1 . 2]" 1
872 1 42 ILE MG 1 59 ARG HD3 . . 3.870 3.125 2.521 3.873 0.003 18 0 "[ . 1 . 2]" 1
873 1 42 ILE MG 1 59 ARG HE . . 5.150 4.908 4.020 5.154 0.004 19 0 "[ . 1 . 2]" 1
874 1 42 ILE MG 1 59 ARG HG2 . . 4.170 3.859 3.480 4.132 . 0 0 "[ . 1 . 2]" 1
875 1 42 ILE MG 1 59 ARG QG . . 3.340 2.351 1.975 2.678 . 0 0 "[ . 1 . 2]" 1
876 1 42 ILE MG 1 59 ARG HG3 . . 4.170 2.372 1.985 2.716 . 0 0 "[ . 1 . 2]" 1
877 1 43 THR H 1 43 THR HB . . 3.060 2.438 2.380 2.565 . 0 0 "[ . 1 . 2]" 1
878 1 43 THR H 1 43 THR MG . . 3.820 3.761 3.735 3.798 . 0 0 "[ . 1 . 2]" 1
879 1 43 THR H 1 44 VAL H . . 4.620 4.445 4.373 4.524 . 0 0 "[ . 1 . 2]" 1
880 1 43 THR H 1 44 VAL MG1 . . 4.810 4.303 4.201 4.418 . 0 0 "[ . 1 . 2]" 1
881 1 43 THR H 1 58 GLU H . . 3.650 3.356 3.096 3.515 . 0 0 "[ . 1 . 2]" 1
882 1 43 THR H 1 58 GLU HB2 . . 5.500 5.280 4.924 5.504 0.004 13 0 "[ . 1 . 2]" 1
883 1 43 THR H 1 58 GLU HB3 . . 5.120 3.862 3.557 4.042 . 0 0 "[ . 1 . 2]" 1
884 1 43 THR HA 1 43 THR MG . . 3.090 2.419 2.381 2.456 . 0 0 "[ . 1 . 2]" 1
885 1 43 THR HA 1 44 VAL H . . 2.690 2.144 2.141 2.162 . 0 0 "[ . 1 . 2]" 1
886 1 43 THR HA 1 44 VAL HA . . 4.620 4.398 4.396 4.407 . 0 0 "[ . 1 . 2]" 1
887 1 43 THR HA 1 44 VAL MG1 . . 4.010 3.831 3.639 4.002 . 0 0 "[ . 1 . 2]" 1
888 1 43 THR HA 1 44 VAL MG2 . . 4.000 3.828 3.741 3.932 . 0 0 "[ . 1 . 2]" 1
889 1 43 THR HB 1 44 VAL H . . 4.440 4.314 4.204 4.406 . 0 0 "[ . 1 . 2]" 1
890 1 43 THR HB 1 58 GLU H . . 3.940 3.430 3.184 3.720 . 0 0 "[ . 1 . 2]" 1
891 1 43 THR HB 1 58 GLU HB2 . . 4.180 3.791 3.449 4.121 . 0 0 "[ . 1 . 2]" 1
892 1 43 THR HB 1 58 GLU HB3 . . 3.320 2.438 2.290 2.562 . 0 0 "[ . 1 . 2]" 1
893 1 43 THR HB 1 58 GLU HG2 . . 4.650 4.588 4.470 4.651 0.001 17 0 "[ . 1 . 2]" 1
894 1 43 THR HB 1 58 GLU HG3 . . 5.500 5.396 5.168 5.501 0.001 4 0 "[ . 1 . 2]" 1
895 1 43 THR MG 1 44 VAL H . . 3.130 2.582 2.292 2.770 . 0 0 "[ . 1 . 2]" 1
896 1 43 THR MG 1 44 VAL HA . . 4.240 3.631 3.437 3.748 . 0 0 "[ . 1 . 2]" 1
897 1 43 THR MG 1 44 VAL MG2 . . 4.120 3.964 3.885 4.044 . 0 0 "[ . 1 . 2]" 1
898 1 43 THR MG 1 45 PHE HB3 . . 5.350 3.758 3.652 3.860 . 0 0 "[ . 1 . 2]" 1
899 1 43 THR MG 1 45 PHE QD . . 3.540 2.665 2.435 2.918 . 0 0 "[ . 1 . 2]" 1
900 1 43 THR MG 1 45 PHE QE . . 3.830 3.097 2.632 3.675 . 0 0 "[ . 1 . 2]" 1
901 1 43 THR MG 1 45 PHE HZ . . 5.430 4.823 4.440 5.314 . 0 0 "[ . 1 . 2]" 1
902 1 43 THR MG 1 58 GLU H . . 5.300 4.162 3.857 4.463 . 0 0 "[ . 1 . 2]" 1
903 1 43 THR MG 1 58 GLU HB2 . . 4.520 3.776 3.527 4.226 . 0 0 "[ . 1 . 2]" 1
904 1 43 THR MG 1 58 GLU HB3 . . 4.540 3.276 3.066 3.528 . 0 0 "[ . 1 . 2]" 1
905 1 43 THR MG 1 58 GLU HG2 . . 5.500 5.186 4.986 5.453 . 0 0 "[ . 1 . 2]" 1
906 1 43 THR MG 1 58 GLU HG3 . . 5.500 5.482 5.315 5.507 0.007 8 0 "[ . 1 . 2]" 1
907 1 44 VAL H 1 44 VAL HB . . 4.100 3.772 3.725 3.831 . 0 0 "[ . 1 . 2]" 1
908 1 44 VAL H 1 44 VAL MG1 . . 3.450 2.873 2.670 3.062 . 0 0 "[ . 1 . 2]" 1
909 1 44 VAL H 1 44 VAL MG2 . . 2.940 2.133 1.981 2.247 . 0 0 "[ . 1 . 2]" 1
910 1 44 VAL H 1 45 PHE HA . . 5.300 5.124 5.039 5.209 . 0 0 "[ . 1 . 2]" 1
911 1 44 VAL H 1 45 PHE QD . . 4.980 3.821 3.720 3.984 . 0 0 "[ . 1 . 2]" 1
912 1 44 VAL HA 1 44 VAL MG1 . . 2.940 2.324 2.180 2.406 . 0 0 "[ . 1 . 2]" 1
913 1 44 VAL HA 1 44 VAL MG2 . . 3.650 3.187 3.185 3.190 . 0 0 "[ . 1 . 2]" 1
914 1 44 VAL HA 1 45 PHE H . . 2.750 2.235 2.195 2.297 . 0 0 "[ . 1 . 2]" 1
915 1 44 VAL HA 1 45 PHE QD . . 4.070 2.582 2.493 2.714 . 0 0 "[ . 1 . 2]" 1
916 1 44 VAL HA 1 45 PHE QE . . 5.080 3.696 3.598 3.819 . 0 0 "[ . 1 . 2]" 1
917 1 44 VAL HA 1 55 LEU HB2 . . 5.260 4.924 4.809 5.069 . 0 0 "[ . 1 . 2]" 1
918 1 44 VAL HA 1 55 LEU HB3 . . 4.650 3.691 3.541 3.820 . 0 0 "[ . 1 . 2]" 1
919 1 44 VAL HA 1 55 LEU MD1 . . 5.130 4.452 4.315 4.687 . 0 0 "[ . 1 . 2]" 1
920 1 44 VAL HA 1 56 MET H . . 4.830 4.137 4.018 4.457 . 0 0 "[ . 1 . 2]" 1
921 1 44 VAL HA 1 57 GLY H . . 4.850 4.544 4.472 4.649 . 0 0 "[ . 1 . 2]" 1
922 1 44 VAL HA 1 57 GLY HA2 . . 3.060 2.588 2.500 2.663 . 0 0 "[ . 1 . 2]" 1
923 1 44 VAL HA 1 57 GLY HA3 . . 4.300 4.155 4.000 4.286 . 0 0 "[ . 1 . 2]" 1
924 1 44 VAL HA 1 58 GLU H . . 4.220 4.071 3.939 4.221 0.001 20 0 "[ . 1 . 2]" 1
925 1 44 VAL HA 1 66 VAL MG2 . . 4.800 3.779 3.645 3.971 . 0 0 "[ . 1 . 2]" 1
926 1 44 VAL HB 1 45 PHE H . . 3.100 2.850 2.658 2.999 . 0 0 "[ . 1 . 2]" 1
927 1 44 VAL HB 1 45 PHE HA . . 4.690 4.275 4.212 4.332 . 0 0 "[ . 1 . 2]" 1
928 1 44 VAL HB 1 55 LEU HB2 . . 3.800 3.170 2.995 3.300 . 0 0 "[ . 1 . 2]" 1
929 1 44 VAL HB 1 55 LEU HB3 . . 3.560 2.319 2.107 2.420 . 0 0 "[ . 1 . 2]" 1
930 1 44 VAL HB 1 55 LEU MD1 . . 3.350 2.335 2.086 2.643 . 0 0 "[ . 1 . 2]" 1
931 1 44 VAL HB 1 55 LEU MD2 . . 3.810 3.163 2.935 3.385 . 0 0 "[ . 1 . 2]" 1
932 1 44 VAL HB 1 56 MET H . . 4.780 3.994 3.816 4.263 . 0 0 "[ . 1 . 2]" 1
933 1 44 VAL HB 1 57 GLY HA2 . . 4.780 4.401 4.252 4.566 . 0 0 "[ . 1 . 2]" 1
934 1 44 VAL HB 1 57 GLY HA3 . . 5.500 5.434 5.313 5.501 0.001 10 0 "[ . 1 . 2]" 1
935 1 44 VAL HB 1 71 LEU MD1 . . 4.590 3.690 3.549 3.868 . 0 0 "[ . 1 . 2]" 1
936 1 44 VAL MG1 1 45 PHE H . . 3.940 3.826 3.744 3.880 . 0 0 "[ . 1 . 2]" 1
937 1 44 VAL MG1 1 45 PHE HA . . 5.460 5.404 5.382 5.426 . 0 0 "[ . 1 . 2]" 1
938 1 44 VAL MG1 1 56 MET H . . 5.020 4.728 4.528 5.002 . 0 0 "[ . 1 . 2]" 1
939 1 44 VAL MG1 1 57 GLY HA2 . . 3.050 2.830 2.464 3.026 . 0 0 "[ . 1 . 2]" 1
940 1 44 VAL MG1 1 57 GLY HA3 . . 3.610 3.526 3.290 3.614 0.004 19 0 "[ . 1 . 2]" 1
941 1 44 VAL MG1 1 58 GLU H . . 4.300 4.017 3.821 4.237 . 0 0 "[ . 1 . 2]" 1
942 1 44 VAL MG2 1 45 PHE H . . 3.900 3.780 3.605 3.891 . 0 0 "[ . 1 . 2]" 1
943 1 44 VAL MG2 1 45 PHE HA . . 4.110 3.834 3.694 3.943 . 0 0 "[ . 1 . 2]" 1
944 1 44 VAL MG2 1 55 LEU HB3 . . 4.120 3.794 3.614 3.920 . 0 0 "[ . 1 . 2]" 1
945 1 44 VAL MG2 1 73 LEU HA . . 4.670 4.345 4.014 4.567 . 0 0 "[ . 1 . 2]" 1
946 1 44 VAL MG2 1 73 LEU MD1 . . 3.780 3.686 3.562 3.782 0.002 5 0 "[ . 1 . 2]" 1
947 1 44 VAL MG2 1 73 LEU HG . . 5.290 4.819 4.627 5.006 . 0 0 "[ . 1 . 2]" 1
948 1 45 PHE H 1 45 PHE HB2 . . 4.010 3.892 3.826 3.967 . 0 0 "[ . 1 . 2]" 1
949 1 45 PHE H 1 45 PHE HB3 . . 4.020 3.561 3.536 3.581 . 0 0 "[ . 1 . 2]" 1
950 1 45 PHE H 1 45 PHE QD . . 3.610 2.464 2.356 2.634 . 0 0 "[ . 1 . 2]" 1
951 1 45 PHE H 1 45 PHE QE . . 4.690 3.996 3.879 4.144 . 0 0 "[ . 1 . 2]" 1
952 1 45 PHE H 1 55 LEU HB2 . . 4.710 4.559 4.402 4.711 0.001 12 0 "[ . 1 . 2]" 1
953 1 45 PHE H 1 55 LEU HB3 . . 3.910 2.849 2.689 3.004 . 0 0 "[ . 1 . 2]" 1
954 1 45 PHE H 1 55 LEU MD1 . . 4.560 4.069 3.832 4.217 . 0 0 "[ . 1 . 2]" 1
955 1 45 PHE H 1 55 LEU MD2 . . 4.380 2.972 2.701 3.325 . 0 0 "[ . 1 . 2]" 1
956 1 45 PHE H 1 56 MET H . . 3.470 2.438 2.275 2.669 . 0 0 "[ . 1 . 2]" 1
957 1 45 PHE H 1 56 MET HB2 . . 4.210 3.684 3.628 3.770 . 0 0 "[ . 1 . 2]" 1
958 1 45 PHE H 1 56 MET HB3 . . 4.020 2.813 2.691 2.949 . 0 0 "[ . 1 . 2]" 1
959 1 45 PHE H 1 57 GLY HA2 . . 4.160 4.116 3.969 4.171 0.011 10 0 "[ . 1 . 2]" 1
960 1 45 PHE HA 1 45 PHE HB2 . . 2.980 2.557 2.517 2.596 . 0 0 "[ . 1 . 2]" 1
961 1 45 PHE HA 1 45 PHE HB3 . . 2.950 2.363 2.332 2.395 . 0 0 "[ . 1 . 2]" 1
962 1 45 PHE HA 1 45 PHE QD . . 3.850 3.574 3.531 3.630 . 0 0 "[ . 1 . 2]" 1
963 1 45 PHE HA 1 46 SER H . . 2.840 2.235 2.203 2.279 . 0 0 "[ . 1 . 2]" 1
964 1 45 PHE HA 1 46 SER QB . . 4.610 4.419 4.045 4.616 0.006 6 0 "[ . 1 . 2]" 1
965 1 45 PHE HA 1 55 LEU MD2 . . 4.350 2.899 2.713 3.219 . 0 0 "[ . 1 . 2]" 1
966 1 45 PHE HB2 1 46 SER H . . 3.340 2.907 2.773 3.024 . 0 0 "[ . 1 . 2]" 1
967 1 45 PHE HB2 1 47 VAL QG . . 4.660 3.925 3.757 4.070 . 0 0 "[ . 1 . 2]" 1
968 1 45 PHE HB2 1 56 MET HB2 . . 4.830 4.642 4.502 4.757 . 0 0 "[ . 1 . 2]" 1
969 1 45 PHE HB2 1 56 MET HB3 . . 4.680 4.011 3.782 4.139 . 0 0 "[ . 1 . 2]" 1
970 1 45 PHE HB3 1 46 SER H . . 4.010 3.872 3.754 3.961 . 0 0 "[ . 1 . 2]" 1
971 1 45 PHE HB3 1 56 MET HB2 . . 5.500 5.509 5.481 5.526 0.026 11 0 "[ . 1 . 2]" 1
972 1 45 PHE HB3 1 56 MET HB3 . . 5.150 4.409 4.338 4.471 . 0 0 "[ . 1 . 2]" 1
973 1 45 PHE QD 1 46 SER H . . 4.480 4.371 4.235 4.469 . 0 0 "[ . 1 . 2]" 1
974 1 45 PHE QD 1 46 SER HA . . 5.290 5.111 4.944 5.215 . 0 0 "[ . 1 . 2]" 1
975 1 45 PHE QD 1 47 VAL HA . . 5.160 4.839 4.578 5.110 . 0 0 "[ . 1 . 2]" 1
