NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
400133 |
1uju   |
10103 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1uju
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 2479
_Distance_constraint_stats_list.Viol_count 1981
_Distance_constraint_stats_list.Viol_total 782.742
_Distance_constraint_stats_list.Viol_max 0.308
_Distance_constraint_stats_list.Viol_rms 0.0060
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0008
_Distance_constraint_stats_list.Viol_average_violations_only 0.0198
_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 PRO 0.000 0.000 8 0 "[ . 1 . 2]"
1 9 GLY 0.000 0.000 8 0 "[ . 1 . 2]"
1 10 LEU 0.281 0.024 11 0 "[ . 1 . 2]"
1 11 ARG 0.139 0.024 11 0 "[ . 1 . 2]"
1 12 GLU 0.403 0.042 17 0 "[ . 1 . 2]"
1 13 LEU 0.277 0.042 17 0 "[ . 1 . 2]"
1 14 CYS 0.180 0.038 17 0 "[ . 1 . 2]"
1 15 ILE 3.347 0.119 1 0 "[ . 1 . 2]"
1 16 GLN 2.291 0.119 1 0 "[ . 1 . 2]"
1 17 LYS 1.169 0.076 7 0 "[ . 1 . 2]"
1 18 ALA 0.290 0.070 18 0 "[ . 1 . 2]"
1 19 PRO 0.006 0.006 7 0 "[ . 1 . 2]"
1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 GLU 0.357 0.030 19 0 "[ . 1 . 2]"
1 22 ARG 0.833 0.107 1 0 "[ . 1 . 2]"
1 23 LEU 1.811 0.271 16 0 "[ . 1 . 2]"
1 24 GLY 0.497 0.051 10 0 "[ . 1 . 2]"
1 25 ILE 1.032 0.051 10 0 "[ . 1 . 2]"
1 26 SER 1.296 0.084 17 0 "[ . 1 . 2]"
1 27 ILE 0.825 0.045 12 0 "[ . 1 . 2]"
1 28 ARG 1.294 0.065 18 0 "[ . 1 . 2]"
1 29 GLY 0.246 0.041 10 0 "[ . 1 . 2]"
1 30 GLY 1.704 0.101 10 0 "[ . 1 . 2]"
1 31 ALA 0.801 0.140 17 0 "[ . 1 . 2]"
1 32 ARG 0.916 0.140 17 0 "[ . 1 . 2]"
1 33 GLY 0.110 0.071 19 0 "[ . 1 . 2]"
1 34 HIS 0.053 0.038 2 0 "[ . 1 . 2]"
1 35 ALA 0.159 0.038 2 0 "[ . 1 . 2]"
1 36 GLY 0.071 0.036 15 0 "[ . 1 . 2]"
1 37 ASN 0.090 0.031 11 0 "[ . 1 . 2]"
1 38 PRO 0.043 0.031 11 0 "[ . 1 . 2]"
1 39 ARG 0.060 0.013 2 0 "[ . 1 . 2]"
1 40 ASP 0.206 0.039 3 0 "[ . 1 . 2]"
1 41 PRO 0.420 0.041 11 0 "[ . 1 . 2]"
1 42 THR 1.316 0.161 10 0 "[ . 1 . 2]"
1 43 ASP 0.303 0.096 11 0 "[ . 1 . 2]"
1 44 GLU 0.662 0.087 11 0 "[ . 1 . 2]"
1 45 GLY 0.790 0.052 6 0 "[ . 1 . 2]"
1 46 ILE 1.440 0.070 4 0 "[ . 1 . 2]"
1 47 PHE 2.589 0.070 4 0 "[ . 1 . 2]"
1 48 ILE 1.247 0.120 6 0 "[ . 1 . 2]"
1 49 SER 0.211 0.039 19 0 "[ . 1 . 2]"
1 50 LYS 2.667 0.084 17 0 "[ . 1 . 2]"
1 51 VAL 0.596 0.120 6 0 "[ . 1 . 2]"
1 52 SER 0.100 0.020 9 0 "[ . 1 . 2]"
1 53 PRO 0.036 0.027 6 0 "[ . 1 . 2]"
1 54 THR 0.087 0.027 6 0 "[ . 1 . 2]"
1 55 GLY 0.058 0.027 17 0 "[ . 1 . 2]"
1 56 ALA 0.583 0.049 15 0 "[ . 1 . 2]"
1 57 ALA 0.769 0.066 6 0 "[ . 1 . 2]"
1 58 GLY 0.352 0.063 12 0 "[ . 1 . 2]"
1 59 ARG 1.126 0.111 10 0 "[ . 1 . 2]"
1 60 ASP 0.085 0.025 6 0 "[ . 1 . 2]"
1 61 GLY 0.368 0.052 17 0 "[ . 1 . 2]"
1 62 ARG 0.128 0.037 17 0 "[ . 1 . 2]"
1 63 LEU 0.256 0.039 11 0 "[ . 1 . 2]"
1 64 ARG 0.608 0.065 19 0 "[ . 1 . 2]"
1 65 VAL 1.268 0.109 20 0 "[ . 1 . 2]"
1 66 GLY 0.307 0.109 20 0 "[ . 1 . 2]"
1 67 LEU 1.592 0.066 18 0 "[ . 1 . 2]"
1 68 ARG 1.473 0.060 3 0 "[ . 1 . 2]"
1 69 LEU 2.488 0.060 3 0 "[ . 1 . 2]"
1 70 LEU 0.099 0.016 7 0 "[ . 1 . 2]"
1 71 GLU 1.082 0.063 20 0 "[ . 1 . 2]"
1 72 VAL 1.586 0.067 17 0 "[ . 1 . 2]"
1 73 ASN 2.600 0.075 7 0 "[ . 1 . 2]"
1 74 GLN 3.128 0.075 7 0 "[ . 1 . 2]"
1 75 GLN 1.013 0.051 11 0 "[ . 1 . 2]"
1 76 SER 1.057 0.051 11 0 "[ . 1 . 2]"
1 77 LEU 0.091 0.060 20 0 "[ . 1 . 2]"
1 78 LEU 1.079 0.308 14 0 "[ . 1 . 2]"
1 79 GLY 0.311 0.099 13 0 "[ . 1 . 2]"
1 80 LEU 1.083 0.198 20 0 "[ . 1 . 2]"
1 81 THR 1.130 0.101 10 0 "[ . 1 . 2]"
1 82 HIS 0.848 0.034 7 0 "[ . 1 . 2]"
1 83 GLY 0.555 0.034 7 0 "[ . 1 . 2]"
1 84 GLU 0.677 0.030 18 0 "[ . 1 . 2]"
1 85 ALA 0.103 0.014 1 0 "[ . 1 . 2]"
1 86 VAL 0.120 0.015 12 0 "[ . 1 . 2]"
1 87 GLN 0.902 0.092 8 0 "[ . 1 . 2]"
1 88 LEU 0.399 0.038 20 0 "[ . 1 . 2]"
1 89 LEU 0.255 0.052 12 0 "[ . 1 . 2]"
1 90 ARG 0.971 0.092 8 0 "[ . 1 . 2]"
1 91 SER 0.855 0.101 20 0 "[ . 1 . 2]"
1 92 VAL 1.360 0.101 20 0 "[ . 1 . 2]"
1 93 GLY 0.218 0.046 20 0 "[ . 1 . 2]"
1 94 ASP 0.338 0.076 7 0 "[ . 1 . 2]"
1 95 THR 0.587 0.064 17 0 "[ . 1 . 2]"
1 96 LEU 0.898 0.067 17 0 "[ . 1 . 2]"
1 97 THR 0.916 0.033 4 0 "[ . 1 . 2]"
1 98 VAL 1.955 0.043 1 0 "[ . 1 . 2]"
1 99 LEU 0.699 0.039 17 0 "[ . 1 . 2]"
1 100 VAL 0.450 0.044 8 0 "[ . 1 . 2]"
1 101 CYS 0.403 0.048 7 0 "[ . 1 . 2]"
1 102 ASP 0.265 0.031 19 0 "[ . 1 . 2]"
1 103 GLY 0.114 0.024 13 0 "[ . 1 . 2]"
1 104 PHE 0.434 0.055 15 0 "[ . 1 . 2]"
1 105 GLU 0.101 0.059 20 0 "[ . 1 . 2]"
1 106 SER 0.059 0.059 20 0 "[ . 1 . 2]"
1 107 GLY 0.067 0.061 14 0 "[ . 1 . 2]"
1 108 PRO 0.061 0.061 14 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 PRO HA 1 9 GLY H . . 2.790 2.342 2.170 2.676 . 0 0 "[ . 1 . 2]" 1
2 1 8 PRO HA 1 9 GLY QA . . 4.540 3.938 3.899 4.014 . 0 0 "[ . 1 . 2]" 1
3 1 8 PRO HA 1 10 LEU H . . 4.180 3.976 3.656 4.146 . 0 0 "[ . 1 . 2]" 1
4 1 8 PRO QB 1 9 GLY H . . 3.430 2.715 1.984 3.223 . 0 0 "[ . 1 . 2]" 1
5 1 8 PRO QB 1 10 LEU H . . 5.340 4.299 3.224 5.157 . 0 0 "[ . 1 . 2]" 1
6 1 8 PRO HB2 1 9 GLY H . . 3.930 2.823 2.004 3.423 . 0 0 "[ . 1 . 2]" 1
7 1 8 PRO HB3 1 9 GLY H . . 3.930 3.580 3.185 3.930 0.000 8 0 "[ . 1 . 2]" 1
8 1 8 PRO QD 1 9 GLY H . . 5.180 4.964 4.763 5.011 . 0 0 "[ . 1 . 2]" 1
9 1 9 GLY H 1 10 LEU H . . 3.300 2.097 1.847 2.548 . 0 0 "[ . 1 . 2]" 1
10 1 9 GLY H 1 10 LEU QB . . 5.020 4.572 3.830 4.929 . 0 0 "[ . 1 . 2]" 1
11 1 9 GLY H 1 10 LEU MD1 . . 4.470 2.911 2.185 3.606 . 0 0 "[ . 1 . 2]" 1
12 1 9 GLY H 1 10 LEU MD2 . . 4.930 2.731 2.462 3.450 . 0 0 "[ . 1 . 2]" 1
13 1 9 GLY H 1 11 ARG QG . . 5.330 3.174 2.325 5.057 . 0 0 "[ . 1 . 2]" 1
14 1 9 GLY QA 1 10 LEU MD1 . . 4.210 3.427 3.192 3.733 . 0 0 "[ . 1 . 2]" 1
15 1 9 GLY QA 1 102 ASP H . . 4.240 2.664 2.198 3.076 . 0 0 "[ . 1 . 2]" 1
16 1 9 GLY HA2 1 102 ASP H . . 4.910 3.658 3.219 4.442 . 0 0 "[ . 1 . 2]" 1
17 1 9 GLY HA3 1 102 ASP H . . 4.910 2.749 2.229 3.139 . 0 0 "[ . 1 . 2]" 1
18 1 10 LEU H 1 10 LEU QB . . 2.850 2.778 2.742 2.858 0.008 1 0 "[ . 1 . 2]" 1
19 1 10 LEU H 1 10 LEU MD1 . . 4.140 1.878 1.818 1.930 . 0 0 "[ . 1 . 2]" 1
20 1 10 LEU H 1 10 LEU MD2 . . 3.580 1.895 1.876 1.936 . 0 0 "[ . 1 . 2]" 1
21 1 10 LEU H 1 10 LEU HG . . 3.950 3.603 3.568 3.653 . 0 0 "[ . 1 . 2]" 1
22 1 10 LEU H 1 11 ARG H . . 4.260 2.953 2.751 3.220 . 0 0 "[ . 1 . 2]" 1
23 1 10 LEU H 1 11 ARG QG . . 4.270 3.606 3.031 3.812 . 0 0 "[ . 1 . 2]" 1
24 1 10 LEU H 1 99 LEU MD1 . . 5.500 5.501 5.449 5.519 0.019 6 0 "[ . 1 . 2]" 1
25 1 10 LEU H 1 101 CYS HA . . 4.780 4.661 4.451 4.784 0.004 13 0 "[ . 1 . 2]" 1
26 1 10 LEU H 1 101 CYS HB2 . . 4.850 3.146 2.954 3.360 . 0 0 "[ . 1 . 2]" 1
27 1 10 LEU H 1 101 CYS HB3 . . 4.850 3.895 3.601 4.218 . 0 0 "[ . 1 . 2]" 1
28 1 10 LEU QB 1 10 LEU MD2 . . 3.020 2.487 2.458 2.514 . 0 0 "[ . 1 . 2]" 1
29 1 10 LEU QB 1 11 ARG H . . 4.180 3.993 3.948 4.012 . 0 0 "[ . 1 . 2]" 1
30 1 10 LEU QB 1 101 CYS HB2 . . 4.910 3.130 2.619 3.430 . 0 0 "[ . 1 . 2]" 1
31 1 10 LEU QB 1 101 CYS QB . . 4.300 2.742 2.346 3.037 . 0 0 "[ . 1 . 2]" 1
32 1 10 LEU QB 1 101 CYS HB3 . . 4.910 3.037 2.620 3.389 . 0 0 "[ . 1 . 2]" 1
33 1 10 LEU MD1 1 101 CYS QB . . 3.890 3.049 2.833 3.198 . 0 0 "[ . 1 . 2]" 1
34 1 10 LEU MD2 1 11 ARG H . . 3.210 2.767 2.398 3.025 . 0 0 "[ . 1 . 2]" 1
35 1 10 LEU MD2 1 11 ARG QB . . 3.720 3.670 3.494 3.735 0.015 8 0 "[ . 1 . 2]" 1
36 1 10 LEU MD2 1 11 ARG QD . . 3.890 3.267 2.475 3.891 0.001 10 0 "[ . 1 . 2]" 1
37 1 10 LEU MD2 1 11 ARG HE . . 5.370 4.547 1.885 5.211 . 0 0 "[ . 1 . 2]" 1
38 1 10 LEU MD2 1 11 ARG HG2 . . 3.680 2.671 2.051 3.417 . 0 0 "[ . 1 . 2]" 1
39 1 10 LEU MD2 1 11 ARG HG3 . . 3.680 2.975 2.241 3.704 0.024 11 0 "[ . 1 . 2]" 1
40 1 10 LEU MD2 1 101 CYS HB2 . . 4.850 4.537 4.358 4.714 . 0 0 "[ . 1 . 2]" 1
41 1 10 LEU MD2 1 101 CYS QB . . 4.130 4.127 4.033 4.149 0.019 17 0 "[ . 1 . 2]" 1
42 1 10 LEU MD2 1 101 CYS HB3 . . 4.850 4.752 4.598 4.850 . 0 0 "[ . 1 . 2]" 1
43 1 10 LEU HG 1 101 CYS QB . . 5.200 4.933 4.578 5.175 . 0 0 "[ . 1 . 2]" 1
44 1 11 ARG H 1 11 ARG HB2 . . 4.080 2.435 2.329 2.667 . 0 0 "[ . 1 . 2]" 1
45 1 11 ARG H 1 11 ARG HB3 . . 4.080 3.639 3.586 3.722 . 0 0 "[ . 1 . 2]" 1
46 1 11 ARG H 1 11 ARG HD2 . . 5.060 4.600 4.207 5.023 . 0 0 "[ . 1 . 2]" 1
47 1 11 ARG H 1 11 ARG QD . . 4.290 4.088 3.920 4.309 0.019 8 0 "[ . 1 . 2]" 1
48 1 11 ARG H 1 11 ARG HD3 . . 5.060 4.668 4.315 5.031 . 0 0 "[ . 1 . 2]" 1
49 1 11 ARG H 1 11 ARG HG2 . . 4.130 3.355 2.262 4.130 . 0 0 "[ . 1 . 2]" 1
50 1 11 ARG H 1 11 ARG QG . . 3.480 2.729 2.233 2.973 . 0 0 "[ . 1 . 2]" 1
51 1 11 ARG H 1 11 ARG HG3 . . 4.130 3.335 2.407 4.106 . 0 0 "[ . 1 . 2]" 1
52 1 11 ARG H 1 12 GLU H . . 4.590 4.546 4.483 4.593 0.003 7 0 "[ . 1 . 2]" 1
53 1 11 ARG H 1 99 LEU HA . . 5.500 5.312 5.145 5.503 0.003 13 0 "[ . 1 . 2]" 1
54 1 11 ARG H 1 99 LEU MD1 . . 4.010 3.713 3.468 3.884 . 0 0 "[ . 1 . 2]" 1
55 1 11 ARG H 1 99 LEU HG . . 5.500 5.411 4.987 5.508 0.008 8 0 "[ . 1 . 2]" 1
56 1 11 ARG H 1 101 CYS HA . . 5.160 4.822 4.434 5.170 0.010 6 0 "[ . 1 . 2]" 1
57 1 11 ARG H 1 101 CYS HB2 . . 4.910 4.551 4.297 4.801 . 0 0 "[ . 1 . 2]" 1
58 1 11 ARG H 1 101 CYS HB3 . . 4.910 4.365 3.794 4.705 . 0 0 "[ . 1 . 2]" 1
59 1 11 ARG HA 1 11 ARG HD2 . . 4.930 3.583 1.988 4.827 . 0 0 "[ . 1 . 2]" 1
60 1 11 ARG HA 1 11 ARG QD . . 4.250 3.178 1.977 4.170 . 0 0 "[ . 1 . 2]" 1
61 1 11 ARG HA 1 11 ARG HD3 . . 4.930 3.917 2.470 4.913 . 0 0 "[ . 1 . 2]" 1
62 1 11 ARG HA 1 11 ARG HG2 . . 4.140 2.690 2.453 2.974 . 0 0 "[ . 1 . 2]" 1
63 1 11 ARG HA 1 11 ARG QG . . 3.620 2.577 2.332 2.875 . 0 0 "[ . 1 . 2]" 1
64 1 11 ARG HA 1 11 ARG HG3 . . 4.140 3.350 2.806 3.895 . 0 0 "[ . 1 . 2]" 1
65 1 11 ARG HA 1 12 GLU H . . 2.680 2.377 2.221 2.566 . 0 0 "[ . 1 . 2]" 1
66 1 11 ARG HA 1 12 GLU HA . . 4.950 4.311 4.303 4.324 . 0 0 "[ . 1 . 2]" 1
67 1 11 ARG HA 1 12 GLU HB2 . . 4.760 4.453 4.351 4.523 . 0 0 "[ . 1 . 2]" 1
68 1 11 ARG HA 1 99 LEU MD1 . . 4.080 2.986 2.775 3.179 . 0 0 "[ . 1 . 2]" 1
69 1 11 ARG QB 1 11 ARG QD . . 3.150 2.288 2.102 2.574 . 0 0 "[ . 1 . 2]" 1
70 1 11 ARG QB 1 12 GLU H . . 3.250 2.481 2.067 2.876 . 0 0 "[ . 1 . 2]" 1
71 1 11 ARG QB 1 99 LEU MD1 . . 5.030 4.047 3.891 4.238 . 0 0 "[ . 1 . 2]" 1
72 1 11 ARG HB2 1 12 GLU H . . 4.040 3.736 3.241 4.040 . 0 0 "[ . 1 . 2]" 1
73 1 11 ARG HB3 1 12 GLU H . . 4.040 2.520 2.085 2.946 . 0 0 "[ . 1 . 2]" 1
74 1 11 ARG QG 1 12 GLU H . . 4.340 3.989 3.552 4.337 . 0 0 "[ . 1 . 2]" 1
75 1 11 ARG HG2 1 12 GLU H . . 4.930 4.305 3.694 4.834 . 0 0 "[ . 1 . 2]" 1
76 1 11 ARG HG3 1 12 GLU H . . 4.930 4.796 4.535 4.937 0.007 11 0 "[ . 1 . 2]" 1
77 1 12 GLU H 1 12 GLU HB2 . . 3.750 2.442 2.294 2.621 . 0 0 "[ . 1 . 2]" 1
78 1 12 GLU H 1 12 GLU HB3 . . 3.160 2.643 2.524 2.780 . 0 0 "[ . 1 . 2]" 1
79 1 12 GLU H 1 12 GLU HG2 . . 4.730 4.504 4.433 4.582 . 0 0 "[ . 1 . 2]" 1
80 1 12 GLU H 1 12 GLU HG3 . . 4.570 4.397 4.259 4.541 . 0 0 "[ . 1 . 2]" 1
81 1 12 GLU H 1 13 LEU H . . 4.630 4.400 4.359 4.449 . 0 0 "[ . 1 . 2]" 1
82 1 12 GLU H 1 99 LEU MD1 . . 3.680 3.047 2.613 3.234 . 0 0 "[ . 1 . 2]" 1
83 1 12 GLU HA 1 12 GLU HG2 . . 3.930 2.960 2.874 3.081 . 0 0 "[ . 1 . 2]" 1
84 1 12 GLU HA 1 12 GLU HG3 . . 3.780 2.521 2.311 2.706 . 0 0 "[ . 1 . 2]" 1
85 1 12 GLU HA 1 13 LEU H . . 2.870 2.147 2.140 2.159 . 0 0 "[ . 1 . 2]" 1
86 1 12 GLU HA 1 13 LEU HA . . 5.350 4.396 4.392 4.402 . 0 0 "[ . 1 . 2]" 1
87 1 12 GLU HA 1 13 LEU QD . . 4.890 4.478 3.290 4.812 . 0 0 "[ . 1 . 2]" 1
88 1 12 GLU HA 1 13 LEU HG . . 4.930 4.586 4.147 4.842 . 0 0 "[ . 1 . 2]" 1
89 1 12 GLU HA 1 99 LEU HB2 . . 4.670 3.748 3.423 3.866 . 0 0 "[ . 1 . 2]" 1
90 1 12 GLU HA 1 99 LEU MD1 . . 2.940 1.935 1.795 1.964 . 0 0 "[ . 1 . 2]" 1
91 1 12 GLU HB2 1 13 LEU H . . 4.570 4.457 4.402 4.521 . 0 0 "[ . 1 . 2]" 1
92 1 12 GLU HB2 1 97 THR MG . . 4.250 4.026 3.912 4.157 . 0 0 "[ . 1 . 2]" 1
93 1 12 GLU HB2 1 99 LEU MD1 . . 3.160 2.952 2.557 3.119 . 0 0 "[ . 1 . 2]" 1
94 1 12 GLU HB3 1 13 LEU HA . . 5.130 4.727 4.642 4.808 . 0 0 "[ . 1 . 2]" 1
95 1 12 GLU HB3 1 97 THR MG . . 4.640 3.878 3.742 4.009 . 0 0 "[ . 1 . 2]" 1
96 1 12 GLU HB3 1 99 LEU MD1 . . 4.340 4.054 3.709 4.187 . 0 0 "[ . 1 . 2]" 1
97 1 12 GLU HG2 1 13 LEU H . . 3.760 3.434 3.241 3.745 . 0 0 "[ . 1 . 2]" 1
98 1 12 GLU HG2 1 13 LEU HA . . 5.090 4.241 4.007 4.641 . 0 0 "[ . 1 . 2]" 1