976 1 45 PHE QD 1 47 VAL MG1 . . 4.670 4.613 4.423 4.679 0.009 5 0 "[ . 1 . 2]" 1
977 1 45 PHE QD 1 47 VAL QG . . 3.450 2.739 2.589 2.882 . 0 0 "[ . 1 . 2]" 1
978 1 45 PHE QD 1 47 VAL MG2 . . 4.670 2.760 2.604 2.911 . 0 0 "[ . 1 . 2]" 1
979 1 45 PHE QD 1 56 MET HB2 . . 4.840 3.653 3.543 3.740 . 0 0 "[ . 1 . 2]" 1
980 1 45 PHE QD 1 56 MET HB3 . . 4.800 2.879 2.789 2.930 . 0 0 "[ . 1 . 2]" 1
981 1 45 PHE QD 1 56 MET ME . . 5.500 5.420 5.238 5.522 0.022 11 0 "[ . 1 . 2]" 1
982 1 45 PHE QD 1 56 MET HG2 . . 5.010 3.985 3.175 4.856 . 0 0 "[ . 1 . 2]" 1
983 1 45 PHE QD 1 56 MET QG . . 4.400 3.377 3.078 3.591 . 0 0 "[ . 1 . 2]" 1
984 1 45 PHE QD 1 56 MET HG3 . . 5.010 3.988 3.489 4.380 . 0 0 "[ . 1 . 2]" 1
985 1 45 PHE QD 1 57 GLY H . . 5.500 5.485 5.381 5.526 0.026 15 0 "[ . 1 . 2]" 1
986 1 45 PHE QD 1 58 GLU HB2 . . 5.060 4.610 4.422 4.828 . 0 0 "[ . 1 . 2]" 1
987 1 45 PHE QE 1 47 VAL MG1 . . 4.960 4.548 4.225 4.888 . 0 0 "[ . 1 . 2]" 1
988 1 45 PHE QE 1 47 VAL QG . . 3.470 3.049 2.714 3.321 . 0 0 "[ . 1 . 2]" 1
989 1 45 PHE QE 1 47 VAL MG2 . . 4.960 3.099 2.747 3.380 . 0 0 "[ . 1 . 2]" 1
990 1 45 PHE QE 1 56 MET HB2 . . 4.420 3.841 3.685 3.947 . 0 0 "[ . 1 . 2]" 1
991 1 45 PHE QE 1 56 MET HB3 . . 4.500 2.925 2.843 3.020 . 0 0 "[ . 1 . 2]" 1
992 1 45 PHE QE 1 56 MET ME . . 4.360 4.086 3.798 4.308 . 0 0 "[ . 1 . 2]" 1
993 1 45 PHE QE 1 56 MET HG2 . . 4.100 2.822 2.030 3.875 . 0 0 "[ . 1 . 2]" 1
994 1 45 PHE QE 1 56 MET QG . . 3.420 2.142 1.990 2.286 . 0 0 "[ . 1 . 2]" 1
995 1 45 PHE QE 1 56 MET HG3 . . 4.100 2.688 2.187 3.106 . 0 0 "[ . 1 . 2]" 1
996 1 45 PHE QE 1 57 GLY H . . 5.500 4.646 4.529 4.708 . 0 0 "[ . 1 . 2]" 1
997 1 45 PHE QE 1 58 GLU H . . 4.900 3.529 2.928 3.850 . 0 0 "[ . 1 . 2]" 1
998 1 45 PHE QE 1 58 GLU HB2 . . 4.340 2.400 2.178 2.571 . 0 0 "[ . 1 . 2]" 1
999 1 45 PHE QE 1 58 GLU HB3 . . 4.290 3.386 2.941 3.717 . 0 0 "[ . 1 . 2]" 1
1000 1 45 PHE QE 1 58 GLU HG2 . . 5.500 5.271 5.066 5.505 0.005 10 0 "[ . 1 . 2]" 1
1001 1 45 PHE QE 1 58 GLU HG3 . . 5.220 4.663 4.350 4.833 . 0 0 "[ . 1 . 2]" 1
1002 1 45 PHE QE 1 63 LYS QD . . 5.080 3.896 2.900 4.956 . 0 0 "[ . 1 . 2]" 1
1003 1 45 PHE QE 1 63 LYS QG . . 5.060 4.185 3.551 4.564 . 0 0 "[ . 1 . 2]" 1
1004 1 45 PHE HZ 1 47 VAL QG . . 5.230 4.513 4.216 4.886 . 0 0 "[ . 1 . 2]" 1
1005 1 45 PHE HZ 1 56 MET HB2 . . 5.500 4.627 4.408 4.890 . 0 0 "[ . 1 . 2]" 1
1006 1 45 PHE HZ 1 56 MET HB3 . . 5.100 3.321 3.196 3.527 . 0 0 "[ . 1 . 2]" 1
1007 1 45 PHE HZ 1 56 MET ME . . 4.720 3.736 3.436 4.131 . 0 0 "[ . 1 . 2]" 1
1008 1 45 PHE HZ 1 56 MET HG2 . . 4.620 3.414 2.560 4.316 . 0 0 "[ . 1 . 2]" 1
1009 1 45 PHE HZ 1 56 MET QG . . 4.060 2.455 2.139 2.794 . 0 0 "[ . 1 . 2]" 1
1010 1 45 PHE HZ 1 56 MET HG3 . . 4.620 2.541 2.249 2.829 . 0 0 "[ . 1 . 2]" 1
1011 1 45 PHE HZ 1 57 GLY H . . 5.500 5.421 5.182 5.504 0.004 10 0 "[ . 1 . 2]" 1
1012 1 45 PHE HZ 1 58 GLU HB2 . . 5.500 3.260 2.830 3.705 . 0 0 "[ . 1 . 2]" 1
1013 1 45 PHE HZ 1 58 GLU HG3 . . 5.500 4.686 4.195 5.025 . 0 0 "[ . 1 . 2]" 1
1014 1 45 PHE HZ 1 63 LYS HD2 . . 4.830 3.207 2.015 4.781 . 0 0 "[ . 1 . 2]" 1
1015 1 45 PHE HZ 1 63 LYS QD . . 4.200 2.927 1.862 4.192 . 0 0 "[ . 1 . 2]" 1
1016 1 45 PHE HZ 1 63 LYS HD3 . . 4.830 3.525 2.047 4.793 . 0 0 "[ . 1 . 2]" 1
1017 1 45 PHE HZ 1 63 LYS QE . . 4.110 2.812 1.898 4.091 . 0 0 "[ . 1 . 2]" 1
1018 1 45 PHE HZ 1 63 LYS QG . . 4.580 3.529 2.347 4.069 . 0 0 "[ . 1 . 2]" 1
1019 1 46 SER H 1 46 SER QB . . 3.240 2.521 2.170 2.752 . 0 0 "[ . 1 . 2]" 1
1020 1 46 SER H 1 55 LEU MD2 . . 4.310 2.861 2.663 3.100 . 0 0 "[ . 1 . 2]" 1
1021 1 46 SER HA 1 47 VAL H . . 2.680 2.285 2.189 2.407 . 0 0 "[ . 1 . 2]" 1
1022 1 46 SER HA 1 47 VAL HB . . 5.060 4.667 4.540 4.772 . 0 0 "[ . 1 . 2]" 1
1023 1 46 SER HA 1 47 VAL QG . . 4.060 3.258 3.022 3.483 . 0 0 "[ . 1 . 2]" 1
1024 1 46 SER HA 1 50 MET ME . . 4.460 4.066 3.753 4.353 . 0 0 "[ . 1 . 2]" 1
1025 1 46 SER HA 1 55 LEU MD1 . . 5.130 4.834 4.723 4.994 . 0 0 "[ . 1 . 2]" 1
1026 1 46 SER HA 1 55 LEU MD2 . . 3.060 2.108 1.961 2.227 . 0 0 "[ . 1 . 2]" 1
1027 1 46 SER HA 1 56 MET H . . 4.050 3.334 3.229 3.424 . 0 0 "[ . 1 . 2]" 1
1028 1 46 SER QB 1 47 VAL H . . 3.310 2.831 2.395 3.323 0.013 10 0 "[ . 1 . 2]" 1
1029 1 46 SER QB 1 47 VAL HA . . 4.640 4.183 3.934 4.637 . 0 0 "[ . 1 . 2]" 1
1030 1 46 SER QB 1 47 VAL QG . . 4.590 4.141 3.893 4.356 . 0 0 "[ . 1 . 2]" 1
1031 1 46 SER QB 1 50 MET ME . . 5.500 5.317 4.964 5.501 0.001 2 0 "[ . 1 . 2]" 1
1032 1 46 SER QB 1 55 LEU MD2 . . 3.190 2.742 2.144 3.164 . 0 0 "[ . 1 . 2]" 1
1033 1 47 VAL H 1 47 VAL HB . . 3.340 2.871 2.705 3.040 . 0 0 "[ . 1 . 2]" 1
1034 1 47 VAL H 1 47 VAL MG1 . . 4.030 3.943 3.880 4.004 . 0 0 "[ . 1 . 2]" 1
1035 1 47 VAL H 1 47 VAL QG . . 3.160 2.706 2.511 2.910 . 0 0 "[ . 1 . 2]" 1
1036 1 47 VAL H 1 47 VAL MG2 . . 4.030 2.757 2.543 2.990 . 0 0 "[ . 1 . 2]" 1
1037 1 47 VAL H 1 50 MET HB2 . . 4.320 3.040 2.532 3.406 . 0 0 "[ . 1 . 2]" 1
1038 1 47 VAL H 1 50 MET QB . . 3.460 2.342 2.069 2.646 . 0 0 "[ . 1 . 2]" 1
1039 1 47 VAL H 1 50 MET HB3 . . 4.320 2.443 2.110 2.758 . 0 0 "[ . 1 . 2]" 1
1040 1 47 VAL H 1 50 MET ME . . 4.230 3.783 3.285 4.205 . 0 0 "[ . 1 . 2]" 1
1041 1 47 VAL H 1 50 MET QG . . 5.270 3.312 2.596 4.016 . 0 0 "[ . 1 . 2]" 1
1042 1 47 VAL H 1 55 LEU MD2 . . 4.000 3.955 3.884 4.003 0.003 1 0 "[ . 1 . 2]" 1
1043 1 47 VAL HA 1 47 VAL MG1 . . 3.060 2.341 2.199 2.403 . 0 0 "[ . 1 . 2]" 1
1044 1 47 VAL HA 1 47 VAL MG2 . . 3.060 2.453 2.379 2.554 . 0 0 "[ . 1 . 2]" 1
1045 1 47 VAL HA 1 48 VAL H . . 2.740 2.200 2.151 2.248 . 0 0 "[ . 1 . 2]" 1
1046 1 47 VAL HA 1 48 VAL HA . . 5.030 4.323 4.308 4.352 . 0 0 "[ . 1 . 2]" 1
1047 1 47 VAL HA 1 48 VAL HB . . 5.010 4.581 4.497 4.633 . 0 0 "[ . 1 . 2]" 1
1048 1 47 VAL HA 1 48 VAL MG1 . . 5.500 5.490 5.451 5.517 0.017 8 0 "[ . 1 . 2]" 1
1049 1 47 VAL HA 1 48 VAL MG2 . . 4.000 3.938 3.882 3.981 . 0 0 "[ . 1 . 2]" 1
1050 1 47 VAL HB 1 48 VAL H . . 4.280 3.920 3.790 4.093 . 0 0 "[ . 1 . 2]" 1
1051 1 47 VAL HB 1 50 MET QB . . 3.930 2.474 2.065 2.813 . 0 0 "[ . 1 . 2]" 1
1052 1 47 VAL HB 1 50 MET QG . . 4.810 4.067 3.586 4.490 . 0 0 "[ . 1 . 2]" 1
1053 1 47 VAL HB 1 56 MET HB2 . . 4.460 4.101 3.777 4.445 . 0 0 "[ . 1 . 2]" 1
1054 1 47 VAL QG 1 48 VAL H . . 3.390 2.105 1.962 2.454 . 0 0 "[ . 1 . 2]" 1
1055 1 47 VAL QG 1 48 VAL HA . . 4.690 4.046 3.925 4.249 . 0 0 "[ . 1 . 2]" 1
1056 1 47 VAL QG 1 50 MET H . . 4.910 4.300 3.792 4.837 . 0 0 "[ . 1 . 2]" 1
1057 1 47 VAL QG 1 50 MET QB . . 3.550 3.221 2.955 3.445 . 0 0 "[ . 1 . 2]" 1
1058 1 47 VAL QG 1 50 MET ME . . 2.900 2.777 2.483 2.903 0.003 9 0 "[ . 1 . 2]" 1
1059 1 47 VAL QG 1 50 MET QG . . 4.930 3.968 3.328 4.552 . 0 0 "[ . 1 . 2]" 1
1060 1 47 VAL QG 1 55 LEU HA . . 4.990 4.627 4.335 4.880 . 0 0 "[ . 1 . 2]" 1
1061 1 47 VAL QG 1 56 MET H . . 4.140 3.653 3.405 3.928 . 0 0 "[ . 1 . 2]" 1
1062 1 47 VAL QG 1 56 MET HA . . 5.190 3.931 3.680 4.074 . 0 0 "[ . 1 . 2]" 1
1063 1 47 VAL QG 1 56 MET QG . . 3.190 2.246 1.922 2.506 . 0 0 "[ . 1 . 2]" 1
1064 1 47 VAL MG1 1 48 VAL H . . 4.290 2.113 1.966 2.472 . 0 0 "[ . 1 . 2]" 1
1065 1 47 VAL MG1 1 50 MET HB2 . . 4.710 3.888 3.497 4.039 . 0 0 "[ . 1 . 2]" 1
1066 1 47 VAL MG1 1 50 MET HB3 . . 4.710 4.684 4.546 4.721 0.011 5 0 "[ . 1 . 2]" 1
1067 1 47 VAL MG2 1 48 VAL H . . 4.290 4.053 3.964 4.192 . 0 0 "[ . 1 . 2]" 1
1068 1 47 VAL MG2 1 50 MET HB2 . . 4.710 3.783 3.328 4.230 . 0 0 "[ . 1 . 2]" 1
1069 1 47 VAL MG2 1 50 MET HB3 . . 4.710 4.322 3.764 4.689 . 0 0 "[ . 1 . 2]" 1
1070 1 48 VAL H 1 48 VAL HB . . 3.010 2.458 2.398 2.535 . 0 0 "[ . 1 . 2]" 1
1071 1 48 VAL H 1 48 VAL MG1 . . 4.540 3.757 3.736 3.785 . 0 0 "[ . 1 . 2]" 1
1072 1 48 VAL H 1 48 VAL MG2 . . 2.980 2.243 2.177 2.304 . 0 0 "[ . 1 . 2]" 1
1073 1 48 VAL HA 1 48 VAL MG1 . . 3.060 2.501 2.478 2.553 . 0 0 "[ . 1 . 2]" 1
1074 1 48 VAL HA 1 48 VAL MG2 . . 2.950 2.274 2.251 2.306 . 0 0 "[ . 1 . 2]" 1
1075 1 48 VAL HA 1 49 GLY H . . 3.100 2.177 2.148 2.262 . 0 0 "[ . 1 . 2]" 1
1076 1 48 VAL HA 1 49 GLY QA . . 4.500 3.945 3.920 3.995 . 0 0 "[ . 1 . 2]" 1
1077 1 48 VAL HA 1 50 MET H . . 4.030 3.553 3.338 3.863 . 0 0 "[ . 1 . 2]" 1
1078 1 48 VAL HB 1 49 GLY H . . 5.340 4.240 4.026 4.357 . 0 0 "[ . 1 . 2]" 1