99 1 12 GLU HG2 1 97 THR HB . . 4.760 4.426 4.341 4.586 . 0 0 "[ . 1 . 2]" 1
100 1 12 GLU HG2 1 97 THR MG . . 3.320 1.942 1.888 2.049 . 0 0 "[ . 1 . 2]" 1
101 1 12 GLU HG2 1 99 LEU HB2 . . 5.500 5.462 5.065 5.539 0.039 17 0 "[ . 1 . 2]" 1
102 1 12 GLU HG2 1 99 LEU MD1 . . 4.290 4.211 3.960 4.311 0.021 11 0 "[ . 1 . 2]" 1
103 1 12 GLU HG3 1 13 LEU H . . 4.180 3.729 3.562 3.875 . 0 0 "[ . 1 . 2]" 1
104 1 12 GLU HG3 1 13 LEU HA . . 5.500 5.502 5.450 5.542 0.042 17 0 "[ . 1 . 2]" 1
105 1 12 GLU HG3 1 74 GLN H . . 5.500 5.468 5.223 5.515 0.015 6 0 "[ . 1 . 2]" 1
106 1 12 GLU HG3 1 97 THR HA . . 5.500 5.106 4.944 5.292 . 0 0 "[ . 1 . 2]" 1
107 1 12 GLU HG3 1 97 THR HB . . 4.640 4.230 4.070 4.462 . 0 0 "[ . 1 . 2]" 1
108 1 12 GLU HG3 1 97 THR MG . . 3.230 2.070 1.946 2.218 . 0 0 "[ . 1 . 2]" 1
109 1 12 GLU HG3 1 99 LEU HA . . 5.400 4.462 4.057 4.802 . 0 0 "[ . 1 . 2]" 1
110 1 12 GLU HG3 1 99 LEU HB2 . . 5.340 4.056 3.531 4.290 . 0 0 "[ . 1 . 2]" 1
111 1 12 GLU HG3 1 99 LEU MD1 . . 3.750 3.164 2.813 3.499 . 0 0 "[ . 1 . 2]" 1
112 1 13 LEU H 1 13 LEU HB2 . . 3.870 2.431 2.290 2.568 . 0 0 "[ . 1 . 2]" 1
113 1 13 LEU H 1 13 LEU QB . . 3.270 2.396 2.262 2.526 . 0 0 "[ . 1 . 2]" 1
114 1 13 LEU H 1 13 LEU HB3 . . 3.870 3.632 3.515 3.733 . 0 0 "[ . 1 . 2]" 1
115 1 13 LEU H 1 13 LEU MD1 . . 4.560 3.636 2.279 4.075 . 0 0 "[ . 1 . 2]" 1
116 1 13 LEU H 1 13 LEU QD . . 3.870 3.385 2.271 3.676 . 0 0 "[ . 1 . 2]" 1
117 1 13 LEU H 1 13 LEU MD2 . . 4.560 4.257 3.968 4.392 . 0 0 "[ . 1 . 2]" 1
118 1 13 LEU H 1 13 LEU HG . . 3.620 3.392 2.997 3.623 0.003 16 0 "[ . 1 . 2]" 1
119 1 13 LEU H 1 14 CYS H . . 4.560 4.499 4.429 4.526 . 0 0 "[ . 1 . 2]" 1
120 1 13 LEU H 1 97 THR HA . . 5.030 4.739 4.615 4.899 . 0 0 "[ . 1 . 2]" 1
121 1 13 LEU H 1 97 THR MG . . 4.130 3.399 3.069 3.633 . 0 0 "[ . 1 . 2]" 1
122 1 13 LEU H 1 99 LEU H . . 5.370 4.734 4.501 4.857 . 0 0 "[ . 1 . 2]" 1
123 1 13 LEU H 1 99 LEU MD1 . . 3.400 3.329 3.146 3.409 0.009 12 0 "[ . 1 . 2]" 1
124 1 13 LEU HA 1 13 LEU MD1 . . 4.180 3.777 3.399 3.912 . 0 0 "[ . 1 . 2]" 1
125 1 13 LEU HA 1 13 LEU QD . . 3.180 2.352 2.052 3.082 . 0 0 "[ . 1 . 2]" 1
126 1 13 LEU HA 1 13 LEU MD2 . . 4.180 2.430 2.060 3.524 . 0 0 "[ . 1 . 2]" 1
127 1 13 LEU HA 1 13 LEU HG . . 4.180 2.676 2.453 2.978 . 0 0 "[ . 1 . 2]" 1
128 1 13 LEU HA 1 14 CYS H . . 2.750 2.419 2.324 2.653 . 0 0 "[ . 1 . 2]" 1
129 1 13 LEU HA 1 14 CYS QB . . 4.640 4.278 3.778 4.587 . 0 0 "[ . 1 . 2]" 1
130 1 13 LEU HA 1 98 VAL H . . 5.120 5.088 5.002 5.136 0.016 17 0 "[ . 1 . 2]" 1
131 1 13 LEU QB 1 14 CYS H . . 3.340 2.379 1.895 2.562 . 0 0 "[ . 1 . 2]" 1
132 1 13 LEU QB 1 97 THR MG . . 4.690 4.490 4.115 4.605 . 0 0 "[ . 1 . 2]" 1
133 1 13 LEU QB 1 98 VAL H . . 3.950 3.810 3.505 3.953 0.003 19 0 "[ . 1 . 2]" 1
134 1 13 LEU QB 1 98 VAL MG2 . . 3.020 2.339 2.106 2.463 . 0 0 "[ . 1 . 2]" 1
135 1 13 LEU HB2 1 14 CYS H . . 3.870 3.745 3.382 3.875 0.005 10 0 "[ . 1 . 2]" 1
136 1 13 LEU HB2 1 97 THR MG . . 5.500 4.898 4.426 5.068 . 0 0 "[ . 1 . 2]" 1
137 1 13 LEU HB2 1 98 VAL MG2 . . 3.660 2.464 2.213 2.625 . 0 0 "[ . 1 . 2]" 1
138 1 13 LEU HB3 1 14 CYS H . . 3.870 2.407 1.905 2.606 . 0 0 "[ . 1 . 2]" 1
139 1 13 LEU HB3 1 97 THR MG . . 5.500 5.220 4.891 5.341 . 0 0 "[ . 1 . 2]" 1
140 1 13 LEU HB3 1 98 VAL MG2 . . 3.660 2.958 2.471 3.410 . 0 0 "[ . 1 . 2]" 1
141 1 13 LEU QD 1 14 CYS H . . 3.640 2.861 2.298 3.651 0.011 9 0 "[ . 1 . 2]" 1
142 1 13 LEU QD 1 62 ARG HA . . 4.880 4.529 3.852 4.887 0.007 11 0 "[ . 1 . 2]" 1
143 1 13 LEU QD 1 62 ARG HB2 . . 3.770 3.179 2.484 3.633 . 0 0 "[ . 1 . 2]" 1
144 1 13 LEU QD 1 62 ARG HB3 . . 4.110 2.737 1.966 3.099 . 0 0 "[ . 1 . 2]" 1
145 1 13 LEU QD 1 62 ARG QD . . 3.160 2.776 1.907 3.120 . 0 0 "[ . 1 . 2]" 1
146 1 13 LEU QD 1 62 ARG HE . . 5.120 4.782 3.574 5.126 0.006 15 0 "[ . 1 . 2]" 1
147 1 13 LEU MD1 1 14 CYS H . . 4.760 4.494 3.938 4.752 . 0 0 "[ . 1 . 2]" 1
148 1 13 LEU MD2 1 14 CYS H . . 4.760 2.906 2.307 3.795 . 0 0 "[ . 1 . 2]" 1
149 1 13 LEU HG 1 14 CYS H . . 5.500 4.450 4.184 4.784 . 0 0 "[ . 1 . 2]" 1
150 1 14 CYS H 1 14 CYS QB . . 3.360 3.098 2.765 3.271 . 0 0 "[ . 1 . 2]" 1
151 1 14 CYS H 1 15 ILE H . . 4.560 4.389 4.309 4.428 . 0 0 "[ . 1 . 2]" 1
152 1 14 CYS H 1 97 THR HA . . 4.790 4.583 4.479 4.698 . 0 0 "[ . 1 . 2]" 1
153 1 14 CYS H 1 97 THR MG . . 4.730 4.489 4.309 4.604 . 0 0 "[ . 1 . 2]" 1
154 1 14 CYS H 1 98 VAL H . . 5.230 4.491 4.183 4.695 . 0 0 "[ . 1 . 2]" 1
155 1 14 CYS H 1 98 VAL MG2 . . 4.910 4.045 3.696 4.326 . 0 0 "[ . 1 . 2]" 1
156 1 14 CYS HA 1 15 ILE H . . 2.940 2.326 2.232 2.423 . 0 0 "[ . 1 . 2]" 1
157 1 14 CYS HA 1 15 ILE HA . . 4.910 4.416 4.391 4.447 . 0 0 "[ . 1 . 2]" 1
158 1 14 CYS HA 1 15 ILE HB . . 4.640 4.588 4.471 4.678 0.038 17 0 "[ . 1 . 2]" 1
159 1 14 CYS HA 1 15 ILE QG . . 4.650 3.432 3.281 3.606 . 0 0 "[ . 1 . 2]" 1
160 1 14 CYS HA 1 15 ILE MG . . 5.500 5.440 5.417 5.449 . 0 0 "[ . 1 . 2]" 1
161 1 14 CYS HA 1 95 THR MG . . 4.910 3.936 3.682 4.160 . 0 0 "[ . 1 . 2]" 1
162 1 14 CYS HA 1 96 LEU H . . 4.710 4.378 4.260 4.520 . 0 0 "[ . 1 . 2]" 1
163 1 14 CYS HA 1 97 THR H . . 4.890 4.635 4.564 4.702 . 0 0 "[ . 1 . 2]" 1
164 1 14 CYS HA 1 97 THR HA . . 3.330 2.307 2.106 2.408 . 0 0 "[ . 1 . 2]" 1
165 1 14 CYS HA 1 97 THR HB . . 5.500 5.305 5.110 5.403 . 0 0 "[ . 1 . 2]" 1
166 1 14 CYS HA 1 97 THR MG . . 3.600 3.580 3.494 3.609 0.009 7 0 "[ . 1 . 2]" 1
167 1 14 CYS HA 1 98 VAL H . . 4.180 2.538 2.355 2.771 . 0 0 "[ . 1 . 2]" 1
168 1 14 CYS HA 1 98 VAL MG1 . . 5.240 3.646 3.399 3.821 . 0 0 "[ . 1 . 2]" 1
169 1 14 CYS HA 1 98 VAL MG2 . . 5.500 3.449 3.234 3.708 . 0 0 "[ . 1 . 2]" 1
170 1 14 CYS QB 1 15 ILE H . . 3.900 2.664 2.359 3.503 . 0 0 "[ . 1 . 2]" 1
171 1 14 CYS QB 1 95 THR MG . . 4.240 2.359 2.036 3.418 . 0 0 "[ . 1 . 2]" 1
172 1 14 CYS QB 1 97 THR H . . 5.500 4.690 4.368 5.533 0.033 4 0 "[ . 1 . 2]" 1
173 1 14 CYS QB 1 97 THR HA . . 4.370 2.710 2.345 3.298 . 0 0 "[ . 1 . 2]" 1
174 1 14 CYS QB 1 97 THR HB . . 5.500 4.910 4.559 5.348 . 0 0 "[ . 1 . 2]" 1
175 1 14 CYS QB 1 97 THR MG . . 3.680 2.949 2.645 3.640 . 0 0 "[ . 1 . 2]" 1
176 1 14 CYS QB 1 98 VAL H . . 4.850 4.063 3.769 4.445 . 0 0 "[ . 1 . 2]" 1
177 1 15 ILE H 1 15 ILE HB . . 3.280 2.663 2.577 2.762 . 0 0 "[ . 1 . 2]" 1
178 1 15 ILE H 1 15 ILE MD . . 4.340 4.104 3.946 4.253 . 0 0 "[ . 1 . 2]" 1
179 1 15 ILE H 1 15 ILE HG12 . . 4.370 3.926 3.714 4.241 . 0 0 "[ . 1 . 2]" 1
180 1 15 ILE H 1 15 ILE QG . . 3.570 2.807 2.698 2.986 . 0 0 "[ . 1 . 2]" 1
181 1 15 ILE H 1 15 ILE HG13 . . 4.370 2.876 2.767 3.051 . 0 0 "[ . 1 . 2]" 1
182 1 15 ILE H 1 15 ILE MG . . 4.000 3.851 3.784 3.902 . 0 0 "[ . 1 . 2]" 1
183 1 15 ILE H 1 16 GLN H . . 4.320 4.164 4.004 4.344 0.024 4 0 "[ . 1 . 2]" 1
184 1 15 ILE H 1 95 THR HA . . 4.720 4.124 3.961 4.364 . 0 0 "[ . 1 . 2]" 1
185 1 15 ILE H 1 95 THR HB . . 5.500 5.453 5.315 5.564 0.064 17 0 "[ . 1 . 2]" 1
186 1 15 ILE H 1 95 THR MG . . 3.820 2.734 2.457 2.923 . 0 0 "[ . 1 . 2]" 1
187 1 15 ILE H 1 96 LEU H . . 3.670 2.693 2.571 2.883 . 0 0 "[ . 1 . 2]" 1
188 1 15 ILE H 1 96 LEU HB2 . . 5.500 5.398 5.273 5.532 0.032 17 0 "[ . 1 . 2]" 1
189 1 15 ILE H 1 96 LEU HB3 . . 5.060 4.776 4.620 4.948 . 0 0 "[ . 1 . 2]" 1
190 1 15 ILE H 1 96 LEU MD1 . . 5.090 4.800 4.647 5.118 0.028 17 0 "[ . 1 . 2]" 1
191 1 15 ILE H 1 96 LEU MD2 . . 4.910 2.104 1.885 2.587 . 0 0 "[ . 1 . 2]" 1
192 1 15 ILE H 1 96 LEU HG . . 4.430 3.823 3.620 3.995 . 0 0 "[ . 1 . 2]" 1
193 1 15 ILE H 1 97 THR H . . 5.230 5.189 5.094 5.242 0.012 10 0 "[ . 1 . 2]" 1
194 1 15 ILE H 1 97 THR HA . . 4.140 4.020 3.791 4.115 . 0 0 "[ . 1 . 2]" 1
195 1 15 ILE H 1 97 THR MG . . 5.390 5.364 5.239 5.407 0.017 20 0 "[ . 1 . 2]" 1
196 1 15 ILE H 1 98 VAL H . . 4.470 4.236 4.071 4.347 . 0 0 "[ . 1 . 2]" 1
197 1 15 ILE H 1 98 VAL MG1 . . 4.290 3.997 3.891 4.137 . 0 0 "[ . 1 . 2]" 1
198 1 15 ILE HA 1 15 ILE MD . . 4.040 3.803 3.753 3.853 . 0 0 "[ . 1 . 2]" 1
199 1 15 ILE HA 1 15 ILE HG12 . . 3.750 2.507 2.430 2.584 . 0 0 "[ . 1 . 2]" 1
200 1 15 ILE HA 1 15 ILE HG13 . . 3.750 3.061 2.762 3.225 . 0 0 "[ . 1 . 2]" 1
201 1 15 ILE HA 1 15 ILE MG . . 3.170 2.444 2.385 2.491 . 0 0 "[ . 1 . 2]" 1
202 1 15 ILE HA 1 16 GLN H . . 2.740 2.153 2.140 2.209 . 0 0 "[ . 1 . 2]" 1
203 1 15 ILE HA 1 16 GLN HA . . 4.640 4.409 4.380 4.468 . 0 0 "[ . 1 . 2]" 1
204 1 15 ILE HA 1 16 GLN HB2 . . 4.370 4.295 4.250 4.319 . 0 0 "[ . 1 . 2]" 1
205 1 15 ILE HA 1 16 GLN HB3 . . 5.500 5.601 5.583 5.619 0.119 1 0 "[ . 1 . 2]" 1
206 1 15 ILE HA 1 16 GLN QG . . 5.100 4.825 4.559 5.134 0.034 1 0 "[ . 1 . 2]" 1
207 1 15 ILE HA 1 23 LEU QD . . 5.440 4.745 4.506 5.095 . 0 0 "[ . 1 . 2]" 1
208 1 15 ILE HA 1 96 LEU H . . 5.240 5.002 4.880 5.115 . 0 0 "[ . 1 . 2]" 1
209 1 15 ILE HB 1 15 ILE MD . . 3.300 2.479 2.358 2.548 . 0 0 "[ . 1 . 2]" 1
210 1 15 ILE HB 1 16 GLN H . . 4.500 4.336 4.149 4.450 . 0 0 "[ . 1 . 2]" 1
211 1 15 ILE HB 1 96 LEU H . . 4.540 3.463 3.236 3.638 . 0 0 "[ . 1 . 2]" 1
212 1 15 ILE HB 1 96 LEU HG . . 4.550 4.409 4.265 4.553 0.003 20 0 "[ . 1 . 2]" 1
213 1 15 ILE HB 1 98 VAL MG1 . . 4.000 3.992 3.766 4.026 0.026 11 0 "[ . 1 . 2]" 1
214 1 15 ILE MD 1 16 GLN H . . 5.460 5.269 5.005 5.426 . 0 0 "[ . 1 . 2]" 1
215 1 15 ILE MD 1 56 ALA H . . 5.500 5.511 5.478 5.538 0.038 9 0 "[ . 1 . 2]" 1
216 1 15 ILE MD 1 57 ALA HA . . 3.260 2.484 2.017 2.696 . 0 0 "[ . 1 . 2]" 1
217 1 15 ILE MD 1 57 ALA MB . . 3.480 2.220 1.913 2.470 . 0 0 "[ . 1 . 2]" 1
218 1 15 ILE MD 1 60 ASP HB3 . . 4.370 3.795 3.117 4.244 . 0 0 "[ . 1 . 2]" 1
219 1 15 ILE MD 1 63 LEU H . . 4.370 4.074 3.663 4.370 0.000 13 0 "[ . 1 . 2]" 1
220 1 15 ILE MD 1 63 LEU HB2 . . 3.390 2.301 2.006 2.710 . 0 0 "[ . 1 . 2]" 1
221 1 15 ILE MD 1 98 VAL MG1 . . 2.890 2.684 2.454 2.899 0.009 18 0 "[ . 1 . 2]" 1
222 1 15 ILE MD 1 98 VAL MG2 . . 3.050 3.054 2.980 3.084 0.034 9 0 "[ . 1 . 2]" 1
223 1 15 ILE QG 1 15 ILE MG . . 3.120 2.286 2.220 2.350 . 0 0 "[ . 1 . 2]" 1
224 1 15 ILE QG 1 16 GLN H . . 4.490 4.241 4.143 4.330 . 0 0 "[ . 1 . 2]" 1
225 1 15 ILE QG 1 98 VAL MG1 . . 4.350 2.853 2.447 3.424 . 0 0 "[ . 1 . 2]" 1
226 1 15 ILE QG 1 98 VAL MG2 . . 4.650 3.032 2.670 3.247 . 0 0 "[ . 1 . 2]" 1
227 1 15 ILE HG12 1 16 GLN H . . 5.220 4.526 4.423 4.648 . 0 0 "[ . 1 . 2]" 1
228 1 15 ILE HG13 1 16 GLN H . . 5.220 5.126 4.885 5.224 0.004 17 0 "[ . 1 . 2]" 1
229 1 15 ILE MG 1 16 GLN H . . 3.250 2.909 2.503 3.197 . 0 0 "[ . 1 . 2]" 1
230 1 15 ILE MG 1 16 GLN HB2 . . 4.770 4.501 4.289 4.652 . 0 0 "[ . 1 . 2]" 1
231 1 15 ILE MG 1 16 GLN HB3 . . 5.410 5.075 4.913 5.184 . 0 0 "[ . 1 . 2]" 1
232 1 15 ILE MG 1 16 GLN QG . . 5.210 5.092 4.855 5.225 0.015 9 0 "[ . 1 . 2]" 1
233 1 15 ILE MG 1 17 LYS HA . . 4.540 4.199 3.960 4.379 . 0 0 "[ . 1 . 2]" 1
234 1 15 ILE MG 1 17 LYS HB2 . . 4.910 4.212 4.035 4.399 . 0 0 "[ . 1 . 2]" 1
235 1 15 ILE MG 1 17 LYS HB3 . . 4.930 3.001 2.739 3.223 . 0 0 "[ . 1 . 2]" 1
236 1 15 ILE MG 1 23 LEU QD . . 3.220 2.081 1.910 2.403 . 0 0 "[ . 1 . 2]" 1
237 1 15 ILE MG 1 56 ALA H . . 4.790 4.480 4.303 4.718 . 0 0 "[ . 1 . 2]" 1
238 1 15 ILE MG 1 56 ALA MB . . 2.990 1.893 1.752 2.056 . 0 0 "[ . 1 . 2]" 1
239 1 15 ILE MG 1 57 ALA H . . 3.780 3.467 3.266 3.700 . 0 0 "[ . 1 . 2]" 1
240 1 15 ILE MG 1 57 ALA HA . . 3.430 2.718 2.292 2.969 . 0 0 "[ . 1 . 2]" 1
241 1 15 ILE MG 1 60 ASP H . . 4.470 4.078 3.738 4.299 . 0 0 "[ . 1 . 2]" 1
242 1 15 ILE MG 1 60 ASP HA . . 4.760 4.195 3.728 4.569 . 0 0 "[ . 1 . 2]" 1
243 1 15 ILE MG 1 60 ASP HB2 . . 3.750 2.368 2.106 2.627 . 0 0 "[ . 1 . 2]" 1
244 1 15 ILE MG 1 60 ASP HB3 . . 3.930 3.663 3.548 3.837 . 0 0 "[ . 1 . 2]" 1
245 1 15 ILE MG 1 61 GLY H . . 5.500 5.455 5.299 5.533 0.033 9 0 "[ . 1 . 2]" 1
246 1 15 ILE MG 1 96 LEU H . . 4.640 4.534 4.418 4.654 0.014 9 0 "[ . 1 . 2]" 1
247 1 16 GLN H 1 16 GLN HB2 . . 3.260 2.195 2.159 2.250 . 0 0 "[ . 1 . 2]" 1
248 1 16 GLN H 1 16 GLN HB3 . . 3.700 3.479 3.465 3.510 . 0 0 "[ . 1 . 2]" 1
249 1 16 GLN H 1 16 GLN HE21 . . 5.370 4.019 2.955 5.308 . 0 0 "[ . 1 . 2]" 1
250 1 16 GLN H 1 16 GLN QE . . 4.660 3.757 2.922 4.580 . 0 0 "[ . 1 . 2]" 1
251 1 16 GLN H 1 16 GLN HE22 . . 5.370 4.888 4.607 5.189 . 0 0 "[ . 1 . 2]" 1
252 1 16 GLN H 1 16 GLN QG . . 3.620 3.306 3.051 3.652 0.032 5 0 "[ . 1 . 2]" 1