1079 1 48 VAL HB 1 49 GLY QA . . 5.340 4.642 4.572 4.702 . 0 0 "[ . 1 . 2]" 1
1080 1 48 VAL MG1 1 49 GLY H . . 4.150 2.300 2.063 2.713 . 0 0 "[ . 1 . 2]" 1
1081 1 48 VAL MG1 1 49 GLY HA2 . . 4.010 3.416 3.292 3.601 . 0 0 "[ . 1 . 2]" 1
1082 1 48 VAL MG1 1 49 GLY HA3 . . 4.010 3.110 2.872 3.208 . 0 0 "[ . 1 . 2]" 1
1083 1 48 VAL MG1 1 50 MET H . . 4.400 4.232 4.123 4.372 . 0 0 "[ . 1 . 2]" 1
1084 1 48 VAL MG2 1 49 GLY H . . 4.860 3.729 3.574 3.804 . 0 0 "[ . 1 . 2]" 1
1085 1 48 VAL MG2 1 49 GLY HA2 . . 5.500 5.489 5.433 5.513 0.013 20 0 "[ . 1 . 2]" 1
1086 1 48 VAL MG2 1 49 GLY HA3 . . 5.500 5.334 5.279 5.365 . 0 0 "[ . 1 . 2]" 1
1087 1 48 VAL MG2 1 50 MET H . . 5.500 5.154 5.022 5.283 . 0 0 "[ . 1 . 2]" 1
1088 1 49 GLY H 1 50 MET H . . 4.210 2.743 2.374 3.208 . 0 0 "[ . 1 . 2]" 1
1089 1 49 GLY QA 1 50 MET HA . . 4.800 4.051 4.007 4.121 . 0 0 "[ . 1 . 2]" 1
1090 1 49 GLY QA 1 50 MET QB . . 4.760 4.307 4.244 4.377 . 0 0 "[ . 1 . 2]" 1
1091 1 50 MET H 1 50 MET HB2 . . 3.210 2.761 2.306 3.121 . 0 0 "[ . 1 . 2]" 1
1092 1 50 MET H 1 50 MET HB3 . . 3.210 2.560 2.405 2.761 . 0 0 "[ . 1 . 2]" 1
1093 1 50 MET H 1 50 MET HG2 . . 4.670 4.538 4.307 4.689 0.019 14 0 "[ . 1 . 2]" 1
1094 1 50 MET H 1 50 MET QG . . 4.050 4.009 3.932 4.078 0.028 17 0 "[ . 1 . 2]" 1
1095 1 50 MET H 1 50 MET HG3 . . 4.670 4.487 4.244 4.682 0.012 12 0 "[ . 1 . 2]" 1
1096 1 50 MET HA 1 50 MET ME . . 4.360 4.018 3.644 4.370 0.010 8 0 "[ . 1 . 2]" 1
1097 1 50 MET HA 1 50 MET HG2 . . 3.990 3.546 3.089 3.875 . 0 0 "[ . 1 . 2]" 1
1098 1 50 MET HA 1 50 MET QG . . 3.230 2.686 2.398 3.007 . 0 0 "[ . 1 . 2]" 1
1099 1 50 MET HA 1 50 MET HG3 . . 3.990 2.784 2.464 3.134 . 0 0 "[ . 1 . 2]" 1
1100 1 50 MET HA 1 51 ASP H . . 3.410 2.257 2.142 2.441 . 0 0 "[ . 1 . 2]" 1
1101 1 50 MET HA 1 51 ASP HB2 . . 5.500 5.016 4.289 5.217 . 0 0 "[ . 1 . 2]" 1
1102 1 50 MET HA 1 51 ASP HB3 . . 5.500 5.581 5.559 5.626 0.126 19 0 "[ . 1 . 2]" 1
1103 1 50 MET HA 1 54 TRP HB2 . . 5.500 4.997 4.779 5.266 . 0 0 "[ . 1 . 2]" 1
1104 1 50 MET HB2 1 51 ASP H . . 5.500 3.991 3.761 4.286 . 0 0 "[ . 1 . 2]" 1
1105 1 50 MET HB3 1 51 ASP H . . 5.500 3.939 3.512 4.273 . 0 0 "[ . 1 . 2]" 1
1106 1 50 MET ME 1 50 MET HG2 . . 3.620 2.668 2.121 3.263 . 0 0 "[ . 1 . 2]" 1
1107 1 50 MET ME 1 50 MET QG . . 3.140 2.153 2.061 2.208 . 0 0 "[ . 1 . 2]" 1
1108 1 50 MET ME 1 50 MET HG3 . . 3.620 2.735 2.085 3.301 . 0 0 "[ . 1 . 2]" 1
1109 1 50 MET ME 1 54 TRP H . . 5.320 5.184 4.996 5.322 0.002 5 0 "[ . 1 . 2]" 1
1110 1 50 MET ME 1 54 TRP HA . . 4.800 4.541 4.221 4.700 . 0 0 "[ . 1 . 2]" 1
1111 1 50 MET ME 1 54 TRP HB2 . . 3.960 3.859 3.692 3.958 . 0 0 "[ . 1 . 2]" 1
1112 1 50 MET ME 1 54 TRP HB3 . . 3.380 3.167 2.934 3.317 . 0 0 "[ . 1 . 2]" 1
1113 1 50 MET ME 1 55 LEU H . . 4.170 3.649 3.143 3.897 . 0 0 "[ . 1 . 2]" 1
1114 1 50 MET ME 1 55 LEU HA . . 3.400 2.868 2.536 3.224 . 0 0 "[ . 1 . 2]" 1
1115 1 50 MET ME 1 56 MET H . . 3.840 3.145 2.721 3.497 . 0 0 "[ . 1 . 2]" 1
1116 1 50 MET ME 1 56 MET HA . . 3.780 2.585 2.079 2.869 . 0 0 "[ . 1 . 2]" 1
1117 1 50 MET ME 1 57 GLY H . . 4.290 4.123 3.666 4.295 0.005 20 0 "[ . 1 . 2]" 1
1118 1 50 MET ME 1 65 LYS HA . . 3.720 2.611 2.100 2.764 . 0 0 "[ . 1 . 2]" 1
1119 1 50 MET ME 1 65 LYS HD2 . . 3.880 2.704 2.292 3.096 . 0 0 "[ . 1 . 2]" 1
1120 1 50 MET ME 1 65 LYS HD3 . . 3.870 3.252 2.632 3.654 . 0 0 "[ . 1 . 2]" 1
1121 1 50 MET ME 1 65 LYS HG2 . . 3.100 2.144 1.959 2.523 . 0 0 "[ . 1 . 2]" 1
1122 1 50 MET ME 1 65 LYS HG3 . . 4.510 3.632 3.305 3.936 . 0 0 "[ . 1 . 2]" 1
1123 1 50 MET ME 1 66 VAL H . . 4.500 3.382 3.022 3.596 . 0 0 "[ . 1 . 2]" 1
1124 1 50 MET QG 1 51 ASP H . . 4.440 2.343 1.825 2.908 . 0 0 "[ . 1 . 2]" 1
1125 1 50 MET QG 1 54 TRP HB2 . . 4.580 3.138 2.852 3.430 . 0 0 "[ . 1 . 2]" 1
1126 1 50 MET HG2 1 51 ASP H . . 5.170 3.364 1.990 4.382 . 0 0 "[ . 1 . 2]" 1
1127 1 50 MET HG2 1 54 TRP H . . 5.360 4.488 3.860 5.120 . 0 0 "[ . 1 . 2]" 1
1128 1 50 MET HG2 1 54 TRP HB3 . . 4.810 4.516 4.197 4.804 . 0 0 "[ . 1 . 2]" 1
1129 1 50 MET HG3 1 51 ASP H . . 5.170 2.467 2.122 3.333 . 0 0 "[ . 1 . 2]" 1
1130 1 50 MET HG3 1 54 TRP H . . 5.360 4.406 3.781 5.225 . 0 0 "[ . 1 . 2]" 1
1131 1 50 MET HG3 1 54 TRP HB3 . . 4.810 4.030 3.625 4.534 . 0 0 "[ . 1 . 2]" 1
1132 1 51 ASP H 1 51 ASP QB . . 3.650 2.689 2.193 2.783 . 0 0 "[ . 1 . 2]" 1
1133 1 51 ASP HA 1 52 SER H . . 2.790 2.300 2.212 2.478 . 0 0 "[ . 1 . 2]" 1
1134 1 51 ASP HA 1 52 SER QB . . 4.760 4.429 4.136 4.700 . 0 0 "[ . 1 . 2]" 1
1135 1 51 ASP HA 1 53 ASP H . . 4.370 3.923 3.762 4.253 . 0 0 "[ . 1 . 2]" 1
1136 1 51 ASP QB 1 52 SER H . . 3.640 2.733 2.323 2.950 . 0 0 "[ . 1 . 2]" 1
1137 1 51 ASP QB 1 53 ASP H . . 3.780 2.456 2.106 2.695 . 0 0 "[ . 1 . 2]" 1
1138 1 51 ASP QB 1 54 TRP H . . 3.620 3.176 3.061 3.355 . 0 0 "[ . 1 . 2]" 1
1139 1 51 ASP QB 1 54 TRP HD1 . . 3.160 2.220 2.103 2.703 . 0 0 "[ . 1 . 2]" 1
1140 1 51 ASP QB 1 54 TRP HE1 . . 4.740 4.409 4.268 4.743 0.003 10 0 "[ . 1 . 2]" 1
1141 1 51 ASP HB2 1 52 SER H . . 4.200 3.545 3.186 3.890 . 0 0 "[ . 1 . 2]" 1
1142 1 51 ASP HB2 1 52 SER HA . . 5.500 4.983 4.762 5.444 . 0 0 "[ . 1 . 2]" 1
1143 1 51 ASP HB2 1 53 ASP H . . 4.580 2.809 2.507 3.909 . 0 0 "[ . 1 . 2]" 1
1144 1 51 ASP HB2 1 54 TRP HD1 . . 3.630 2.303 2.120 3.003 . 0 0 "[ . 1 . 2]" 1
1145 1 51 ASP HB2 1 54 TRP HE1 . . 5.500 4.702 4.519 5.300 . 0 0 "[ . 1 . 2]" 1
1146 1 51 ASP HB3 1 52 SER H . . 4.200 2.860 2.345 3.112 . 0 0 "[ . 1 . 2]" 1
1147 1 51 ASP HB3 1 52 SER HA . . 5.500 5.140 4.444 5.340 . 0 0 "[ . 1 . 2]" 1
1148 1 51 ASP HB3 1 53 ASP H . . 4.580 2.947 2.122 3.252 . 0 0 "[ . 1 . 2]" 1
1149 1 51 ASP HB3 1 54 TRP HD1 . . 3.630 3.354 2.418 3.529 . 0 0 "[ . 1 . 2]" 1
1150 1 51 ASP HB3 1 54 TRP HE1 . . 5.500 5.398 4.682 5.507 0.007 11 0 "[ . 1 . 2]" 1
1151 1 52 SER H 1 52 SER HB2 . . 3.760 3.020 2.535 3.592 . 0 0 "[ . 1 . 2]" 1
1152 1 52 SER H 1 52 SER QB . . 3.160 2.478 2.158 2.831 . 0 0 "[ . 1 . 2]" 1
1153 1 52 SER H 1 52 SER HB3 . . 3.760 2.863 2.224 3.647 . 0 0 "[ . 1 . 2]" 1
1154 1 52 SER H 1 53 ASP H . . 3.680 2.541 2.281 2.656 . 0 0 "[ . 1 . 2]" 1
1155 1 52 SER H 1 53 ASP HB2 . . 5.430 4.823 4.397 5.048 . 0 0 "[ . 1 . 2]" 1
1156 1 52 SER HA 1 53 ASP H . . 3.500 3.421 3.368 3.498 . 0 0 "[ . 1 . 2]" 1
1157 1 52 SER HA 1 54 TRP H . . 3.830 3.502 3.435 3.555 . 0 0 "[ . 1 . 2]" 1
1158 1 52 SER HA 1 68 ILE MD . . 4.460 3.784 3.632 4.238 . 0 0 "[ . 1 . 2]" 1
1159 1 52 SER HB2 1 53 ASP H . . 4.350 3.786 2.809 4.352 0.002 14 0 "[ . 1 . 2]" 1
1160 1 52 SER HB2 1 68 ILE MD . . 5.500 5.088 4.617 5.516 0.016 11 0 "[ . 1 . 2]" 1
1161 1 52 SER HB3 1 53 ASP H . . 4.350 3.850 3.153 4.348 . 0 0 "[ . 1 . 2]" 1
1162 1 52 SER HB3 1 68 ILE MD . . 5.500 5.265 4.823 5.506 0.006 4 0 "[ . 1 . 2]" 1
1163 1 53 ASP H 1 53 ASP HB2 . . 3.260 2.521 2.330 2.642 . 0 0 "[ . 1 . 2]" 1
1164 1 53 ASP H 1 53 ASP HB3 . . 3.720 3.660 3.589 3.700 . 0 0 "[ . 1 . 2]" 1
1165 1 53 ASP H 1 54 TRP H . . 3.190 2.592 2.484 2.762 . 0 0 "[ . 1 . 2]" 1
1166 1 53 ASP H 1 54 TRP HD1 . . 3.870 3.330 3.071 3.475 . 0 0 "[ . 1 . 2]" 1
1167 1 53 ASP H 1 68 ILE MD . . 4.620 3.863 3.727 3.982 . 0 0 "[ . 1 . 2]" 1
1168 1 53 ASP HA 1 68 ILE H . . 4.580 3.585 3.454 3.718 . 0 0 "[ . 1 . 2]" 1
1169 1 53 ASP HA 1 68 ILE HB . . 4.630 2.677 2.579 2.791 . 0 0 "[ . 1 . 2]" 1
1170 1 53 ASP HA 1 68 ILE MD . . 2.910 2.501 2.187 2.686 . 0 0 "[ . 1 . 2]" 1
1171 1 53 ASP HA 1 68 ILE HG12 . . 4.160 4.138 3.963 4.171 0.011 20 0 "[ . 1 . 2]" 1
1172 1 53 ASP HA 1 68 ILE HG13 . . 5.060 4.957 4.868 5.026 . 0 0 "[ . 1 . 2]" 1
1173 1 53 ASP HA 1 68 ILE MG . . 4.130 3.920 3.823 4.023 . 0 0 "[ . 1 . 2]" 1
1174 1 53 ASP HB2 1 54 TRP H . . 4.190 3.880 3.807 4.066 . 0 0 "[ . 1 . 2]" 1
1175 1 53 ASP HB2 1 54 TRP HD1 . . 3.840 2.480 2.340 2.735 . 0 0 "[ . 1 . 2]" 1
1176 1 53 ASP HB2 1 54 TRP HE1 . . 4.030 3.472 3.375 3.656 . 0 0 "[ . 1 . 2]" 1
1177 1 53 ASP HB2 1 68 ILE H . . 5.360 5.221 5.087 5.358 . 0 0 "[ . 1 . 2]" 1
1178 1 53 ASP HB2 1 68 ILE MD . . 4.690 4.447 4.348 4.517 . 0 0 "[ . 1 . 2]" 1
1179 1 53 ASP HB3 1 54 TRP H . . 4.580 4.431 4.360 4.490 . 0 0 "[ . 1 . 2]" 1
1180 1 53 ASP HB3 1 54 TRP HD1 . . 3.950 3.707 3.432 3.906 . 0 0 "[ . 1 . 2]" 1
1181 1 53 ASP HB3 1 54 TRP HE1 . . 4.310 4.034 3.762 4.226 . 0 0 "[ . 1 . 2]" 1