253 1 16 GLN H 1 60 ASP HB2 . . 5.500 5.035 4.672 5.358 . 0 0 "[ . 1 . 2]" 1
254 1 16 GLN H 1 95 THR MG . . 4.150 3.361 3.046 3.830 . 0 0 "[ . 1 . 2]" 1
255 1 16 GLN HB2 1 17 LYS H . . 4.860 4.506 4.406 4.583 . 0 0 "[ . 1 . 2]" 1
256 1 16 GLN HB2 1 95 THR MG . . 4.450 3.893 3.694 4.140 . 0 0 "[ . 1 . 2]" 1
257 1 16 GLN HB3 1 17 LYS H . . 4.090 3.643 3.396 3.871 . 0 0 "[ . 1 . 2]" 1
258 1 16 GLN HB3 1 95 THR MG . . 4.640 4.134 3.893 4.381 . 0 0 "[ . 1 . 2]" 1
259 1 16 GLN QE 1 95 THR MG . . 4.020 3.012 2.185 3.406 . 0 0 "[ . 1 . 2]" 1
260 1 16 GLN HE21 1 95 THR MG . . 4.670 3.100 2.229 3.512 . 0 0 "[ . 1 . 2]" 1
261 1 16 GLN HE22 1 95 THR MG . . 4.670 4.173 3.049 4.690 0.020 17 0 "[ . 1 . 2]" 1
262 1 16 GLN QG 1 17 LYS H . . 4.510 3.853 3.679 4.020 . 0 0 "[ . 1 . 2]" 1
263 1 16 GLN QG 1 95 THR HA . . 4.540 4.297 4.103 4.526 . 0 0 "[ . 1 . 2]" 1
264 1 16 GLN QG 1 95 THR HB . . 5.090 3.897 3.565 4.213 . 0 0 "[ . 1 . 2]" 1
265 1 16 GLN QG 1 95 THR MG . . 3.660 2.041 1.901 2.423 . 0 0 "[ . 1 . 2]" 1
266 1 16 GLN QG 1 96 LEU H . . 5.500 5.329 5.130 5.517 0.017 5 0 "[ . 1 . 2]" 1
267 1 17 LYS H 1 17 LYS HB2 . . 3.910 3.837 3.757 3.910 0.000 7 0 "[ . 1 . 2]" 1
268 1 17 LYS H 1 17 LYS HB3 . . 3.450 2.848 2.737 2.965 . 0 0 "[ . 1 . 2]" 1
269 1 17 LYS H 1 17 LYS HD2 . . 5.090 4.853 4.667 5.097 0.007 7 0 "[ . 1 . 2]" 1
270 1 17 LYS H 1 17 LYS HD3 . . 5.090 4.826 4.621 5.083 . 0 0 "[ . 1 . 2]" 1
271 1 17 LYS H 1 17 LYS QE . . 4.720 3.192 2.802 3.870 . 0 0 "[ . 1 . 2]" 1
272 1 17 LYS H 1 17 LYS HG2 . . 3.610 2.578 2.391 2.746 . 0 0 "[ . 1 . 2]" 1
273 1 17 LYS H 1 17 LYS HG3 . . 4.070 3.973 3.833 4.090 0.020 19 0 "[ . 1 . 2]" 1
274 1 17 LYS H 1 18 ALA H . . 4.670 4.456 4.416 4.497 . 0 0 "[ . 1 . 2]" 1
275 1 17 LYS H 1 23 LEU QD . . 5.440 5.132 4.879 5.321 . 0 0 "[ . 1 . 2]" 1
276 1 17 LYS H 1 56 ALA MB . . 4.300 4.165 3.820 4.335 0.035 6 0 "[ . 1 . 2]" 1
277 1 17 LYS H 1 94 ASP QB . . 4.170 3.883 3.531 4.246 0.076 7 0 "[ . 1 . 2]" 1
278 1 17 LYS H 1 95 THR H . . 5.020 4.834 4.703 4.981 . 0 0 "[ . 1 . 2]" 1
279 1 17 LYS H 1 95 THR HA . . 3.480 3.175 2.905 3.285 . 0 0 "[ . 1 . 2]" 1
280 1 17 LYS H 1 95 THR HB . . 5.410 5.062 4.794 5.340 . 0 0 "[ . 1 . 2]" 1
281 1 17 LYS H 1 95 THR MG . . 4.000 3.700 3.544 4.004 0.004 7 0 "[ . 1 . 2]" 1
282 1 17 LYS H 1 96 LEU H . . 5.130 5.061 4.763 5.159 0.029 18 0 "[ . 1 . 2]" 1
283 1 17 LYS HA 1 17 LYS HD3 . . 5.410 4.750 4.696 4.838 . 0 0 "[ . 1 . 2]" 1
284 1 17 LYS HA 1 17 LYS HG2 . . 4.130 3.652 3.618 3.690 . 0 0 "[ . 1 . 2]" 1
285 1 17 LYS HA 1 17 LYS HG3 . . 4.000 3.735 3.660 3.789 . 0 0 "[ . 1 . 2]" 1
286 1 17 LYS HA 1 18 ALA H . . 2.770 2.469 2.411 2.588 . 0 0 "[ . 1 . 2]" 1
287 1 17 LYS HA 1 18 ALA MB . . 4.250 4.191 4.154 4.231 . 0 0 "[ . 1 . 2]" 1
288 1 17 LYS HA 1 21 GLU HB3 . . 4.540 4.394 4.194 4.542 0.002 20 0 "[ . 1 . 2]" 1
289 1 17 LYS HA 1 56 ALA MB . . 3.560 3.232 2.906 3.398 . 0 0 "[ . 1 . 2]" 1
290 1 17 LYS HB2 1 17 LYS HD2 . . 4.010 3.786 3.720 3.876 . 0 0 "[ . 1 . 2]" 1
291 1 17 LYS HB2 1 17 LYS HD3 . . 3.800 2.703 2.597 2.813 . 0 0 "[ . 1 . 2]" 1
292 1 17 LYS HB2 1 17 LYS QE . . 3.890 3.466 3.236 3.956 0.066 2 0 "[ . 1 . 2]" 1
293 1 17 LYS HB2 1 18 ALA H . . 3.700 2.514 2.336 2.611 . 0 0 "[ . 1 . 2]" 1
294 1 17 LYS HB2 1 21 GLU H . . 4.780 4.626 4.457 4.783 0.003 2 0 "[ . 1 . 2]" 1
295 1 17 LYS HB2 1 21 GLU HB3 . . 4.640 2.745 2.568 2.928 . 0 0 "[ . 1 . 2]" 1
296 1 17 LYS HB2 1 21 GLU HG2 . . 5.090 3.661 3.248 3.830 . 0 0 "[ . 1 . 2]" 1
297 1 17 LYS HB2 1 21 GLU HG3 . . 5.090 3.618 3.124 3.969 . 0 0 "[ . 1 . 2]" 1
298 1 17 LYS HB2 1 23 LEU QD . . 4.720 4.200 4.062 4.456 . 0 0 "[ . 1 . 2]" 1
299 1 17 LYS HB2 1 56 ALA MB . . 3.480 2.063 1.957 2.273 . 0 0 "[ . 1 . 2]" 1
300 1 17 LYS HB3 1 17 LYS QE . . 4.240 2.202 1.972 2.908 . 0 0 "[ . 1 . 2]" 1
301 1 17 LYS HB3 1 18 ALA H . . 3.940 3.888 3.752 3.955 0.015 19 0 "[ . 1 . 2]" 1
302 1 17 LYS HB3 1 21 GLU HB3 . . 4.540 4.277 4.126 4.428 . 0 0 "[ . 1 . 2]" 1
303 1 17 LYS HB3 1 21 GLU HG2 . . 5.500 5.347 4.921 5.510 0.010 19 0 "[ . 1 . 2]" 1
304 1 17 LYS HB3 1 21 GLU HG3 . . 5.500 5.029 4.582 5.394 . 0 0 "[ . 1 . 2]" 1
305 1 17 LYS HB3 1 23 LEU QD . . 4.720 3.400 3.194 3.612 . 0 0 "[ . 1 . 2]" 1
306 1 17 LYS HB3 1 56 ALA MB . . 3.590 1.954 1.777 2.096 . 0 0 "[ . 1 . 2]" 1
307 1 17 LYS HD2 1 21 GLU H . . 4.610 3.852 3.575 4.079 . 0 0 "[ . 1 . 2]" 1
308 1 17 LYS HD2 1 21 GLU HB3 . . 4.930 3.967 3.805 4.288 . 0 0 "[ . 1 . 2]" 1
309 1 17 LYS HD2 1 21 GLU HG3 . . 5.500 4.882 4.524 5.084 . 0 0 "[ . 1 . 2]" 1
310 1 17 LYS HD2 1 22 ARG HA . . 4.820 4.223 3.721 4.687 . 0 0 "[ . 1 . 2]" 1
311 1 17 LYS HD2 1 23 LEU H . . 5.450 3.838 3.556 4.010 . 0 0 "[ . 1 . 2]" 1
312 1 17 LYS HD2 1 23 LEU HA . . 4.930 4.528 4.286 4.730 . 0 0 "[ . 1 . 2]" 1
313 1 17 LYS HD2 1 23 LEU HB2 . . 4.910 4.717 3.968 4.899 . 0 0 "[ . 1 . 2]" 1
314 1 17 LYS HD2 1 23 LEU QD . . 4.060 3.701 3.459 3.962 . 0 0 "[ . 1 . 2]" 1
315 1 17 LYS HD2 1 92 VAL MG1 . . 5.500 3.670 3.225 4.140 . 0 0 "[ . 1 . 2]" 1
316 1 17 LYS HD2 1 92 VAL QG . . 4.750 3.510 3.119 3.949 . 0 0 "[ . 1 . 2]" 1
317 1 17 LYS HD2 1 92 VAL MG2 . . 5.500 4.510 4.035 5.191 . 0 0 "[ . 1 . 2]" 1
318 1 17 LYS HD2 1 95 THR H . . 5.500 5.412 5.137 5.520 0.020 19 0 "[ . 1 . 2]" 1
319 1 17 LYS HD2 1 96 LEU MD2 . . 5.500 5.253 4.905 5.477 . 0 0 "[ . 1 . 2]" 1
320 1 17 LYS HD3 1 21 GLU H . . 4.840 4.504 4.250 4.843 0.003 2 0 "[ . 1 . 2]" 1
321 1 17 LYS HD3 1 21 GLU HB3 . . 5.340 3.548 3.259 3.903 . 0 0 "[ . 1 . 2]" 1
322 1 17 LYS HD3 1 21 GLU HG3 . . 4.430 3.831 3.524 4.269 . 0 0 "[ . 1 . 2]" 1
323 1 17 LYS HD3 1 22 ARG HA . . 5.500 4.159 3.644 4.720 . 0 0 "[ . 1 . 2]" 1
324 1 17 LYS HD3 1 23 LEU H . . 4.570 3.283 2.963 3.543 . 0 0 "[ . 1 . 2]" 1
325 1 17 LYS HD3 1 23 LEU HA . . 4.540 3.031 2.790 3.232 . 0 0 "[ . 1 . 2]" 1
326 1 17 LYS HD3 1 23 LEU HB2 . . 4.460 4.038 3.176 4.234 . 0 0 "[ . 1 . 2]" 1
327 1 17 LYS HD3 1 23 LEU QD . . 3.940 2.817 2.502 3.068 . 0 0 "[ . 1 . 2]" 1
328 1 17 LYS HD3 1 92 VAL MG1 . . 5.500 4.524 4.097 5.130 . 0 0 "[ . 1 . 2]" 1
329 1 17 LYS HD3 1 92 VAL MG2 . . 5.500 5.352 4.918 5.516 0.016 15 0 "[ . 1 . 2]" 1
330 1 17 LYS HD3 1 96 LEU MD2 . . 5.500 5.083 4.735 5.262 . 0 0 "[ . 1 . 2]" 1
331 1 17 LYS QE 1 18 ALA H . . 5.370 5.256 5.089 5.374 0.004 6 0 "[ . 1 . 2]" 1
332 1 17 LYS QE 1 21 GLU H . . 5.500 5.467 5.351 5.520 0.020 7 0 "[ . 1 . 2]" 1
333 1 17 LYS QE 1 23 LEU H . . 4.780 3.965 3.304 4.584 . 0 0 "[ . 1 . 2]" 1
334 1 17 LYS QE 1 23 LEU HA . . 4.760 3.656 3.178 4.457 . 0 0 "[ . 1 . 2]" 1
335 1 17 LYS QE 1 23 LEU HB2 . . 4.760 3.657 3.113 4.168 . 0 0 "[ . 1 . 2]" 1
336 1 17 LYS QE 1 23 LEU HB3 . . 5.500 5.059 4.601 5.506 0.006 20 0 "[ . 1 . 2]" 1
337 1 17 LYS QE 1 23 LEU MD1 . . 4.760 3.882 2.110 4.783 0.023 6 0 "[ . 1 . 2]" 1
338 1 17 LYS QE 1 23 LEU QD . . 3.830 2.029 1.797 2.525 . 0 0 "[ . 1 . 2]" 1
339 1 17 LYS QE 1 23 LEU MD2 . . 4.760 2.256 1.801 4.467 . 0 0 "[ . 1 . 2]" 1
340 1 17 LYS QE 1 56 ALA MB . . 4.640 2.783 2.325 3.644 . 0 0 "[ . 1 . 2]" 1
341 1 17 LYS QE 1 92 VAL MG1 . . 4.250 2.837 2.060 3.659 . 0 0 "[ . 1 . 2]" 1
342 1 17 LYS QE 1 92 VAL QG . . 3.640 2.681 2.044 3.191 . 0 0 "[ . 1 . 2]" 1
343 1 17 LYS QE 1 92 VAL MG2 . . 4.250 3.462 2.550 4.256 0.006 14 0 "[ . 1 . 2]" 1
344 1 17 LYS QE 1 96 LEU MD1 . . 4.820 4.406 4.031 4.834 0.014 19 0 "[ . 1 . 2]" 1
345 1 17 LYS QE 1 96 LEU MD2 . . 4.300 3.006 2.722 3.247 . 0 0 "[ . 1 . 2]" 1
346 1 17 LYS HG2 1 18 ALA H . . 4.130 3.783 3.524 3.995 . 0 0 "[ . 1 . 2]" 1
347 1 17 LYS HG2 1 21 GLU H . . 4.850 4.112 3.863 4.378 . 0 0 "[ . 1 . 2]" 1
348 1 17 LYS HG2 1 21 GLU HB2 . . 5.500 5.498 5.441 5.530 0.030 19 0 "[ . 1 . 2]" 1
349 1 17 LYS HG2 1 21 GLU HB3 . . 4.910 3.960 3.835 4.046 . 0 0 "[ . 1 . 2]" 1
350 1 17 LYS HG2 1 23 LEU QD . . 4.600 4.603 4.553 4.654 0.054 19 0 "[ . 1 . 2]" 1
351 1 17 LYS HG2 1 56 ALA MB . . 4.100 3.984 3.759 4.080 . 0 0 "[ . 1 . 2]" 1
352 1 17 LYS HG2 1 95 THR H . . 5.370 4.595 4.379 4.906 . 0 0 "[ . 1 . 2]" 1
353 1 17 LYS HG3 1 18 ALA H . . 4.640 2.895 2.553 3.144 . 0 0 "[ . 1 . 2]" 1
354 1 17 LYS HG3 1 21 GLU H . . 3.840 2.737 2.622 2.952 . 0 0 "[ . 1 . 2]" 1
355 1 17 LYS HG3 1 21 GLU HB2 . . 5.090 3.816 3.755 3.919 . 0 0 "[ . 1 . 2]" 1
356 1 17 LYS HG3 1 21 GLU HB3 . . 3.880 2.242 2.134 2.340 . 0 0 "[ . 1 . 2]" 1
357 1 17 LYS HG3 1 21 GLU HG3 . . 4.670 4.058 3.759 4.414 . 0 0 "[ . 1 . 2]" 1
358 1 17 LYS HG3 1 23 LEU HA . . 5.500 5.329 5.036 5.498 . 0 0 "[ . 1 . 2]" 1
359 1 17 LYS HG3 1 23 LEU QD . . 5.050 4.775 4.644 4.918 . 0 0 "[ . 1 . 2]" 1
360 1 18 ALA H 1 18 ALA MB . . 2.850 2.038 2.026 2.056 . 0 0 "[ . 1 . 2]" 1
361 1 18 ALA H 1 19 PRO HD2 . . 5.090 4.659 4.647 4.694 . 0 0 "[ . 1 . 2]" 1
362 1 18 ALA H 1 19 PRO QD . . 4.390 4.304 4.294 4.329 . 0 0 "[ . 1 . 2]" 1
363 1 18 ALA H 1 19 PRO HD3 . . 5.090 5.060 5.047 5.096 0.006 7 0 "[ . 1 . 2]" 1
364 1 18 ALA H 1 21 GLU H . . 4.320 4.110 3.907 4.288 . 0 0 "[ . 1 . 2]" 1
365 1 18 ALA H 1 21 GLU HA . . 5.500 5.401 5.188 5.527 0.027 12 0 "[ . 1 . 2]" 1
366 1 18 ALA H 1 21 GLU HB2 . . 3.520 3.271 2.972 3.532 0.012 12 0 "[ . 1 . 2]" 1
367 1 18 ALA H 1 21 GLU HB3 . . 3.460 2.612 2.400 2.773 . 0 0 "[ . 1 . 2]" 1
368 1 18 ALA H 1 21 GLU HG2 . . 4.080 3.640 3.421 3.793 . 0 0 "[ . 1 . 2]" 1
369 1 18 ALA H 1 21 GLU HG3 . . 4.790 4.444 4.146 4.676 . 0 0 "[ . 1 . 2]" 1
370 1 18 ALA H 1 56 ALA HA . . 5.500 5.344 5.106 5.511 0.011 19 0 "[ . 1 . 2]" 1
371 1 18 ALA H 1 56 ALA MB . . 4.350 4.157 4.018 4.314 . 0 0 "[ . 1 . 2]" 1
372 1 18 ALA H 1 59 ARG HE . . 5.500 5.104 4.226 5.504 0.004 12 0 "[ . 1 . 2]" 1
373 1 18 ALA H 1 59 ARG QH1 . . 4.510 4.090 3.339 4.580 0.070 18 0 "[ . 1 . 2]" 1
374 1 18 ALA H 1 59 ARG QH2 . . 4.510 2.706 1.810 3.825 . 0 0 "[ . 1 . 2]" 1
375 1 18 ALA HA 1 19 PRO HB3 . . 4.910 4.903 4.882 4.910 0.000 7 0 "[ . 1 . 2]" 1
376 1 18 ALA HA 1 19 PRO HD2 . . 3.220 2.624 2.555 2.647 . 0 0 "[ . 1 . 2]" 1
377 1 18 ALA HA 1 19 PRO QD . . 2.790 2.230 2.184 2.246 . 0 0 "[ . 1 . 2]" 1
378 1 18 ALA HA 1 19 PRO HD3 . . 3.220 2.413 2.372 2.428 . 0 0 "[ . 1 . 2]" 1
379 1 18 ALA HA 1 19 PRO HG2 . . 4.920 4.698 4.640 4.718 . 0 0 "[ . 1 . 2]" 1
380 1 18 ALA HA 1 19 PRO QG . . 4.250 4.151 4.103 4.167 . 0 0 "[ . 1 . 2]" 1
381 1 18 ALA HA 1 19 PRO HG3 . . 4.920 4.622 4.573 4.640 . 0 0 "[ . 1 . 2]" 1
382 1 18 ALA HA 1 21 GLU HB2 . . 5.450 4.612 4.460 4.781 . 0 0 "[ . 1 . 2]" 1
383 1 18 ALA MB 1 19 PRO HA . . 4.790 4.325 4.305 4.361 . 0 0 "[ . 1 . 2]" 1
384 1 18 ALA MB 1 19 PRO HB2 . . 5.090 4.873 4.830 4.952 . 0 0 "[ . 1 . 2]" 1
385 1 18 ALA MB 1 19 PRO HB3 . . 5.060 4.864 4.831 4.939 . 0 0 "[ . 1 . 2]" 1
386 1 18 ALA MB 1 19 PRO HD2 . . 3.240 1.903 1.875 1.941 . 0 0 "[ . 1 . 2]" 1
387 1 18 ALA MB 1 19 PRO HD3 . . 3.240 2.968 2.931 3.036 . 0 0 "[ . 1 . 2]" 1
388 1 18 ALA MB 1 19 PRO HG2 . . 4.640 3.541 3.480 3.641 . 0 0 "[ . 1 . 2]" 1
389 1 18 ALA MB 1 19 PRO QG . . 3.960 3.359 3.311 3.446 . 0 0 "[ . 1 . 2]" 1
390 1 18 ALA MB 1 19 PRO HG3 . . 4.640 4.178 4.149 4.260 . 0 0 "[ . 1 . 2]" 1
391 1 18 ALA MB 1 20 GLY H . . 4.670 2.113 2.089 2.144 . 0 0 "[ . 1 . 2]" 1
392 1 18 ALA MB 1 21 GLU H . . 4.000 2.785 2.488 3.056 . 0 0 "[ . 1 . 2]" 1
393 1 18 ALA MB 1 21 GLU HA . . 4.970 3.727 3.563 3.878 . 0 0 "[ . 1 . 2]" 1
394 1 18 ALA MB 1 21 GLU HB2 . . 3.270 1.932 1.844 2.030 . 0 0 "[ . 1 . 2]" 1
395 1 18 ALA MB 1 21 GLU HB3 . . 3.520 2.533 2.358 2.735 . 0 0 "[ . 1 . 2]" 1
396 1 18 ALA MB 1 21 GLU HG2 . . 3.850 3.242 3.161 3.320 . 0 0 "[ . 1 . 2]" 1
397 1 18 ALA MB 1 21 GLU HG3 . . 4.390 4.170 4.048 4.295 . 0 0 "[ . 1 . 2]" 1
398 1 18 ALA MB 1 22 ARG H . . 5.500 5.305 5.096 5.434 . 0 0 "[ . 1 . 2]" 1
399 1 18 ALA MB 1 59 ARG QH1 . . 4.910 4.048 3.198 4.672 . 0 0 "[ . 1 . 2]" 1
400 1 18 ALA MB 1 59 ARG QH2 . . 5.090 3.482 2.434 4.685 . 0 0 "[ . 1 . 2]" 1
401 1 19 PRO HA 1 20 GLY H . . 3.360 3.312 3.290 3.348 . 0 0 "[ . 1 . 2]" 1
402 1 19 PRO HA 1 20 GLY QA . . 4.250 4.159 4.150 4.175 . 0 0 "[ . 1 . 2]" 1
403 1 19 PRO HA 1 21 GLU H . . 4.840 4.635 4.448 4.736 . 0 0 "[ . 1 . 2]" 1
404 1 19 PRO HB2 1 20 GLY H . . 4.170 3.952 3.886 3.988 . 0 0 "[ . 1 . 2]" 1
405 1 19 PRO HB3 1 20 GLY H . . 4.670 4.499 4.462 4.519 . 0 0 "[ . 1 . 2]" 1