1182 1 53 ASP HB3 1 68 ILE H . . 5.110 4.199 3.977 4.286 . 0 0 "[ . 1 . 2]" 1
1183 1 53 ASP HB3 1 68 ILE MD . . 4.390 4.084 3.884 4.200 . 0 0 "[ . 1 . 2]" 1
1184 1 54 TRP H 1 54 TRP HB2 . . 3.610 2.865 2.842 2.875 . 0 0 "[ . 1 . 2]" 1
1185 1 54 TRP H 1 54 TRP HB3 . . 3.970 3.898 3.888 3.906 . 0 0 "[ . 1 . 2]" 1
1186 1 54 TRP H 1 54 TRP HD1 . . 3.550 3.508 3.417 3.556 0.006 5 0 "[ . 1 . 2]" 1
1187 1 54 TRP H 1 55 LEU H . . 4.630 4.175 4.091 4.247 . 0 0 "[ . 1 . 2]" 1
1188 1 54 TRP H 1 67 PRO HA . . 5.330 5.096 5.029 5.162 . 0 0 "[ . 1 . 2]" 1
1189 1 54 TRP H 1 68 ILE HB . . 5.000 4.550 4.474 4.621 . 0 0 "[ . 1 . 2]" 1
1190 1 54 TRP H 1 68 ILE MD . . 4.090 2.283 2.198 2.352 . 0 0 "[ . 1 . 2]" 1
1191 1 54 TRP H 1 68 ILE HG12 . . 5.430 4.677 4.569 4.744 . 0 0 "[ . 1 . 2]" 1
1192 1 54 TRP H 1 68 ILE HG13 . . 5.320 5.119 5.000 5.209 . 0 0 "[ . 1 . 2]" 1
1193 1 54 TRP H 1 68 ILE MG . . 5.500 5.495 5.467 5.507 0.007 3 0 "[ . 1 . 2]" 1
1194 1 54 TRP HA 1 54 TRP HE3 . . 3.910 3.321 3.226 3.436 . 0 0 "[ . 1 . 2]" 1
1195 1 54 TRP HA 1 54 TRP HZ3 . . 5.500 5.384 5.295 5.496 . 0 0 "[ . 1 . 2]" 1
1196 1 54 TRP HA 1 55 LEU H . . 2.690 2.162 2.144 2.192 . 0 0 "[ . 1 . 2]" 1
1197 1 54 TRP HA 1 55 LEU HB2 . . 4.400 4.229 4.187 4.266 . 0 0 "[ . 1 . 2]" 1
1198 1 54 TRP HA 1 55 LEU HG . . 4.770 4.579 4.471 4.661 . 0 0 "[ . 1 . 2]" 1
1199 1 54 TRP HA 1 66 VAL H . . 4.400 3.850 3.611 4.032 . 0 0 "[ . 1 . 2]" 1
1200 1 54 TRP HA 1 66 VAL MG2 . . 4.350 3.916 3.781 4.061 . 0 0 "[ . 1 . 2]" 1
1201 1 54 TRP HA 1 67 PRO HA . . 3.040 2.816 2.802 2.832 . 0 0 "[ . 1 . 2]" 1
1202 1 54 TRP HA 1 67 PRO HB2 . . 5.500 5.508 5.502 5.512 0.012 17 0 "[ . 1 . 2]" 1
1203 1 54 TRP HA 1 67 PRO HB3 . . 5.390 4.940 4.900 4.989 . 0 0 "[ . 1 . 2]" 1
1204 1 54 TRP HA 1 68 ILE H . . 3.240 2.939 2.859 3.026 . 0 0 "[ . 1 . 2]" 1
1205 1 54 TRP HA 1 68 ILE HA . . 5.180 5.005 4.887 5.083 . 0 0 "[ . 1 . 2]" 1
1206 1 54 TRP HA 1 68 ILE HB . . 4.640 4.562 4.471 4.636 . 0 0 "[ . 1 . 2]" 1
1207 1 54 TRP HA 1 68 ILE MD . . 3.660 2.221 1.972 2.390 . 0 0 "[ . 1 . 2]" 1
1208 1 54 TRP HA 1 68 ILE HG12 . . 5.500 5.132 4.957 5.272 . 0 0 "[ . 1 . 2]" 1
1209 1 54 TRP HA 1 68 ILE HG13 . . 4.920 4.549 4.292 4.732 . 0 0 "[ . 1 . 2]" 1
1210 1 54 TRP HB2 1 54 TRP HD1 . . 3.880 2.699 2.675 2.732 . 0 0 "[ . 1 . 2]" 1
1211 1 54 TRP HB2 1 55 LEU H . . 4.350 4.232 4.130 4.322 . 0 0 "[ . 1 . 2]" 1
1212 1 54 TRP HB2 1 65 LYS HB2 . . 5.500 5.497 5.449 5.509 0.009 9 0 "[ . 1 . 2]" 1
1213 1 54 TRP HB2 1 65 LYS HB3 . . 4.640 3.911 3.828 4.047 . 0 0 "[ . 1 . 2]" 1
1214 1 54 TRP HB2 1 65 LYS HD2 . . 4.920 3.290 2.855 3.655 . 0 0 "[ . 1 . 2]" 1
1215 1 54 TRP HB2 1 65 LYS HE2 . . 5.500 5.450 5.316 5.508 0.008 20 0 "[ . 1 . 2]" 1
1216 1 54 TRP HB2 1 65 LYS HE3 . . 4.960 3.840 3.602 4.027 . 0 0 "[ . 1 . 2]" 1
1217 1 54 TRP HB2 1 66 VAL H . . 5.370 5.181 4.966 5.374 0.004 18 0 "[ . 1 . 2]" 1
1218 1 54 TRP HB2 1 67 PRO HA . . 5.500 5.265 5.219 5.289 . 0 0 "[ . 1 . 2]" 1
1219 1 54 TRP HB3 1 54 TRP HE3 . . 3.700 2.530 2.495 2.559 . 0 0 "[ . 1 . 2]" 1
1220 1 54 TRP HB3 1 54 TRP HZ3 . . 4.960 4.922 4.896 4.945 . 0 0 "[ . 1 . 2]" 1
1221 1 54 TRP HB3 1 55 LEU H . . 3.480 3.242 3.076 3.400 . 0 0 "[ . 1 . 2]" 1
1222 1 54 TRP HB3 1 65 LYS HA . . 4.470 3.955 3.741 4.291 . 0 0 "[ . 1 . 2]" 1
1223 1 54 TRP HB3 1 65 LYS HB2 . . 4.550 4.045 3.945 4.142 . 0 0 "[ . 1 . 2]" 1
1224 1 54 TRP HB3 1 65 LYS HB3 . . 4.140 2.364 2.293 2.423 . 0 0 "[ . 1 . 2]" 1
1225 1 54 TRP HB3 1 65 LYS HD2 . . 4.520 2.761 2.360 3.063 . 0 0 "[ . 1 . 2]" 1
1226 1 54 TRP HB3 1 65 LYS HD3 . . 5.190 4.498 4.119 4.760 . 0 0 "[ . 1 . 2]" 1
1227 1 54 TRP HB3 1 65 LYS HE2 . . 4.980 4.668 4.396 4.878 . 0 0 "[ . 1 . 2]" 1
1228 1 54 TRP HB3 1 65 LYS HE3 . . 4.810 3.212 2.810 3.514 . 0 0 "[ . 1 . 2]" 1
1229 1 54 TRP HB3 1 65 LYS HG2 . . 5.080 4.147 3.737 4.423 . 0 0 "[ . 1 . 2]" 1
1230 1 54 TRP HB3 1 65 LYS HG3 . . 5.250 4.967 4.689 5.134 . 0 0 "[ . 1 . 2]" 1
1231 1 54 TRP HB3 1 66 VAL H . . 4.300 3.531 3.296 3.734 . 0 0 "[ . 1 . 2]" 1
1232 1 54 TRP HB3 1 67 PRO HA . . 4.850 4.605 4.508 4.666 . 0 0 "[ . 1 . 2]" 1
1233 1 54 TRP HE3 1 55 LEU H . . 4.380 3.849 3.718 3.979 . 0 0 "[ . 1 . 2]" 1
1234 1 54 TRP HE3 1 65 LYS HA . . 4.570 3.705 3.495 3.995 . 0 0 "[ . 1 . 2]" 1
1235 1 54 TRP HE3 1 65 LYS HB2 . . 4.150 2.974 2.795 3.208 . 0 0 "[ . 1 . 2]" 1
1236 1 54 TRP HE3 1 65 LYS HB3 . . 3.640 2.112 2.033 2.276 . 0 0 "[ . 1 . 2]" 1
1237 1 54 TRP HE3 1 65 LYS HD2 . . 5.030 4.149 4.014 4.329 . 0 0 "[ . 1 . 2]" 1
1238 1 54 TRP HE3 1 65 LYS HD3 . . 5.500 5.513 5.503 5.523 0.023 15 0 "[ . 1 . 2]" 1
1239 1 54 TRP HE3 1 65 LYS HE2 . . 5.020 4.512 4.148 4.887 . 0 0 "[ . 1 . 2]" 1
1240 1 54 TRP HE3 1 65 LYS HE3 . . 4.890 3.453 3.118 3.845 . 0 0 "[ . 1 . 2]" 1
1241 1 54 TRP HE3 1 65 LYS HG2 . . 4.900 4.685 4.559 4.854 . 0 0 "[ . 1 . 2]" 1
1242 1 54 TRP HE3 1 65 LYS HG3 . . 5.200 4.905 4.857 4.983 . 0 0 "[ . 1 . 2]" 1
1243 1 54 TRP HE3 1 66 VAL H . . 3.860 2.901 2.665 3.061 . 0 0 "[ . 1 . 2]" 1
1244 1 54 TRP HE3 1 66 VAL HA . . 4.080 3.234 3.131 3.314 . 0 0 "[ . 1 . 2]" 1
1245 1 54 TRP HE3 1 66 VAL MG2 . . 4.970 4.276 4.158 4.352 . 0 0 "[ . 1 . 2]" 1
1246 1 54 TRP HE3 1 67 PRO HA . . 3.850 3.753 3.708 3.797 . 0 0 "[ . 1 . 2]" 1
1247 1 54 TRP HE3 1 67 PRO HD2 . . 4.620 4.578 4.543 4.614 . 0 0 "[ . 1 . 2]" 1
1248 1 54 TRP HE3 1 67 PRO HD3 . . 4.140 3.441 3.389 3.477 . 0 0 "[ . 1 . 2]" 1
1249 1 54 TRP HH2 1 67 PRO HA . . 5.460 5.050 5.010 5.098 . 0 0 "[ . 1 . 2]" 1
1250 1 54 TRP HH2 1 67 PRO HB3 . . 4.230 3.632 3.577 3.685 . 0 0 "[ . 1 . 2]" 1
1251 1 54 TRP HH2 1 67 PRO HD3 . . 4.780 3.457 3.389 3.538 . 0 0 "[ . 1 . 2]" 1
1252 1 54 TRP HH2 1 67 PRO HG2 . . 5.500 5.502 5.476 5.508 0.008 11 0 "[ . 1 . 2]" 1
1253 1 54 TRP HH2 1 67 PRO HG3 . . 4.360 3.921 3.901 3.939 . 0 0 "[ . 1 . 2]" 1
1254 1 54 TRP HZ2 1 65 LYS HE3 . . 5.500 5.448 5.330 5.509 0.009 2 0 "[ . 1 . 2]" 1
1255 1 54 TRP HZ2 1 67 PRO HA . . 5.500 4.983 4.885 5.039 . 0 0 "[ . 1 . 2]" 1
1256 1 54 TRP HZ2 1 67 PRO HB3 . . 5.140 3.844 3.758 3.921 . 0 0 "[ . 1 . 2]" 1
1257 1 54 TRP HZ2 1 67 PRO HG3 . . 5.500 5.243 5.189 5.319 . 0 0 "[ . 1 . 2]" 1
1258 1 54 TRP HZ3 1 65 LYS HB2 . . 4.540 3.600 3.435 3.928 . 0 0 "[ . 1 . 2]" 1
1259 1 54 TRP HZ3 1 65 LYS HB3 . . 4.240 3.916 3.792 4.137 . 0 0 "[ . 1 . 2]" 1
1260 1 54 TRP HZ3 1 66 VAL H . . 4.900 4.588 4.403 4.701 . 0 0 "[ . 1 . 2]" 1
1261 1 54 TRP HZ3 1 66 VAL HA . . 3.910 3.112 2.937 3.260 . 0 0 "[ . 1 . 2]" 1
1262 1 54 TRP HZ3 1 66 VAL MG1 . . 5.160 4.671 4.554 4.786 . 0 0 "[ . 1 . 2]" 1
1263 1 54 TRP HZ3 1 67 PRO HA . . 4.800 4.499 4.443 4.546 . 0 0 "[ . 1 . 2]" 1
1264 1 54 TRP HZ3 1 67 PRO HB2 . . 5.500 5.499 5.399 5.513 0.013 15 0 "[ . 1 . 2]" 1
1265 1 54 TRP HZ3 1 67 PRO HB3 . . 5.000 4.021 3.906 4.053 . 0 0 "[ . 1 . 2]" 1
1266 1 54 TRP HZ3 1 67 PRO HD2 . . 4.130 3.824 3.746 3.881 . 0 0 "[ . 1 . 2]" 1
1267 1 54 TRP HZ3 1 67 PRO HD3 . . 3.610 2.192 2.143 2.236 . 0 0 "[ . 1 . 2]" 1
1268 1 54 TRP HZ3 1 67 PRO HG3 . . 4.600 4.036 3.932 4.058 . 0 0 "[ . 1 . 2]" 1
1269 1 55 LEU H 1 55 LEU HB2 . . 3.470 2.396 2.332 2.443 . 0 0 "[ . 1 . 2]" 1
1270 1 55 LEU H 1 55 LEU MD2 . . 4.560 4.318 4.257 4.405 . 0 0 "[ . 1 . 2]" 1
1271 1 55 LEU H 1 55 LEU HG . . 3.880 3.575 3.475 3.668 . 0 0 "[ . 1 . 2]" 1
1272 1 55 LEU H 1 56 MET H . . 4.880 4.474 4.444 4.508 . 0 0 "[ . 1 . 2]" 1
1273 1 55 LEU H 1 65 LYS HA . . 4.550 4.297 4.087 4.479 . 0 0 "[ . 1 . 2]" 1
1274 1 55 LEU H 1 66 VAL H . . 3.480 2.581 2.401 2.811 . 0 0 "[ . 1 . 2]" 1
1275 1 55 LEU H 1 66 VAL HA . . 4.910 4.522 4.436 4.606 . 0 0 "[ . 1 . 2]" 1
1276 1 55 LEU H 1 66 VAL MG2 . . 3.510 2.328 2.042 2.515 . 0 0 "[ . 1 . 2]" 1
1277 1 55 LEU H 1 67 PRO HA . . 4.300 4.182 4.121 4.246 . 0 0 "[ . 1 . 2]" 1
1278 1 55 LEU H 1 68 ILE H . . 4.430 4.070 3.894 4.185 . 0 0 "[ . 1 . 2]" 1
1279 1 55 LEU H 1 68 ILE HA . . 5.070 4.974 4.820 5.054 . 0 0 "[ . 1 . 2]" 1
1280 1 55 LEU H 1 68 ILE HG13 . . 5.500 4.189 4.032 4.347 . 0 0 "[ . 1 . 2]" 1
1281 1 55 LEU H 1 71 LEU MD1 . . 4.570 3.649 3.521 3.844 . 0 0 "[ . 1 . 2]" 1
1282 1 55 LEU HA 1 55 LEU MD1 . . 4.330 3.820 3.808 3.833 . 0 0 "[ . 1 . 2]" 1
1283 1 55 LEU HA 1 55 LEU MD2 . . 2.710 2.208 2.018 2.410 . 0 0 "[ . 1 . 2]" 1