406 1 19 PRO QD 1 20 GLY H . . 4.760 2.931 2.859 2.973 . 0 0 "[ . 1 . 2]" 1
407 1 19 PRO QG 1 20 GLY H . . 4.270 3.246 3.133 3.310 . 0 0 "[ . 1 . 2]" 1
408 1 19 PRO HG2 1 20 GLY H . . 4.950 3.319 3.197 3.388 . 0 0 "[ . 1 . 2]" 1
409 1 19 PRO HG3 1 20 GLY H . . 4.950 4.597 4.504 4.650 . 0 0 "[ . 1 . 2]" 1
410 1 20 GLY H 1 21 GLU H . . 3.300 2.100 1.941 2.271 . 0 0 "[ . 1 . 2]" 1
411 1 21 GLU H 1 21 GLU HB2 . . 3.030 2.890 2.727 3.026 . 0 0 "[ . 1 . 2]" 1
412 1 21 GLU H 1 21 GLU HB3 . . 3.050 2.496 2.384 2.621 . 0 0 "[ . 1 . 2]" 1
413 1 21 GLU H 1 21 GLU HG2 . . 4.840 4.736 4.660 4.814 . 0 0 "[ . 1 . 2]" 1
414 1 21 GLU H 1 21 GLU HG3 . . 4.540 4.392 4.270 4.482 . 0 0 "[ . 1 . 2]" 1
415 1 21 GLU H 1 22 ARG H . . 4.570 4.518 4.456 4.565 . 0 0 "[ . 1 . 2]" 1
416 1 21 GLU H 1 22 ARG HA . . 5.410 5.152 5.042 5.235 . 0 0 "[ . 1 . 2]" 1
417 1 21 GLU HA 1 21 GLU HG2 . . 3.910 3.743 3.655 3.857 . 0 0 "[ . 1 . 2]" 1
418 1 21 GLU HA 1 21 GLU HG3 . . 3.860 3.220 3.014 3.414 . 0 0 "[ . 1 . 2]" 1
419 1 21 GLU HA 1 22 ARG H . . 2.610 2.214 2.147 2.303 . 0 0 "[ . 1 . 2]" 1
420 1 21 GLU HA 1 22 ARG QG . . 4.500 4.087 3.784 4.428 . 0 0 "[ . 1 . 2]" 1
421 1 21 GLU HB3 1 22 ARG H . . 4.340 4.023 3.771 4.288 . 0 0 "[ . 1 . 2]" 1
422 1 21 GLU HB3 1 56 ALA H . . 5.500 5.372 5.015 5.510 0.010 16 0 "[ . 1 . 2]" 1
423 1 21 GLU HB3 1 56 ALA MB . . 4.240 3.948 3.712 4.161 . 0 0 "[ . 1 . 2]" 1
424 1 21 GLU HG2 1 22 ARG H . . 4.510 4.119 3.768 4.510 0.000 19 0 "[ . 1 . 2]" 1
425 1 21 GLU HG2 1 56 ALA H . . 4.760 4.414 3.939 4.750 . 0 0 "[ . 1 . 2]" 1
426 1 21 GLU HG2 1 56 ALA MB . . 4.450 4.016 3.641 4.345 . 0 0 "[ . 1 . 2]" 1
427 1 21 GLU HG3 1 22 ARG H . . 3.540 2.841 2.307 3.476 . 0 0 "[ . 1 . 2]" 1
428 1 21 GLU HG3 1 23 LEU H . . 5.490 4.613 4.024 4.841 . 0 0 "[ . 1 . 2]" 1
429 1 21 GLU HG3 1 56 ALA H . . 3.990 3.718 3.399 4.001 0.011 9 0 "[ . 1 . 2]" 1
430 1 21 GLU HG3 1 56 ALA HA . . 5.090 4.961 4.644 5.094 0.004 16 0 "[ . 1 . 2]" 1
431 1 21 GLU HG3 1 56 ALA MB . . 3.890 3.539 3.278 3.768 . 0 0 "[ . 1 . 2]" 1
432 1 22 ARG H 1 22 ARG HB2 . . 3.860 2.735 2.190 3.626 . 0 0 "[ . 1 . 2]" 1
433 1 22 ARG H 1 22 ARG QB . . 3.350 2.418 2.168 2.892 . 0 0 "[ . 1 . 2]" 1
434 1 22 ARG H 1 22 ARG HB3 . . 3.860 3.298 2.731 3.615 . 0 0 "[ . 1 . 2]" 1
435 1 22 ARG H 1 22 ARG QD . . 4.080 3.404 1.855 4.086 0.006 15 0 "[ . 1 . 2]" 1
436 1 22 ARG H 1 22 ARG QG . . 3.190 2.582 1.879 3.189 . 0 0 "[ . 1 . 2]" 1
437 1 22 ARG H 1 23 LEU H . . 5.250 4.447 4.232 4.479 . 0 0 "[ . 1 . 2]" 1
438 1 22 ARG H 1 23 LEU HA . . 5.500 5.507 5.416 5.536 0.036 12 0 "[ . 1 . 2]" 1
439 1 22 ARG HA 1 22 ARG QD . . 4.100 3.669 1.963 4.207 0.107 1 0 "[ . 1 . 2]" 1
440 1 22 ARG HA 1 22 ARG QG . . 3.510 2.756 2.265 3.443 . 0 0 "[ . 1 . 2]" 1
441 1 22 ARG HA 1 23 LEU H . . 3.230 2.146 2.140 2.206 . 0 0 "[ . 1 . 2]" 1
442 1 22 ARG HA 1 23 LEU HB2 . . 5.090 4.235 4.172 4.260 . 0 0 "[ . 1 . 2]" 1
443 1 22 ARG HA 1 23 LEU HB3 . . 5.210 5.029 4.979 5.118 . 0 0 "[ . 1 . 2]" 1
444 1 22 ARG HA 1 23 LEU QD . . 5.010 4.760 4.682 5.071 0.061 19 0 "[ . 1 . 2]" 1
445 1 22 ARG HA 1 24 GLY H . . 4.320 4.120 3.876 4.300 . 0 0 "[ . 1 . 2]" 1
446 1 22 ARG QB 1 22 ARG QD . . 3.180 2.140 2.000 2.344 . 0 0 "[ . 1 . 2]" 1
447 1 22 ARG QB 1 23 LEU H . . 3.750 3.349 3.214 3.704 . 0 0 "[ . 1 . 2]" 1
448 1 22 ARG QB 1 24 GLY H . . 3.810 3.012 2.777 3.245 . 0 0 "[ . 1 . 2]" 1
449 1 22 ARG QB 1 24 GLY QA . . 3.860 3.584 3.402 3.873 0.013 9 0 "[ . 1 . 2]" 1
450 1 22 ARG QB 1 25 ILE H . . 5.340 5.169 4.933 5.349 0.009 9 0 "[ . 1 . 2]" 1
451 1 22 ARG HB2 1 22 ARG QD . . 3.800 2.636 2.072 3.405 . 0 0 "[ . 1 . 2]" 1
452 1 22 ARG HB2 1 23 LEU H . . 4.620 4.072 3.374 4.557 . 0 0 "[ . 1 . 2]" 1
453 1 22 ARG HB3 1 22 ARG QD . . 3.800 2.473 2.055 3.218 . 0 0 "[ . 1 . 2]" 1
454 1 22 ARG HB3 1 23 LEU H . . 4.620 3.754 3.374 4.297 . 0 0 "[ . 1 . 2]" 1
455 1 22 ARG QG 1 24 GLY H . . 4.870 4.361 3.304 4.905 0.035 15 0 "[ . 1 . 2]" 1
456 1 23 LEU H 1 23 LEU HB2 . . 3.640 2.143 2.112 2.163 . 0 0 "[ . 1 . 2]" 1
457 1 23 LEU H 1 23 LEU HB3 . . 3.460 3.113 3.051 3.240 . 0 0 "[ . 1 . 2]" 1
458 1 23 LEU H 1 23 LEU MD1 . . 4.760 4.105 3.235 4.233 . 0 0 "[ . 1 . 2]" 1
459 1 23 LEU H 1 23 LEU QD . . 3.780 3.215 3.131 3.452 . 0 0 "[ . 1 . 2]" 1
460 1 23 LEU H 1 23 LEU MD2 . . 4.760 3.441 3.229 4.468 . 0 0 "[ . 1 . 2]" 1
461 1 23 LEU H 1 24 GLY H . . 3.810 3.114 3.051 3.200 . 0 0 "[ . 1 . 2]" 1
462 1 23 LEU H 1 25 ILE H . . 5.380 5.193 5.063 5.306 . 0 0 "[ . 1 . 2]" 1
463 1 23 LEU H 1 56 ALA H . . 5.120 4.863 4.654 5.129 0.009 13 0 "[ . 1 . 2]" 1
464 1 23 LEU H 1 56 ALA MB . . 5.000 4.105 3.771 4.274 . 0 0 "[ . 1 . 2]" 1
465 1 23 LEU HA 1 23 LEU MD1 . . 3.420 2.425 2.089 3.497 0.077 19 0 "[ . 1 . 2]" 1
466 1 23 LEU HA 1 23 LEU QD . . 2.850 2.069 1.907 2.873 0.023 19 0 "[ . 1 . 2]" 1
467 1 23 LEU HA 1 23 LEU MD2 . . 3.420 2.306 1.972 3.691 0.271 16 0 "[ . 1 . 2]" 1
468 1 23 LEU HA 1 25 ILE MD . . 5.500 5.149 4.965 5.536 0.036 19 0 "[ . 1 . 2]" 1
469 1 23 LEU HA 1 56 ALA H . . 3.240 2.602 2.166 2.837 . 0 0 "[ . 1 . 2]" 1
470 1 23 LEU HA 1 56 ALA MB . . 2.980 2.100 1.937 2.399 . 0 0 "[ . 1 . 2]" 1
471 1 23 LEU HA 1 57 ALA H . . 4.240 3.627 3.555 3.745 . 0 0 "[ . 1 . 2]" 1
472 1 23 LEU HB2 1 23 LEU MD1 . . 3.220 3.069 2.013 3.181 . 0 0 "[ . 1 . 2]" 1
473 1 23 LEU HB2 1 23 LEU MD2 . . 3.220 2.327 2.061 3.096 . 0 0 "[ . 1 . 2]" 1
474 1 23 LEU HB2 1 24 GLY H . . 3.640 3.412 3.291 3.532 . 0 0 "[ . 1 . 2]" 1
475 1 23 LEU HB2 1 25 ILE H . . 4.450 4.451 4.229 4.483 0.033 16 0 "[ . 1 . 2]" 1
476 1 23 LEU HB2 1 25 ILE MD . . 4.340 3.827 3.663 4.039 . 0 0 "[ . 1 . 2]" 1
477 1 23 LEU HB2 1 25 ILE HG13 . . 4.640 4.343 4.091 4.687 0.047 19 0 "[ . 1 . 2]" 1
478 1 23 LEU HB2 1 56 ALA H . . 5.410 5.204 4.740 5.420 0.010 10 0 "[ . 1 . 2]" 1
479 1 23 LEU HB2 1 56 ALA MB . . 4.340 3.987 3.605 4.160 . 0 0 "[ . 1 . 2]" 1
480 1 23 LEU HB2 1 57 ALA H . . 5.500 5.495 5.225 5.566 0.066 6 0 "[ . 1 . 2]" 1
481 1 23 LEU HB3 1 23 LEU QD . . 3.100 2.322 2.105 2.439 . 0 0 "[ . 1 . 2]" 1
482 1 23 LEU HB3 1 24 GLY H . . 3.680 2.424 2.224 2.595 . 0 0 "[ . 1 . 2]" 1