1284 1 55 LEU HA 1 55 LEU HG . . 3.980 2.647 2.561 2.747 . 0 0 "[ . 1 . 2]" 1
1285 1 55 LEU HA 1 56 MET H . . 2.960 2.497 2.369 2.579 . 0 0 "[ . 1 . 2]" 1
1286 1 55 LEU HA 1 66 VAL H . . 4.870 4.449 4.374 4.536 . 0 0 "[ . 1 . 2]" 1
1287 1 55 LEU HA 1 66 VAL MG2 . . 4.670 3.880 3.729 4.006 . 0 0 "[ . 1 . 2]" 1
1288 1 55 LEU HB2 1 55 LEU MD1 . . 3.120 2.172 2.068 2.280 . 0 0 "[ . 1 . 2]" 1
1289 1 55 LEU HB2 1 56 MET H . . 4.020 3.718 3.594 3.940 . 0 0 "[ . 1 . 2]" 1
1290 1 55 LEU HB2 1 66 VAL H . . 4.640 4.110 3.959 4.295 . 0 0 "[ . 1 . 2]" 1
1291 1 55 LEU HB2 1 66 VAL MG2 . . 3.120 2.223 2.083 2.400 . 0 0 "[ . 1 . 2]" 1
1292 1 55 LEU HB2 1 71 LEU MD1 . . 3.110 2.908 2.802 3.095 . 0 0 "[ . 1 . 2]" 1
1293 1 55 LEU HB3 1 55 LEU MD1 . . 3.430 2.531 2.445 2.616 . 0 0 "[ . 1 . 2]" 1
1294 1 55 LEU HB3 1 56 MET H . . 3.100 2.269 2.094 2.583 . 0 0 "[ . 1 . 2]" 1
1295 1 55 LEU HB3 1 56 MET HA . . 4.950 4.412 4.322 4.556 . 0 0 "[ . 1 . 2]" 1
1296 1 55 LEU HB3 1 66 VAL H . . 5.500 4.698 4.571 4.839 . 0 0 "[ . 1 . 2]" 1
1297 1 55 LEU HB3 1 66 VAL MG2 . . 3.580 2.912 2.797 3.021 . 0 0 "[ . 1 . 2]" 1
1298 1 55 LEU HB3 1 71 LEU MD1 . . 4.970 3.965 3.837 4.191 . 0 0 "[ . 1 . 2]" 1
1299 1 55 LEU MD1 1 56 MET H . . 4.880 4.234 4.132 4.430 . 0 0 "[ . 1 . 2]" 1
1300 1 55 LEU MD1 1 68 ILE HA . . 3.940 3.682 3.539 3.918 . 0 0 "[ . 1 . 2]" 1
1301 1 55 LEU MD1 1 68 ILE HB . . 4.840 4.674 4.545 4.785 . 0 0 "[ . 1 . 2]" 1
1302 1 55 LEU MD1 1 68 ILE HG12 . . 4.190 2.769 2.611 2.933 . 0 0 "[ . 1 . 2]" 1
1303 1 55 LEU MD1 1 68 ILE HG13 . . 3.990 2.150 1.967 2.413 . 0 0 "[ . 1 . 2]" 1
1304 1 55 LEU MD1 1 71 LEU HB2 . . 4.240 3.994 3.818 4.183 . 0 0 "[ . 1 . 2]" 1
1305 1 55 LEU MD2 1 56 MET H . . 3.610 2.562 2.308 2.734 . 0 0 "[ . 1 . 2]" 1
1306 1 55 LEU HG 1 56 MET H . . 4.510 4.338 4.241 4.482 . 0 0 "[ . 1 . 2]" 1
1307 1 55 LEU HG 1 68 ILE HA . . 5.500 5.205 4.985 5.382 . 0 0 "[ . 1 . 2]" 1
1308 1 56 MET H 1 56 MET HB2 . . 3.300 2.406 2.292 2.499 . 0 0 "[ . 1 . 2]" 1
1309 1 56 MET H 1 56 MET HB3 . . 3.270 2.857 2.827 2.883 . 0 0 "[ . 1 . 2]" 1
1310 1 56 MET H 1 56 MET HG2 . . 4.720 4.541 4.310 4.733 0.013 12 0 "[ . 1 . 2]" 1
1311 1 56 MET H 1 56 MET QG . . 4.150 4.076 3.985 4.152 0.002 12 0 "[ . 1 . 2]" 1
1312 1 56 MET H 1 56 MET HG3 . . 4.720 4.632 4.545 4.725 0.005 10 0 "[ . 1 . 2]" 1
1313 1 56 MET H 1 65 LYS HA . . 5.320 5.100 4.890 5.261 . 0 0 "[ . 1 . 2]" 1
1314 1 56 MET H 1 66 VAL MG2 . . 4.020 3.817 3.609 4.023 0.003 9 0 "[ . 1 . 2]" 1
1315 1 56 MET HA 1 56 MET ME . . 3.270 2.990 2.615 3.243 . 0 0 "[ . 1 . 2]" 1
1316 1 56 MET HA 1 56 MET HG2 . . 4.060 3.254 2.636 3.644 . 0 0 "[ . 1 . 2]" 1
1317 1 56 MET HA 1 56 MET HG3 . . 4.060 3.109 2.666 3.641 . 0 0 "[ . 1 . 2]" 1
1318 1 56 MET HA 1 57 GLY H . . 2.800 2.186 2.179 2.190 . 0 0 "[ . 1 . 2]" 1
1319 1 56 MET HA 1 64 GLY H . . 4.570 4.256 4.097 4.458 . 0 0 "[ . 1 . 2]" 1
1320 1 56 MET HA 1 65 LYS H . . 5.370 5.234 5.054 5.369 . 0 0 "[ . 1 . 2]" 1
1321 1 56 MET HA 1 65 LYS HA . . 3.340 3.057 2.741 3.246 . 0 0 "[ . 1 . 2]" 1
1322 1 56 MET HA 1 65 LYS HG2 . . 5.280 4.224 3.971 4.438 . 0 0 "[ . 1 . 2]" 1
1323 1 56 MET HA 1 66 VAL H . . 4.120 3.913 3.772 4.110 . 0 0 "[ . 1 . 2]" 1
1324 1 56 MET HA 1 66 VAL MG2 . . 4.000 3.628 3.431 3.885 . 0 0 "[ . 1 . 2]" 1
1325 1 56 MET HB2 1 56 MET ME . . 4.730 4.044 3.942 4.114 . 0 0 "[ . 1 . 2]" 1
1326 1 56 MET HB2 1 57 GLY H . . 4.630 4.608 4.600 4.618 . 0 0 "[ . 1 . 2]" 1
1327 1 56 MET HB3 1 56 MET ME . . 4.390 4.150 4.032 4.222 . 0 0 "[ . 1 . 2]" 1
1328 1 56 MET HB3 1 57 GLY H . . 4.250 4.234 4.220 4.255 0.005 2 0 "[ . 1 . 2]" 1
1329 1 56 MET ME 1 56 MET HG2 . . 3.620 2.631 2.160 3.040 . 0 0 "[ . 1 . 2]" 1
1330 1 56 MET ME 1 56 MET QG . . 3.170 2.093 1.977 2.184 . 0 0 "[ . 1 . 2]" 1
1331 1 56 MET ME 1 56 MET HG3 . . 3.620 2.444 2.005 3.042 . 0 0 "[ . 1 . 2]" 1
1332 1 56 MET ME 1 57 GLY H . . 3.920 3.529 3.129 3.845 . 0 0 "[ . 1 . 2]" 1
1333 1 56 MET ME 1 63 LYS HA . . 4.260 3.544 3.278 3.999 . 0 0 "[ . 1 . 2]" 1
1334 1 56 MET ME 1 63 LYS QE . . 3.710 3.032 2.016 3.711 0.001 8 0 "[ . 1 . 2]" 1
1335 1 56 MET ME 1 64 GLY H . . 3.480 2.317 1.960 2.609 . 0 0 "[ . 1 . 2]" 1
1336 1 56 MET ME 1 64 GLY HA2 . . 3.150 2.264 2.058 2.465 . 0 0 "[ . 1 . 2]" 1
1337 1 56 MET ME 1 64 GLY HA3 . . 3.640 3.414 3.286 3.630 . 0 0 "[ . 1 . 2]" 1
1338 1 56 MET ME 1 65 LYS H . . 3.960 3.711 3.508 3.959 . 0 0 "[ . 1 . 2]" 1
1339 1 56 MET ME 1 65 LYS HA . . 3.880 3.620 3.210 3.868 . 0 0 "[ . 1 . 2]" 1
1340 1 56 MET ME 1 65 LYS HG3 . . 4.970 4.174 3.879 4.399 . 0 0 "[ . 1 . 2]" 1
1341 1 56 MET QG 1 57 GLY H . . 4.310 3.864 3.560 4.248 . 0 0 "[ . 1 . 2]" 1
1342 1 56 MET QG 1 63 LYS QE . . 4.560 3.437 1.836 4.505 . 0 0 "[ . 1 . 2]" 1
1343 1 56 MET QG 1 64 GLY H . . 4.750 4.110 3.594 4.699 . 0 0 "[ . 1 . 2]" 1
1344 1 56 MET QG 1 65 LYS HA . . 5.340 4.936 4.467 5.278 . 0 0 "[ . 1 . 2]" 1
1345 1 56 MET HG2 1 64 GLY H . . 5.500 5.284 4.934 5.501 0.001 19 0 "[ . 1 . 2]" 1
1346 1 56 MET HG3 1 64 GLY H . . 5.500 4.476 3.656 5.495 . 0 0 "[ . 1 . 2]" 1
1347 1 57 GLY H 1 58 GLU H . . 4.790 4.575 4.530 4.597 . 0 0 "[ . 1 . 2]" 1
1348 1 57 GLY H 1 63 LYS HA . . 5.390 5.008 4.843 5.230 . 0 0 "[ . 1 . 2]" 1
1349 1 57 GLY H 1 64 GLY H . . 3.620 3.309 3.124 3.491 . 0 0 "[ . 1 . 2]" 1
1350 1 57 GLY H 1 65 LYS HA . . 3.620 3.286 2.924 3.548 . 0 0 "[ . 1 . 2]" 1
1351 1 57 GLY H 1 66 VAL H . . 4.060 3.564 3.311 3.855 . 0 0 "[ . 1 . 2]" 1
1352 1 57 GLY H 1 66 VAL MG1 . . 3.850 2.667 2.452 2.994 . 0 0 "[ . 1 . 2]" 1
1353 1 57 GLY H 1 66 VAL MG2 . . 3.740 2.694 2.348 3.002 . 0 0 "[ . 1 . 2]" 1
1354 1 57 GLY HA2 1 58 GLU H . . 2.930 2.227 2.178 2.284 . 0 0 "[ . 1 . 2]" 1
1355 1 57 GLY HA2 1 58 GLU HB2 . . 5.230 4.321 4.262 4.456 . 0 0 "[ . 1 . 2]" 1
1356 1 57 GLY HA2 1 66 VAL MG1 . . 3.720 3.414 3.234 3.619 . 0 0 "[ . 1 . 2]" 1
1357 1 57 GLY HA2 1 66 VAL MG2 . . 3.950 3.221 2.950 3.413 . 0 0 "[ . 1 . 2]" 1
1358 1 57 GLY HA3 1 58 GLU H . . 3.080 2.987 2.895 3.083 0.003 18 0 "[ . 1 . 2]" 1
1359 1 57 GLY HA3 1 66 VAL MG1 . . 3.350 2.121 1.960 2.265 . 0 0 "[ . 1 . 2]" 1
1360 1 57 GLY HA3 1 66 VAL MG2 . . 3.610 2.787 2.409 3.089 . 0 0 "[ . 1 . 2]" 1
1361 1 58 GLU H 1 58 GLU HB2 . . 3.920 3.090 2.868 3.233 . 0 0 "[ . 1 . 2]" 1
1362 1 58 GLU H 1 58 GLU HB3 . . 3.500 2.788 2.663 2.893 . 0 0 "[ . 1 . 2]" 1
1363 1 58 GLU H 1 58 GLU HG2 . . 4.620 4.535 4.394 4.611 . 0 0 "[ . 1 . 2]" 1
1364 1 58 GLU H 1 58 GLU HG3 . . 5.170 4.744 4.611 4.859 . 0 0 "[ . 1 . 2]" 1
1365 1 58 GLU H 1 66 VAL MG1 . . 4.920 4.485 4.271 4.680 . 0 0 "[ . 1 . 2]" 1
1366 1 58 GLU HA 1 58 GLU HG2 . . 3.560 2.997 2.803 3.160 . 0 0 "[ . 1 . 2]" 1
1367 1 58 GLU HA 1 58 GLU HG3 . . 3.770 2.551 2.391 2.883 . 0 0 "[ . 1 . 2]" 1
1368 1 58 GLU HA 1 59 ARG H . . 2.640 2.149 2.144 2.151 . 0 0 "[ . 1 . 2]" 1
1369 1 58 GLU HA 1 62 GLN H . . 4.860 4.450 4.321 4.612 . 0 0 "[ . 1 . 2]" 1
1370 1 58 GLU HA 1 63 LYS H . . 4.890 4.887 4.855 4.921 0.031 17 0 "[ . 1 . 2]" 1
1371 1 58 GLU HA 1 63 LYS HA . . 2.880 2.517 2.366 2.613 . 0 0 "[ . 1 . 2]" 1
1372 1 58 GLU HA 1 63 LYS HB2 . . 5.260 5.028 4.816 5.239 . 0 0 "[ . 1 . 2]" 1
1373 1 58 GLU HA 1 63 LYS HB3 . . 4.860 4.497 3.971 4.862 0.002 17 0 "[ . 1 . 2]" 1
1374 1 58 GLU HA 1 63 LYS QG . . 3.740 2.695 2.372 3.006 . 0 0 "[ . 1 . 2]" 1
1375 1 58 GLU HA 1 64 GLY H . . 4.250 3.967 3.786 4.097 . 0 0 "[ . 1 . 2]" 1
1376 1 58 GLU HB2 1 59 ARG H . . 4.480 4.447 4.381 4.486 0.006 14 0 "[ . 1 . 2]" 1
1377 1 58 GLU HB2 1 63 LYS HA . . 4.780 4.126 3.929 4.329 . 0 0 "[ . 1 . 2]" 1
1378 1 58 GLU HB2 1 63 LYS QG . . 3.700 2.825 2.457 3.312 . 0 0 "[ . 1 . 2]" 1
1379 1 58 GLU HB3 1 59 ARG H . . 4.500 4.316 4.264 4.386 . 0 0 "[ . 1 . 2]" 1
1380 1 58 GLU HB3 1 63 LYS HA . . 5.460 5.288 5.143 5.373 . 0 0 "[ . 1 . 2]" 1
1381 1 58 GLU HB3 1 63 LYS QG . . 4.510 4.134 3.829 4.504 . 0 0 "[ . 1 . 2]" 1
1382 1 58 GLU HG2 1 59 ARG H . . 3.880 3.478 3.187 3.682 . 0 0 "[ . 1 . 2]" 1
1383 1 58 GLU HG2 1 63 LYS HA . . 5.210 4.916 4.794 5.113 . 0 0 "[ . 1 . 2]" 1
1384 1 58 GLU HG2 1 63 LYS QG . . 3.760 3.553 3.296 3.702 . 0 0 "[ . 1 . 2]" 1
1385 1 58 GLU HG3 1 59 ARG H . . 4.100 3.725 3.497 4.030 . 0 0 "[ . 1 . 2]" 1
1386 1 58 GLU HG3 1 63 LYS HA . . 4.340 3.717 3.468 4.214 . 0 0 "[ . 1 . 2]" 1
1387 1 58 GLU HG3 1 63 LYS QG . . 3.990 2.035 1.964 2.338 . 0 0 "[ . 1 . 2]" 1
1388 1 59 ARG H 1 59 ARG HB2 . . 3.760 2.800 2.630 3.106 . 0 0 "[ . 1 . 2]" 1
1389 1 59 ARG H 1 59 ARG HB3 . . 3.480 2.938 2.861 3.072 . 0 0 "[ . 1 . 2]" 1
1390 1 59 ARG H 1 59 ARG HG2 . . 5.070 4.666 4.587 4.737 . 0 0 "[ . 1 . 2]" 1
1391 1 59 ARG H 1 59 ARG QG . . 4.390 4.123 4.067 4.209 . 0 0 "[ . 1 . 2]" 1
1392 1 59 ARG H 1 59 ARG HG3 . . 5.070 4.604 4.473 4.840 . 0 0 "[ . 1 . 2]" 1
1393 1 59 ARG H 1 62 GLN H . . 3.800 3.291 3.055 3.512 . 0 0 "[ . 1 . 2]" 1
1394 1 59 ARG H 1 62 GLN QB . . 3.900 3.330 2.848 3.579 . 0 0 "[ . 1 . 2]" 1
1395 1 59 ARG H 1 63 LYS HA . . 3.770 3.548 3.327 3.710 . 0 0 "[ . 1 . 2]" 1
1396 1 59 ARG H 1 63 LYS QG . . 4.240 4.099 3.954 4.250 0.010 17 0 "[ . 1 . 2]" 1
1397 1 59 ARG HA 1 59 ARG HG2 . . 3.500 2.809 2.448 3.075 . 0 0 "[ . 1 . 2]" 1
1398 1 59 ARG HA 1 59 ARG QG . . 3.030 2.273 2.174 2.404 . 0 0 "[ . 1 . 2]" 1
1399 1 59 ARG HA 1 59 ARG HG3 . . 3.500 2.459 2.223 2.795 . 0 0 "[ . 1 . 2]" 1
1400 1 59 ARG HB2 1 59 ARG HD2 . . 3.760 3.496 2.755 3.721 . 0 0 "[ . 1 . 2]" 1
1401 1 59 ARG HB2 1 59 ARG HD3 . . 3.760 2.426 2.125 2.926 . 0 0 "[ . 1 . 2]" 1
1402 1 59 ARG HB2 1 59 ARG HE . . 5.140 3.932 3.435 4.601 . 0 0 "[ . 1 . 2]" 1
1403 1 59 ARG HB3 1 59 ARG QD . . 3.570 2.657 2.124 2.968 . 0 0 "[ . 1 . 2]" 1
1404 1 59 ARG HB3 1 59 ARG HE . . 4.760 2.965 2.304 4.251 . 0 0 "[ . 1 . 2]" 1
1405 1 59 ARG HB3 1 62 GLN H . . 4.860 4.510 4.200 4.865 0.005 18 0 "[ . 1 . 2]" 1
1406 1 59 ARG HB3 1 62 GLN QB . . 4.160 3.455 2.597 4.192 0.032 17 0 "[ . 1 . 2]" 1
1407 1 59 ARG QD 1 59 ARG QH1 . . 3.210 1.923 1.849 1.981 . 0 0 "[ . 1 . 2]" 1
1408 1 59 ARG HD2 1 59 ARG HH11 . . 4.270 2.509 2.377 2.653 . 0 0 "[ . 1 . 2]" 1
1409 1 59 ARG HD2 1 59 ARG HH12 . . 4.270 3.938 3.827 4.061 . 0 0 "[ . 1 . 2]" 1
1410 1 59 ARG HD3 1 59 ARG HH11 . . 4.270 2.025 1.899 2.145 . 0 0 "[ . 1 . 2]" 1
1411 1 59 ARG HD3 1 59 ARG HH12 . . 4.270 3.550 3.456 3.641 . 0 0 "[ . 1 . 2]" 1
1412 1 59 ARG QG 1 60 GLY QA . . 4.600 3.674 3.180 3.924 . 0 0 "[ . 1 . 2]" 1
1413 1 60 GLY QA 1 61 ASN QB . . 4.620 3.933 3.638 4.280 . 0 0 "[ . 1 . 2]" 1
1414 1 60 GLY QA 1 62 GLN H . . 4.120 3.783 3.483 3.945 . 0 0 "[ . 1 . 2]" 1
1415 1 60 GLY HA2 1 61 ASN QB . . 5.370 4.668 3.873 5.285 . 0 0 "[ . 1 . 2]" 1
1416 1 60 GLY HA2 1 62 GLN H . . 4.760 4.553 4.096 4.747 . 0 0 "[ . 1 . 2]" 1
1417 1 60 GLY HA3 1 61 ASN QB . . 5.370 4.331 3.937 4.648 . 0 0 "[ . 1 . 2]" 1
1418 1 60 GLY HA3 1 62 GLN H . . 4.760 4.049 3.769 4.236 . 0 0 "[ . 1 . 2]" 1
1419 1 61 ASN QB 1 62 GLN H . . 4.260 3.847 3.737 3.894 . 0 0 "[ . 1 . 2]" 1
1420 1 61 ASN QB 1 62 GLN HG2 . . 4.770 4.539 4.370 4.747 . 0 0 "[ . 1 . 2]" 1
1421 1 61 ASN QB 1 62 GLN HG3 . . 4.610 3.794 3.304 4.013 . 0 0 "[ . 1 . 2]" 1
1422 1 62 GLN H 1 62 GLN HB2 . . 3.860 2.658 2.468 2.801 . 0 0 "[ . 1 . 2]" 1
1423 1 62 GLN H 1 62 GLN QB . . 3.070 2.605 2.428 2.738 . 0 0 "[ . 1 . 2]" 1
1424 1 62 GLN H 1 62 GLN HB3 . . 3.860 3.748 3.610 3.867 0.007 5 0 "[ . 1 . 2]" 1
1425 1 62 GLN H 1 62 GLN HG2 . . 4.300 4.222 4.132 4.296 . 0 0 "[ . 1 . 2]" 1
1426 1 62 GLN H 1 62 GLN HG3 . . 3.770 3.572 3.080 3.766 . 0 0 "[ . 1 . 2]" 1
1427 1 62 GLN HA 1 62 GLN HG2 . . 3.430 2.310 2.206 2.656 . 0 0 "[ . 1 . 2]" 1
1428 1 62 GLN HA 1 62 GLN HG3 . . 3.640 3.083 2.996 3.177 . 0 0 "[ . 1 . 2]" 1
1429 1 62 GLN HA 1 63 LYS H . . 2.570 2.406 2.221 2.567 . 0 0 "[ . 1 . 2]" 1
1430 1 62 GLN HA 1 63 LYS HA . . 4.740 4.503 4.427 4.551 . 0 0 "[ . 1 . 2]" 1
1431 1 62 GLN HA 1 63 LYS QG . . 4.740 3.847 3.191 4.201 . 0 0 "[ . 1 . 2]" 1
1432 1 62 GLN QB 1 63 LYS H . . 3.360 2.421 2.099 2.871 . 0 0 "[ . 1 . 2]" 1
1433 1 62 GLN HB2 1 63 LYS H . . 4.170 3.784 3.592 4.032 . 0 0 "[ . 1 . 2]" 1
1434 1 62 GLN HB3 1 63 LYS H . . 4.170 2.451 2.113 2.938 . 0 0 "[ . 1 . 2]" 1
1435 1 62 GLN HG2 1 63 LYS H . . 4.310 3.698 3.427 4.136 . 0 0 "[ . 1 . 2]" 1
1436 1 62 GLN HG3 1 63 LYS H . . 5.040 4.757 4.537 4.944 . 0 0 "[ . 1 . 2]" 1
1437 1 63 LYS H 1 63 LYS HB2 . . 3.380 2.795 2.604 2.879 . 0 0 "[ . 1 . 2]" 1
1438 1 63 LYS H 1 63 LYS HB3 . . 3.880 3.817 3.689 3.907 0.027 13 0 "[ . 1 . 2]" 1
1439 1 63 LYS H 1 63 LYS QE . . 5.500 5.130 4.588 5.502 0.002 4 0 "[ . 1 . 2]" 1
1440 1 63 LYS H 1 63 LYS QG . . 3.660 3.409 2.690 3.670 0.010 17 0 "[ . 1 . 2]" 1
1441 1 63 LYS HA 1 63 LYS HD2 . . 5.320 4.302 2.603 5.005 . 0 0 "[ . 1 . 2]" 1
1442 1 63 LYS HA 1 63 LYS QD . . 4.630 3.875 2.549 4.295 . 0 0 "[ . 1 . 2]" 1
1443 1 63 LYS HA 1 63 LYS HD3 . . 5.320 4.493 3.641 4.675 . 0 0 "[ . 1 . 2]" 1
1444 1 63 LYS HA 1 63 LYS QG . . 3.320 2.289 2.135 2.598 . 0 0 "[ . 1 . 2]" 1
1445 1 63 LYS HA 1 64 GLY H . . 2.720 2.248 2.195 2.295 . 0 0 "[ . 1 . 2]" 1
1446 1 63 LYS HA 1 64 GLY HA3 . . 4.840 4.316 4.309 4.333 . 0 0 "[ . 1 . 2]" 1
1447 1 63 LYS HB2 1 63 LYS QE . . 4.820 2.864 2.101 3.500 . 0 0 "[ . 1 . 2]" 1
1448 1 63 LYS HB2 1 64 GLY H . . 4.340 4.060 3.700 4.204 . 0 0 "[ . 1 . 2]" 1
1449 1 63 LYS HB3 1 63 LYS QE . . 4.110 2.400 1.989 3.328 . 0 0 "[ . 1 . 2]" 1
1450 1 63 LYS HB3 1 64 GLY H . . 3.610 2.910 2.780 3.093 . 0 0 "[ . 1 . 2]" 1
1451 1 63 LYS QE 1 63 LYS QG . . 3.060 2.353 2.189 2.752 . 0 0 "[ . 1 . 2]" 1
1452 1 63 LYS QG 1 64 GLY H . . 4.220 3.792 3.484 4.223 0.003 9 0 "[ . 1 . 2]" 1
1453 1 64 GLY H 1 65 LYS H . . 4.650 4.367 4.337 4.384 . 0 0 "[ . 1 . 2]" 1
1454 1 64 GLY HA2 1 65 LYS H . . 3.020 2.659 2.517 2.765 . 0 0 "[ . 1 . 2]" 1
1455 1 64 GLY HA2 1 65 LYS HA . . 4.990 4.346 4.319 4.376 . 0 0 "[ . 1 . 2]" 1
1456 1 64 GLY HA2 1 65 LYS HG3 . . 4.480 4.112 3.966 4.241 . 0 0 "[ . 1 . 2]" 1
1457 1 64 GLY HA3 1 65 LYS H . . 3.100 2.471 2.377 2.606 . 0 0 "[ . 1 . 2]" 1
1458 1 64 GLY HA3 1 65 LYS HG3 . . 5.500 4.840 4.611 5.180 . 0 0 "[ . 1 . 2]" 1
1459 1 65 LYS H 1 65 LYS HB2 . . 3.210 2.480 2.344 2.584 . 0 0 "[ . 1 . 2]" 1
1460 1 65 LYS H 1 65 LYS HB3 . . 3.750 3.638 3.586 3.680 . 0 0 "[ . 1 . 2]" 1
1461 1 65 LYS H 1 65 LYS HD2 . . 5.330 5.063 4.963 5.190 . 0 0 "[ . 1 . 2]" 1
1462 1 65 LYS H 1 65 LYS HD3 . . 5.250 5.027 4.828 5.243 . 0 0 "[ . 1 . 2]" 1
1463 1 65 LYS H 1 65 LYS HE2 . . 5.140 4.328 4.228 4.433 . 0 0 "[ . 1 . 2]" 1
1464 1 65 LYS H 1 65 LYS HE3 . . 5.260 5.114 4.996 5.173 . 0 0 "[ . 1 . 2]" 1
1465 1 65 LYS H 1 65 LYS HG2 . . 3.580 3.291 3.087 3.494 . 0 0 "[ . 1 . 2]" 1
1466 1 65 LYS H 1 65 LYS HG3 . . 3.570 2.690 2.472 2.914 . 0 0 "[ . 1 . 2]" 1
1467 1 65 LYS HA 1 65 LYS HE2 . . 5.500 4.942 4.880 5.035 . 0 0 "[ . 1 . 2]" 1
1468 1 65 LYS HA 1 65 LYS HG2 . . 3.510 2.408 2.293 2.523 . 0 0 "[ . 1 . 2]" 1
1469 1 65 LYS HA 1 65 LYS HG3 . . 3.880 3.416 3.302 3.493 . 0 0 "[ . 1 . 2]" 1
1470 1 65 LYS HA 1 66 VAL H . . 2.670 2.205 2.144 2.350 . 0 0 "[ . 1 . 2]" 1
1471 1 65 LYS HA 1 66 VAL MG1 . . 4.290 3.761 3.565 3.970 . 0 0 "[ . 1 . 2]" 1
1472 1 65 LYS HA 1 66 VAL MG2 . . 3.880 3.579 3.427 3.714 . 0 0 "[ . 1 . 2]" 1
1473 1 65 LYS HB2 1 65 LYS HD2 . . 4.150 3.429 3.372 3.494 . 0 0 "[ . 1 . 2]" 1
1474 1 65 LYS HB2 1 65 LYS HD3 . . 4.010 3.847 3.796 3.895 . 0 0 "[ . 1 . 2]" 1
1475 1 65 LYS HB2 1 65 LYS HE2 . . 4.050 2.483 2.349 2.615 . 0 0 "[ . 1 . 2]" 1
1476 1 65 LYS HB2 1 65 LYS HE3 . . 4.050 2.781 2.614 2.856 . 0 0 "[ . 1 . 2]" 1
1477 1 65 LYS HB2 1 66 VAL H . . 4.340 4.044 3.602 4.293 . 0 0 "[ . 1 . 2]" 1
1478 1 65 LYS HB3 1 65 LYS HD2 . . 4.110 2.405 2.319 2.492 . 0 0 "[ . 1 . 2]" 1
1479 1 65 LYS HB3 1 65 LYS HD3 . . 4.050 3.579 3.555 3.609 . 0 0 "[ . 1 . 2]" 1
1480 1 65 LYS HB3 1 65 LYS HE2 . . 4.030 3.136 3.008 3.273 . 0 0 "[ . 1 . 2]" 1
1481 1 65 LYS HB3 1 65 LYS HE3 . . 4.200 2.464 2.313 2.602 . 0 0 "[ . 1 . 2]" 1
1482 1 65 LYS HB3 1 66 VAL H . . 3.850 3.057 2.591 3.383 . 0 0 "[ . 1 . 2]" 1
1483 1 65 LYS HE2 1 65 LYS HG2 . . 4.050 3.592 3.565 3.618 . 0 0 "[ . 1 . 2]" 1
1484 1 65 LYS HE2 1 65 LYS HG3 . . 3.890 2.418 2.331 2.508 . 0 0 "[ . 1 . 2]" 1
1485 1 65 LYS HE3 1 65 LYS HG2 . . 4.060 3.852 3.794 3.905 . 0 0 "[ . 1 . 2]" 1
1486 1 65 LYS HE3 1 65 LYS HG3 . . 4.190 3.432 3.368 3.490 . 0 0 "[ . 1 . 2]" 1
1487 1 65 LYS HG2 1 66 VAL H . . 4.600 4.321 4.172 4.391 . 0 0 "[ . 1 . 2]" 1
1488 1 65 LYS HG3 1 66 VAL H . . 5.360 5.260 5.095 5.369 0.009 14 0 "[ . 1 . 2]" 1
1489 1 66 VAL H 1 66 VAL MG1 . . 3.820 3.007 2.768 3.204 . 0 0 "[ . 1 . 2]" 1
1490 1 66 VAL H 1 66 VAL MG2 . . 3.000 2.086 1.902 2.312 . 0 0 "[ . 1 . 2]" 1
1491 1 66 VAL H 1 67 PRO HA . . 5.340 5.045 4.848 5.190 . 0 0 "[ . 1 . 2]" 1
1492 1 66 VAL H 1 67 PRO HD2 . . 5.190 4.809 4.766 4.834 . 0 0 "[ . 1 . 2]" 1
1493 1 66 VAL H 1 67 PRO HD3 . . 5.000 4.698 4.571 4.808 . 0 0 "[ . 1 . 2]" 1
1494 1 66 VAL HA 1 66 VAL MG1 . . 3.030 2.252 2.204 2.315 . 0 0 "[ . 1 . 2]" 1
1495 1 66 VAL HA 1 66 VAL MG2 . . 3.500 3.195 3.175 3.203 . 0 0 "[ . 1 . 2]" 1
1496 1 66 VAL HA 1 67 PRO HA . . 4.810 4.424 4.415 4.429 . 0 0 "[ . 1 . 2]" 1
1497 1 66 VAL HA 1 67 PRO HD2 . . 2.940 2.108 2.083 2.149 . 0 0 "[ . 1 . 2]" 1
1498 1 66 VAL HA 1 67 PRO HD3 . . 2.750 2.259 2.253 2.265 . 0 0 "[ . 1 . 2]" 1
1499 1 66 VAL HA 1 67 PRO HG2 . . 4.890 4.279 4.259 4.312 . 0 0 "[ . 1 . 2]" 1
1500 1 66 VAL HA 1 67 PRO HG3 . . 4.430 4.335 4.328 4.348 . 0 0 "[ . 1 . 2]" 1
1501 1 66 VAL HB 1 67 PRO HD2 . . 3.220 2.691 2.530 2.775 . 0 0 "[ . 1 . 2]" 1
1502 1 66 VAL HB 1 67 PRO HD3 . . 4.080 4.022 3.898 4.083 0.003 14 0 "[ . 1 . 2]" 1
1503 1 66 VAL HB 1 71 LEU MD2 . . 3.640 2.657 2.421 2.948 . 0 0 "[ . 1 . 2]" 1
1504 1 66 VAL MG1 1 67 PRO HD2 . . 3.990 3.186 2.988 3.317 . 0 0 "[ . 1 . 2]" 1
1505 1 66 VAL MG1 1 67 PRO HD3 . . 4.100 3.977 3.853 4.064 . 0 0 "[ . 1 . 2]" 1
1506 1 66 VAL MG2 1 67 PRO HD2 . . 4.300 4.066 3.921 4.151 . 0 0 "[ . 1 . 2]" 1
1507 1 66 VAL MG2 1 67 PRO HD3 . . 4.940 4.730 4.660 4.774 . 0 0 "[ . 1 . 2]" 1
1508 1 66 VAL MG2 1 68 ILE HA . . 4.840 4.269 4.039 4.570 . 0 0 "[ . 1 . 2]" 1
1509 1 67 PRO HA 1 68 ILE H . . 2.610 2.156 2.152 2.166 . 0 0 "[ . 1 . 2]" 1
1510 1 67 PRO HA 1 68 ILE HB . . 4.600 4.420 4.402 4.453 . 0 0 "[ . 1 . 2]" 1
1511 1 67 PRO HA 1 68 ILE MD . . 3.830 3.328 3.226 3.404 . 0 0 "[ . 1 . 2]" 1
1512 1 67 PRO HA 1 69 THR H . . 4.230 3.691 3.604 3.743 . 0 0 "[ . 1 . 2]" 1
1513 1 67 PRO HA 1 70 TYR H . . 5.270 4.529 4.501 4.595 . 0 0 "[ . 1 . 2]" 1
1514 1 67 PRO HA 1 70 TYR QD . . 5.500 4.879 4.598 5.222 . 0 0 "[ . 1 . 2]" 1
1515 1 67 PRO HB2 1 68 ILE H . . 4.280 3.737 3.684 3.820 . 0 0 "[ . 1 . 2]" 1
1516 1 67 PRO HB2 1 69 THR H . . 3.350 3.178 3.046 3.273 . 0 0 "[ . 1 . 2]" 1
1517 1 67 PRO HB2 1 70 TYR H . . 4.040 2.897 2.791 3.034 . 0 0 "[ . 1 . 2]" 1
1518 1 67 PRO HB2 1 70 TYR HB2 . . 4.250 3.205 3.096 3.336 . 0 0 "[ . 1 . 2]" 1
1519 1 67 PRO HB2 1 70 TYR HB3 . . 5.190 4.825 4.729 4.920 . 0 0 "[ . 1 . 2]" 1
1520 1 67 PRO HB2 1 70 TYR QD . . 3.590 2.298 1.996 2.736 . 0 0 "[ . 1 . 2]" 1
1521 1 67 PRO HB2 1 70 TYR QE . . 4.300 3.710 3.449 4.012 . 0 0 "[ . 1 . 2]" 1
1522 1 67 PRO HB2 1 71 LEU H . . 5.300 4.831 4.747 4.915 . 0 0 "[ . 1 . 2]" 1
1523 1 67 PRO HB3 1 68 ILE H . . 4.330 4.143 4.105 4.203 . 0 0 "[ . 1 . 2]" 1
1524 1 67 PRO HB3 1 69 THR H . . 4.650 4.397 4.297 4.459 . 0 0 "[ . 1 . 2]" 1
1525 1 67 PRO HB3 1 70 TYR H . . 4.750 4.617 4.520 4.747 . 0 0 "[ . 1 . 2]" 1
1526 1 67 PRO HB3 1 70 TYR QD . . 4.660 3.838 3.527 4.282 . 0 0 "[ . 1 . 2]" 1
1527 1 67 PRO HB3 1 70 TYR QE . . 5.100 4.466 4.129 4.893 . 0 0 "[ . 1 . 2]" 1
1528 1 67 PRO HD2 1 71 LEU MD1 . . 4.730 3.973 3.744 4.140 . 0 0 "[ . 1 . 2]" 1
1529 1 67 PRO HD2 1 71 LEU MD2 . . 5.300 4.145 3.997 4.307 . 0 0 "[ . 1 . 2]" 1
1530 1 67 PRO HG2 1 70 TYR H . . 4.020 3.463 3.344 3.596 . 0 0 "[ . 1 . 2]" 1
1531 1 67 PRO HG2 1 70 TYR HB2 . . 3.570 2.031 1.998 2.074 . 0 0 "[ . 1 . 2]" 1
1532 1 67 PRO HG2 1 70 TYR HB3 . . 4.200 3.480 3.421 3.536 . 0 0 "[ . 1 . 2]" 1
1533 1 67 PRO HG2 1 70 TYR QD . . 3.850 3.117 2.850 3.440 . 0 0 "[ . 1 . 2]" 1
1534 1 67 PRO HG2 1 70 TYR QE . . 4.890 4.515 4.315 4.733 . 0 0 "[ . 1 . 2]" 1
1535 1 67 PRO HG3 1 70 TYR H . . 5.120 4.854 4.723 5.003 . 0 0 "[ . 1 . 2]" 1
1536 1 67 PRO HG3 1 70 TYR HB2 . . 5.000 3.639 3.577 3.695 . 0 0 "[ . 1 . 2]" 1
1537 1 67 PRO HG3 1 70 TYR HB3 . . 4.910 4.855 4.783 4.913 0.003 11 0 "[ . 1 . 2]" 1
1538 1 67 PRO HG3 1 70 TYR QD . . 4.640 3.725 3.500 4.061 . 0 0 "[ . 1 . 2]" 1
1539 1 67 PRO HG3 1 70 TYR QE . . 4.830 4.302 4.055 4.636 . 0 0 "[ . 1 . 2]" 1
1540 1 68 ILE H 1 68 ILE HB . . 3.010 2.334 2.311 2.372 . 0 0 "[ . 1 . 2]" 1
1541 1 68 ILE H 1 68 ILE MD . . 3.010 1.883 1.867 1.942 . 0 0 "[ . 1 . 2]" 1
1542 1 68 ILE H 1 68 ILE HG12 . . 4.050 4.027 3.974 4.069 0.019 14 0 "[ . 1 . 2]" 1
1543 1 68 ILE H 1 68 ILE HG13 . . 3.500 3.375 3.299 3.441 . 0 0 "[ . 1 . 2]" 1
1544 1 68 ILE H 1 68 ILE MG . . 4.090 3.707 3.693 3.725 . 0 0 "[ . 1 . 2]" 1
1545 1 68 ILE H 1 69 THR H . . 2.910 2.668 2.622 2.723 . 0 0 "[ . 1 . 2]" 1
1546 1 68 ILE H 1 69 THR HA . . 5.300 5.251 5.209 5.295 . 0 0 "[ . 1 . 2]" 1
1547 1 68 ILE H 1 71 LEU MD1 . . 4.770 3.528 3.253 3.711 . 0 0 "[ . 1 . 2]" 1
1548 1 68 ILE HA 1 68 ILE MD . . 3.210 3.107 3.064 3.133 . 0 0 "[ . 1 . 2]" 1
1549 1 68 ILE HA 1 68 ILE HG12 . . 3.680 3.463 3.448 3.480 . 0 0 "[ . 1 . 2]" 1
1550 1 68 ILE HA 1 68 ILE HG13 . . 3.420 2.168 2.152 2.197 . 0 0 "[ . 1 . 2]" 1
1551 1 68 ILE HA 1 68 ILE MG . . 3.140 2.516 2.479 2.532 . 0 0 "[ . 1 . 2]" 1
1552 1 68 ILE HA 1 69 THR HA . . 4.980 4.847 4.829 4.867 . 0 0 "[ . 1 . 2]" 1
1553 1 68 ILE HA 1 70 TYR H . . 4.020 3.621 3.477 3.803 . 0 0 "[ . 1 . 2]" 1
1554 1 68 ILE HA 1 70 TYR HB2 . . 5.300 5.043 4.973 5.180 . 0 0 "[ . 1 . 2]" 1
1555 1 68 ILE HA 1 71 LEU H . . 4.050 2.972 2.943 3.006 . 0 0 "[ . 1 . 2]" 1
1556 1 68 ILE HA 1 71 LEU HB2 . . 3.230 2.612 2.455 2.683 . 0 0 "[ . 1 . 2]" 1
1557 1 68 ILE HA 1 71 LEU HB3 . . 4.300 4.243 4.063 4.304 0.004 6 0 "[ . 1 . 2]" 1
1558 1 68 ILE HA 1 71 LEU MD1 . . 2.950 2.165 1.957 2.347 . 0 0 "[ . 1 . 2]" 1
1559 1 68 ILE HA 1 71 LEU MD2 . . 4.620 4.354 4.200 4.530 . 0 0 "[ . 1 . 2]" 1
1560 1 68 ILE HA 1 71 LEU HG . . 3.900 3.117 2.985 3.316 . 0 0 "[ . 1 . 2]" 1
1561 1 68 ILE HB 1 68 ILE MD . . 2.960 2.210 2.162 2.290 . 0 0 "[ . 1 . 2]" 1
1562 1 68 ILE HB 1 69 THR H . . 3.900 2.888 2.834 2.947 . 0 0 "[ . 1 . 2]" 1
1563 1 68 ILE HB 1 71 LEU MD1 . . 4.700 4.478 4.239 4.696 . 0 0 "[ . 1 . 2]" 1
1564 1 68 ILE MD 1 69 THR H . . 4.190 4.011 3.969 4.077 . 0 0 "[ . 1 . 2]" 1
1565 1 68 ILE MD 1 71 LEU H . . 5.500 5.503 5.480 5.517 0.017 14 0 "[ . 1 . 2]" 1
1566 1 68 ILE HG12 1 68 ILE MG . . 2.750 2.055 2.023 2.110 . 0 0 "[ . 1 . 2]" 1
1567 1 68 ILE HG12 1 69 THR H . . 5.380 5.320 5.285 5.364 . 0 0 "[ . 1 . 2]" 1
1568 1 68 ILE HG12 1 71 LEU MD1 . . 4.520 4.229 3.995 4.507 . 0 0 "[ . 1 . 2]" 1
1569 1 68 ILE HG13 1 68 ILE MG . . 2.950 2.692 2.666 2.709 . 0 0 "[ . 1 . 2]" 1
1570 1 68 ILE HG13 1 69 THR H . . 5.050 4.944 4.910 4.972 . 0 0 "[ . 1 . 2]" 1
1571 1 68 ILE HG13 1 71 LEU H . . 5.500 5.058 5.003 5.109 . 0 0 "[ . 1 . 2]" 1
1572 1 68 ILE HG13 1 71 LEU MD1 . . 4.350 2.748 2.483 3.031 . 0 0 "[ . 1 . 2]" 1
1573 1 68 ILE MG 1 69 THR H . . 3.430 3.280 3.217 3.402 . 0 0 "[ . 1 . 2]" 1
1574 1 68 ILE MG 1 69 THR HA . . 3.730 3.245 3.178 3.322 . 0 0 "[ . 1 . 2]" 1
1575 1 68 ILE MG 1 69 THR HB . . 5.440 5.308 5.233 5.391 . 0 0 "[ . 1 . 2]" 1
1576 1 68 ILE MG 1 70 TYR H . . 4.480 4.336 4.181 4.457 . 0 0 "[ . 1 . 2]" 1
1577 1 69 THR H 1 69 THR HB . . 3.660 3.570 3.545 3.602 . 0 0 "[ . 1 . 2]" 1
1578 1 69 THR H 1 69 THR MG . . 2.920 2.628 2.350 2.760 . 0 0 "[ . 1 . 2]" 1
1579 1 69 THR H 1 70 TYR H . . 3.070 2.692 2.654 2.733 . 0 0 "[ . 1 . 2]" 1
1580 1 69 THR H 1 70 TYR HB2 . . 5.150 4.798 4.734 4.886 . 0 0 "[ . 1 . 2]" 1
1581 1 69 THR H 1 70 TYR QD . . 4.370 3.665 3.517 3.790 . 0 0 "[ . 1 . 2]" 1
1582 1 69 THR HA 1 69 THR HB . . 2.630 2.612 2.555 2.650 0.020 9 0 "[ . 1 . 2]" 1
1583 1 69 THR HA 1 69 THR MG . . 2.650 2.178 2.032 2.304 . 0 0 "[ . 1 . 2]" 1
1584 1 69 THR HA 1 70 TYR QD . . 5.240 4.388 4.067 4.620 . 0 0 "[ . 1 . 2]" 1
1585 1 69 THR HA 1 71 LEU H . . 4.050 4.031 3.955 4.060 0.010 15 0 "[ . 1 . 2]" 1
1586 1 69 THR HB 1 70 TYR H . . 4.550 3.811 3.603 3.965 . 0 0 "[ . 1 . 2]" 1
1587 1 69 THR HB 1 70 TYR QD . . 4.710 3.144 2.713 3.385 . 0 0 "[ . 1 . 2]" 1
1588 1 69 THR HB 1 70 TYR QE . . 5.110 3.729 3.224 3.988 . 0 0 "[ . 1 . 2]" 1
1589 1 69 THR HB 1 71 LEU H . . 5.500 5.355 5.175 5.442 . 0 0 "[ . 1 . 2]" 1
1590 1 69 THR MG 1 70 TYR H . . 4.360 4.252 4.173 4.322 . 0 0 "[ . 1 . 2]" 1
1591 1 69 THR MG 1 70 TYR QD . . 4.430 4.164 4.037 4.360 . 0 0 "[ . 1 . 2]" 1
1592 1 69 THR MG 1 70 TYR QE . . 4.980 4.494 4.281 4.715 . 0 0 "[ . 1 . 2]" 1
1593 1 70 TYR H 1 70 TYR HB2 . . 2.990 2.382 2.347 2.439 . 0 0 "[ . 1 . 2]" 1
1594 1 70 TYR H 1 70 TYR HB3 . . 3.720 3.621 3.600 3.657 . 0 0 "[ . 1 . 2]" 1
1595 1 70 TYR H 1 70 TYR QD . . 3.270 2.377 2.245 2.464 . 0 0 "[ . 1 . 2]" 1
1596 1 70 TYR H 1 70 TYR QE . . 4.790 4.708 4.590 4.794 0.004 9 0 "[ . 1 . 2]" 1
1597 1 70 TYR H 1 71 LEU H . . 2.870 2.143 2.059 2.247 . 0 0 "[ . 1 . 2]" 1
1598 1 70 TYR H 1 71 LEU HA . . 4.910 4.824 4.733 4.883 . 0 0 "[ . 1 . 2]" 1
1599 1 70 TYR H 1 71 LEU MD1 . . 4.290 4.102 3.984 4.225 . 0 0 "[ . 1 . 2]" 1
1600 1 70 TYR H 1 71 LEU MD2 . . 4.760 4.658 4.571 4.760 . 0 0 "[ . 1 . 2]" 1
1601 1 70 TYR H 1 71 LEU HG . . 3.610 3.321 3.203 3.440 . 0 0 "[ . 1 . 2]" 1
1602 1 70 TYR HA 1 70 TYR QD . . 3.940 3.047 2.920 3.108 . 0 0 "[ . 1 . 2]" 1
1603 1 70 TYR HA 1 70 TYR QE . . 4.800 4.609 4.574 4.633 . 0 0 "[ . 1 . 2]" 1
1604 1 70 TYR HA 1 71 LEU HG . . 4.820 4.734 4.663 4.785 . 0 0 "[ . 1 . 2]" 1
1605 1 70 TYR HB2 1 71 LEU H . . 4.140 3.340 3.278 3.444 . 0 0 "[ . 1 . 2]" 1
1606 1 70 TYR HB2 1 71 LEU MD1 . . 4.760 4.277 4.194 4.356 . 0 0 "[ . 1 . 2]" 1
1607 1 70 TYR HB2 1 71 LEU MD2 . . 3.960 3.739 3.616 3.843 . 0 0 "[ . 1 . 2]" 1
1608 1 70 TYR HB2 1 71 LEU HG . . 4.340 3.111 3.074 3.146 . 0 0 "[ . 1 . 2]" 1
1609 1 70 TYR HB3 1 71 LEU H . . 4.500 4.032 3.985 4.109 . 0 0 "[ . 1 . 2]" 1
1610 1 70 TYR HB3 1 71 LEU MD2 . . 4.110 3.810 3.669 3.939 . 0 0 "[ . 1 . 2]" 1
1611 1 70 TYR HB3 1 71 LEU HG . . 4.640 3.967 3.840 4.054 . 0 0 "[ . 1 . 2]" 1
1612 1 70 TYR QD 1 71 LEU MD1 . . 5.500 5.496 5.484 5.508 0.008 5 0 "[ . 1 . 2]" 1
1613 1 70 TYR QD 1 71 LEU MD2 . . 5.200 5.145 5.050 5.204 0.004 5 0 "[ . 1 . 2]" 1
1614 1 71 LEU H 1 71 LEU HB2 . . 3.100 2.746 2.711 2.770 . 0 0 "[ . 1 . 2]" 1
1615 1 71 LEU H 1 71 LEU HB3 . . 3.930 3.729 3.710 3.754 . 0 0 "[ . 1 . 2]" 1
1616 1 71 LEU H 1 71 LEU MD1 . . 3.970 3.431 3.349 3.521 . 0 0 "[ . 1 . 2]" 1
1617 1 71 LEU H 1 71 LEU MD2 . . 3.970 3.710 3.636 3.796 . 0 0 "[ . 1 . 2]" 1
1618 1 71 LEU H 1 71 LEU HG . . 3.240 2.352 2.304 2.450 . 0 0 "[ . 1 . 2]" 1
1619 1 71 LEU H 1 72 GLU H . . 4.670 4.517 4.487 4.541 . 0 0 "[ . 1 . 2]" 1
1620 1 71 LEU H 1 73 LEU MD2 . . 5.500 5.456 5.307 5.501 0.001 2 0 "[ . 1 . 2]" 1
1621 1 71 LEU HA 1 71 LEU MD1 . . 4.380 4.005 3.992 4.013 . 0 0 "[ . 1 . 2]" 1
1622 1 71 LEU HA 1 71 LEU MD2 . . 2.830 2.674 2.617 2.714 . 0 0 "[ . 1 . 2]" 1
1623 1 71 LEU HA 1 71 LEU HG . . 3.830 3.100 3.064 3.145 . 0 0 "[ . 1 . 2]" 1
1624 1 71 LEU HA 1 72 GLU H . . 2.760 2.249 2.203 2.309 . 0 0 "[ . 1 . 2]" 1
1625 1 71 LEU HA 1 72 GLU HB2 . . 5.180 4.588 4.508 4.628 . 0 0 "[ . 1 . 2]" 1
1626 1 71 LEU HA 1 72 GLU HB3 . . 4.900 4.357 4.310 4.447 . 0 0 "[ . 1 . 2]" 1
1627 1 71 LEU HB2 1 71 LEU MD1 . . 3.110 2.047 1.979 2.144 . 0 0 "[ . 1 . 2]" 1
1628 1 71 LEU HB2 1 72 GLU H . . 4.070 3.696 3.561 3.843 . 0 0 "[ . 1 . 2]" 1
1629 1 71 LEU HB3 1 71 LEU MD1 . . 3.180 2.609 2.547 2.681 . 0 0 "[ . 1 . 2]" 1
1630 1 71 LEU HB3 1 71 LEU MD2 . . 3.120 2.044 2.014 2.085 . 0 0 "[ . 1 . 2]" 1
1631 1 71 LEU HB3 1 72 GLU H . . 3.740 2.894 2.723 3.039 . 0 0 "[ . 1 . 2]" 1
1632 1 71 LEU HB3 1 72 GLU HA . . 5.020 4.767 4.689 4.818 . 0 0 "[ . 1 . 2]" 1
1633 1 71 LEU MD2 1 72 GLU H . . 4.040 3.962 3.813 4.023 . 0 0 "[ . 1 . 2]" 1
1634 1 71 LEU HG 1 72 GLU H . . 5.500 5.015 4.965 5.055 . 0 0 "[ . 1 . 2]" 1
1635 1 72 GLU H 1 72 GLU HB2 . . 3.660 3.260 3.151 3.347 . 0 0 "[ . 1 . 2]" 1
1636 1 72 GLU H 1 72 GLU HB3 . . 3.480 2.547 2.496 2.616 . 0 0 "[ . 1 . 2]" 1
1637 1 72 GLU H 1 72 GLU HG2 . . 4.910 4.299 4.258 4.408 . 0 0 "[ . 1 . 2]" 1
1638 1 72 GLU H 1 72 GLU HG3 . . 4.670 4.560 4.524 4.589 . 0 0 "[ . 1 . 2]" 1
1639 1 72 GLU H 1 73 LEU HA . . 5.350 4.588 4.482 4.705 . 0 0 "[ . 1 . 2]" 1
1640 1 72 GLU HA 1 72 GLU HG2 . . 3.700 3.542 3.503 3.587 . 0 0 "[ . 1 . 2]" 1
1641 1 72 GLU HA 1 72 GLU HG3 . . 3.250 2.599 2.510 2.637 . 0 0 "[ . 1 . 2]" 1
1642 1 72 GLU HA 1 73 LEU H . . 2.620 2.299 2.235 2.332 . 0 0 "[ . 1 . 2]" 1
1643 1 72 GLU HA 1 73 LEU HB2 . . 4.850 4.636 4.549 4.700 . 0 0 "[ . 1 . 2]" 1
1644 1 72 GLU HA 1 73 LEU MD2 . . 4.680 4.237 4.066 4.405 . 0 0 "[ . 1 . 2]" 1
1645 1 72 GLU HA 1 73 LEU HG . . 4.620 4.111 3.999 4.254 . 0 0 "[ . 1 . 2]" 1
1646 1 72 GLU HB2 1 72 GLU HG3 . . 2.910 2.608 2.576 2.647 . 0 0 "[ . 1 . 2]" 1
1647 1 72 GLU HB2 1 73 LEU H . . 4.630 4.530 4.467 4.565 . 0 0 "[ . 1 . 2]" 1
1648 1 72 GLU HB2 1 74 LEU MD2 . . 5.040 4.868 4.754 4.972 . 0 0 "[ . 1 . 2]" 1
1649 1 72 GLU HB3 1 73 LEU H . . 4.740 4.541 4.512 4.553 . 0 0 "[ . 1 . 2]" 1
1650 1 72 GLU HB3 1 74 LEU MD2 . . 4.780 3.603 3.472 3.727 . 0 0 "[ . 1 . 2]" 1
1651 1 72 GLU HB3 1 74 LEU HG . . 5.500 4.876 4.683 5.049 . 0 0 "[ . 1 . 2]" 1
1652 1 72 GLU HG2 1 73 LEU H . . 4.560 4.536 4.480 4.561 0.001 13 0 "[ . 1 . 2]" 1
1653 1 72 GLU HG2 1 74 LEU HA . . 4.920 3.785 3.636 3.927 . 0 0 "[ . 1 . 2]" 1
1654 1 72 GLU HG2 1 74 LEU MD2 . . 3.510 2.575 2.421 2.663 . 0 0 "[ . 1 . 2]" 1
1655 1 72 GLU HG2 1 74 LEU HG . . 4.700 4.249 4.085 4.424 . 0 0 "[ . 1 . 2]" 1
1656 1 72 GLU HG3 1 73 LEU H . . 3.960 3.854 3.624 3.958 . 0 0 "[ . 1 . 2]" 1
1657 1 72 GLU HG3 1 74 LEU MD2 . . 4.180 4.068 3.921 4.158 . 0 0 "[ . 1 . 2]" 1
1658 1 73 LEU H 1 73 LEU HB2 . . 2.990 2.740 2.659 2.807 . 0 0 "[ . 1 . 2]" 1
1659 1 73 LEU H 1 73 LEU HB3 . . 3.600 3.583 3.570 3.603 0.003 13 0 "[ . 1 . 2]" 1
1660 1 73 LEU H 1 73 LEU MD1 . . 4.030 3.707 3.645 3.784 . 0 0 "[ . 1 . 2]" 1
1661 1 73 LEU H 1 73 LEU MD2 . . 3.950 2.499 2.285 2.638 . 0 0 "[ . 1 . 2]" 1
1662 1 73 LEU H 1 73 LEU HG . . 3.200 2.081 1.986 2.196 . 0 0 "[ . 1 . 2]" 1
1663 1 73 LEU H 1 74 LEU H . . 4.740 4.379 4.306 4.441 . 0 0 "[ . 1 . 2]" 1
1664 1 73 LEU HA 1 73 LEU MD1 . . 3.910 3.789 3.732 3.835 . 0 0 "[ . 1 . 2]" 1
1665 1 73 LEU HA 1 73 LEU MD2 . . 2.920 2.025 1.948 2.145 . 0 0 "[ . 1 . 2]" 1
1666 1 73 LEU HA 1 73 LEU HG . . 3.820 3.404 3.356 3.458 . 0 0 "[ . 1 . 2]" 1
1667 1 73 LEU HA 1 74 LEU H . . 2.660 2.153 2.141 2.171 . 0 0 "[ . 1 . 2]" 1
1668 1 73 LEU HA 1 74 LEU MD2 . . 4.660 4.608 4.463 4.661 0.001 8 0 "[ . 1 . 2]" 1
1669 1 73 LEU HA 1 74 LEU HG . . 4.220 3.641 3.524 3.778 . 0 0 "[ . 1 . 2]" 1
1670 1 73 LEU HB2 1 73 LEU MD1 . . 3.520 2.407 2.338 2.474 . 0 0 "[ . 1 . 2]" 1
1671 1 73 LEU HB2 1 73 LEU MD2 . . 3.360 3.174 3.166 3.183 . 0 0 "[ . 1 . 2]" 1
1672 1 73 LEU HB2 1 74 LEU H . . 4.410 4.302 4.229 4.387 . 0 0 "[ . 1 . 2]" 1
1673 1 73 LEU HB3 1 73 LEU MD1 . . 3.580 2.303 2.214 2.352 . 0 0 "[ . 1 . 2]" 1
1674 1 73 LEU HB3 1 73 LEU MD2 . . 3.160 2.436 2.387 2.487 . 0 0 "[ . 1 . 2]" 1
1675 1 73 LEU HB3 1 74 LEU H . . 3.770 3.656 3.535 3.764 . 0 0 "[ . 1 . 2]" 1
1676 1 73 LEU MD1 1 74 LEU H . . 5.500 5.246 5.168 5.357 . 0 0 "[ . 1 . 2]" 1
1677 1 73 LEU MD2 1 74 LEU H . . 4.030 3.777 3.715 3.897 . 0 0 "[ . 1 . 2]" 1
1678 1 73 LEU HG 1 74 LEU H . . 5.460 5.409 5.360 5.455 . 0 0 "[ . 1 . 2]" 1
1679 1 74 LEU H 1 74 LEU HB2 . . 3.460 2.693 2.644 2.739 . 0 0 "[ . 1 . 2]" 1
1680 1 74 LEU H 1 74 LEU HB3 . . 3.620 3.594 3.579 3.618 . 0 0 "[ . 1 . 2]" 1
1681 1 74 LEU H 1 74 LEU MD1 . . 3.750 3.257 3.120 3.386 . 0 0 "[ . 1 . 2]" 1
1682 1 74 LEU H 1 74 LEU MD2 . . 3.740 3.310 3.215 3.422 . 0 0 "[ . 1 . 2]" 1
1683 1 74 LEU H 1 74 LEU HG . . 3.200 1.940 1.899 2.033 . 0 0 "[ . 1 . 2]" 1
1684 1 74 LEU HA 1 74 LEU MD1 . . 4.350 3.994 3.958 4.016 . 0 0 "[ . 1 . 2]" 1
1685 1 74 LEU HA 1 74 LEU MD2 . . 2.770 2.550 2.394 2.684 . 0 0 "[ . 1 . 2]" 1
1686 1 74 LEU HA 1 74 LEU HG . . 4.030 3.129 3.092 3.173 . 0 0 "[ . 1 . 2]" 1
1687 1 74 LEU HB2 1 74 LEU MD1 . . 2.880 2.230 2.073 2.294 . 0 0 "[ . 1 . 2]" 1
1688 1 74 LEU HB3 1 74 LEU MD1 . . 3.190 2.529 2.436 2.644 . 0 0 "[ . 1 . 2]" 1
1689 1 77 GLY QA 1 78 PRO QG . . 4.690 3.685 3.661 3.700 . 0 0 "[ . 1 . 2]" 1
1690 1 77 GLY HA2 1 78 PRO QD . . 3.080 2.184 2.005 2.629 . 0 0 "[ . 1 . 2]" 1
1691 1 77 GLY HA2 1 78 PRO QG . . 5.410 4.096 3.907 4.536 . 0 0 "[ . 1 . 2]" 1
1692 1 77 GLY HA3 1 78 PRO QD . . 3.080 2.448 1.969 2.717 . 0 0 "[ . 1 . 2]" 1
1693 1 77 GLY HA3 1 78 PRO QG . . 5.410 4.241 3.864 4.462 . 0 0 "[ . 1 . 2]" 1
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