483 1 23 LEU HB3 1 25 ILE H . . 3.550 2.752 2.497 2.933 . 0 0 "[ . 1 . 2]" 1
484 1 23 LEU HB3 1 25 ILE MD . . 4.180 3.176 2.970 3.400 . 0 0 "[ . 1 . 2]" 1
485 1 23 LEU HB3 1 25 ILE HG13 . . 4.080 2.865 2.560 3.359 . 0 0 "[ . 1 . 2]" 1
486 1 23 LEU HB3 1 57 ALA H . . 5.390 4.924 4.572 5.132 . 0 0 "[ . 1 . 2]" 1
487 1 23 LEU QD 1 24 GLY H . . 4.110 3.516 3.332 3.896 . 0 0 "[ . 1 . 2]" 1
488 1 23 LEU QD 1 24 GLY QA . . 4.720 3.775 3.599 4.565 . 0 0 "[ . 1 . 2]" 1
489 1 23 LEU QD 1 25 ILE H . . 3.740 3.329 3.120 3.580 . 0 0 "[ . 1 . 2]" 1
490 1 23 LEU QD 1 25 ILE HB . . 4.270 3.781 3.506 3.925 . 0 0 "[ . 1 . 2]" 1
491 1 23 LEU QD 1 25 ILE MD . . 2.840 2.521 1.797 2.766 . 0 0 "[ . 1 . 2]" 1
492 1 23 LEU QD 1 25 ILE HG12 . . 3.450 1.941 1.787 2.035 . 0 0 "[ . 1 . 2]" 1
493 1 23 LEU QD 1 25 ILE MG . . 3.110 1.816 1.688 2.077 . 0 0 "[ . 1 . 2]" 1
494 1 23 LEU QD 1 26 SER H . . 5.440 5.388 5.256 5.457 0.017 12 0 "[ . 1 . 2]" 1
495 1 23 LEU QD 1 51 VAL QG . . 3.810 3.506 3.254 3.627 . 0 0 "[ . 1 . 2]" 1
496 1 23 LEU QD 1 56 ALA H . . 4.030 3.042 2.695 3.776 . 0 0 "[ . 1 . 2]" 1
497 1 23 LEU QD 1 56 ALA MB . . 2.860 1.858 1.746 2.458 . 0 0 "[ . 1 . 2]" 1
498 1 23 LEU QD 1 57 ALA H . . 3.450 1.918 1.807 3.124 . 0 0 "[ . 1 . 2]" 1
499 1 23 LEU QD 1 57 ALA MB . . 3.300 1.794 1.694 2.212 . 0 0 "[ . 1 . 2]" 1
500 1 23 LEU MD1 1 56 ALA H . . 4.910 3.205 2.738 4.514 . 0 0 "[ . 1 . 2]" 1
501 1 23 LEU MD1 1 56 ALA MB . . 3.450 2.104 1.914 2.666 . 0 0 "[ . 1 . 2]" 1
502 1 23 LEU MD1 1 57 ALA H . . 4.040 2.051 1.813 4.047 0.007 19 0 "[ . 1 . 2]" 1
503 1 23 LEU MD2 1 56 ALA H . . 4.910 4.005 3.407 4.651 . 0 0 "[ . 1 . 2]" 1
504 1 23 LEU MD2 1 56 ALA MB . . 3.450 2.147 1.862 3.372 . 0 0 "[ . 1 . 2]" 1
505 1 23 LEU MD2 1 57 ALA H . . 4.040 3.521 2.156 3.753 . 0 0 "[ . 1 . 2]" 1
506 1 23 LEU HG 1 57 ALA H . . 5.500 4.504 2.416 4.807 . 0 0 "[ . 1 . 2]" 1
507 1 24 GLY H 1 25 ILE H . . 3.150 2.530 2.427 2.629 . 0 0 "[ . 1 . 2]" 1
508 1 24 GLY H 1 25 ILE MD . . 4.930 4.948 4.905 4.981 0.051 10 0 "[ . 1 . 2]" 1
509 1 24 GLY H 1 25 ILE HG12 . . 5.320 3.773 3.625 3.906 . 0 0 "[ . 1 . 2]" 1
510 1 24 GLY H 1 25 ILE HG13 . . 4.660 4.045 3.915 4.317 . 0 0 "[ . 1 . 2]" 1
511 1 24 GLY H 1 25 ILE MG . . 5.140 4.527 4.288 4.680 . 0 0 "[ . 1 . 2]" 1
512 1 24 GLY H 1 55 GLY QA . . 5.170 4.478 4.073 5.052 . 0 0 "[ . 1 . 2]" 1
513 1 24 GLY QA 1 25 ILE H . . 3.230 2.701 2.648 2.784 . 0 0 "[ . 1 . 2]" 1
514 1 24 GLY QA 1 25 ILE HG12 . . 4.640 4.433 4.344 4.557 . 0 0 "[ . 1 . 2]" 1
515 1 24 GLY QA 1 25 ILE MG . . 4.240 3.994 3.873 4.138 . 0 0 "[ . 1 . 2]" 1
516 1 24 GLY QA 1 55 GLY QA . . 4.440 2.647 2.036 3.551 . 0 0 "[ . 1 . 2]" 1
517 1 25 ILE H 1 25 ILE HB . . 3.900 3.671 3.623 3.705 . 0 0 "[ . 1 . 2]" 1
518 1 25 ILE H 1 25 ILE MD . . 3.900 3.715 3.630 3.774 . 0 0 "[ . 1 . 2]" 1
519 1 25 ILE H 1 25 ILE HG12 . . 3.330 2.495 2.312 2.663 . 0 0 "[ . 1 . 2]" 1
520 1 25 ILE H 1 25 ILE HG13 . . 3.560 2.120 1.944 2.383 . 0 0 "[ . 1 . 2]" 1
521 1 25 ILE H 1 25 ILE MG . . 4.000 3.212 3.095 3.326 . 0 0 "[ . 1 . 2]" 1
522 1 25 ILE H 1 26 SER H . . 4.620 4.484 4.434 4.530 . 0 0 "[ . 1 . 2]" 1
523 1 25 ILE H 1 51 VAL HA . . 5.180 5.073 4.902 5.186 0.006 18 0 "[ . 1 . 2]" 1
524 1 25 ILE H 1 57 ALA MB . . 5.210 4.902 4.664 5.230 0.020 19 0 "[ . 1 . 2]" 1
525 1 25 ILE HA 1 25 ILE MD . . 4.390 4.167 4.153 4.180 . 0 0 "[ . 1 . 2]" 1
526 1 25 ILE HA 1 25 ILE HG13 . . 4.240 3.601 3.572 3.663 . 0 0 "[ . 1 . 2]" 1
527 1 25 ILE HA 1 25 ILE MG . . 3.260 2.190 2.047 2.273 . 0 0 "[ . 1 . 2]" 1
528 1 25 ILE HA 1 26 SER H . . 2.740 2.422 2.305 2.559 . 0 0 "[ . 1 . 2]" 1
529 1 25 ILE HA 1 51 VAL H . . 5.020 4.898 4.722 5.018 . 0 0 "[ . 1 . 2]" 1
530 1 25 ILE HA 1 51 VAL HA . . 4.080 2.167 1.993 2.311 . 0 0 "[ . 1 . 2]" 1
531 1 25 ILE HA 1 51 VAL MG1 . . 4.770 3.552 2.983 4.562 . 0 0 "[ . 1 . 2]" 1
532 1 25 ILE HA 1 51 VAL QG . . 4.000 3.018 2.722 3.405 . 0 0 "[ . 1 . 2]" 1
533 1 25 ILE HA 1 51 VAL MG2 . . 4.770 3.345 3.045 3.714 . 0 0 "[ . 1 . 2]" 1
534 1 25 ILE HA 1 52 SER H . . 3.840 2.662 2.496 3.003 . 0 0 "[ . 1 . 2]" 1
535 1 25 ILE HB 1 25 ILE MD . . 3.140 2.291 2.157 2.372 . 0 0 "[ . 1 . 2]" 1
536 1 25 ILE HB 1 26 SER H . . 3.270 2.362 2.055 2.645 . 0 0 "[ . 1 . 2]" 1
537 1 25 ILE HB 1 52 SER H . . 5.380 5.069 4.804 5.393 0.013 13 0 "[ . 1 . 2]" 1
538 1 25 ILE MD 1 25 ILE MG . . 2.710 2.256 1.991 2.424 . 0 0 "[ . 1 . 2]" 1
539 1 25 ILE MD 1 26 SER H . . 4.570 4.128 3.811 4.393 . 0 0 "[ . 1 . 2]" 1
540 1 25 ILE MD 1 48 ILE HA . . 5.500 5.450 5.177 5.532 0.032 19 0 "[ . 1 . 2]" 1
541 1 25 ILE MD 1 48 ILE HG12 . . 4.170 3.884 3.519 4.146 . 0 0 "[ . 1 . 2]" 1
542 1 25 ILE MD 1 51 VAL HA . . 5.500 5.343 5.086 5.506 0.006 7 0 "[ . 1 . 2]" 1
543 1 25 ILE MD 1 89 LEU HA . . 5.090 4.694 4.418 4.973 . 0 0 "[ . 1 . 2]" 1
544 1 25 ILE MD 1 89 LEU HB3 . . 4.660 3.990 3.632 4.351 . 0 0 "[ . 1 . 2]" 1
545 1 25 ILE HG12 1 26 SER H . . 5.060 4.960 4.778 5.097 0.037 19 0 "[ . 1 . 2]" 1
546 1 25 ILE HG13 1 26 SER H . . 4.310 4.181 4.010 4.309 . 0 0 "[ . 1 . 2]" 1
547 1 25 ILE MG 1 26 SER H . . 3.720 3.283 3.120 3.441 . 0 0 "[ . 1 . 2]" 1
548 1 25 ILE MG 1 51 VAL HA . . 3.600 2.604 2.165 3.009 . 0 0 "[ . 1 . 2]" 1
549 1 25 ILE MG 1 51 VAL QG . . 2.810 1.794 1.648 2.040 . 0 0 "[ . 1 . 2]" 1
550 1 25 ILE MG 1 52 SER H . . 4.020 3.270 2.878 3.783 . 0 0 "[ . 1 . 2]" 1
551 1 25 ILE MG 1 57 ALA H . . 4.760 3.321 3.157 3.512 . 0 0 "[ . 1 . 2]" 1
552 1 25 ILE MG 1 57 ALA MB . . 2.960 1.841 1.749 2.055 . 0 0 "[ . 1 . 2]" 1
553 1 26 SER H 1 26 SER HB2 . . 3.420 2.709 2.463 2.970 . 0 0 "[ . 1 . 2]" 1
554 1 26 SER H 1 26 SER HB3 . . 3.900 3.296 2.938 3.695 . 0 0 "[ . 1 . 2]" 1
555 1 26 SER H 1 27 ILE H . . 4.560 4.425 4.357 4.495 . 0 0 "[ . 1 . 2]" 1
556 1 26 SER H 1 27 ILE HA . . 5.120 4.900 4.788 5.027 . 0 0 "[ . 1 . 2]" 1
557 1 26 SER H 1 27 ILE MG . . 4.910 3.769 3.607 3.922 . 0 0 "[ . 1 . 2]" 1
558 1 26 SER H 1 48 ILE HA . . 5.460 4.882 4.654 5.072 . 0 0 "[ . 1 . 2]" 1
559 1 26 SER H 1 48 ILE MD . . 5.500 5.012 4.658 5.504 0.004 18 0 "[ . 1 . 2]" 1
560 1 26 SER H 1 48 ILE HG12 . . 5.370 4.661 4.214 5.096 . 0 0 "[ . 1 . 2]" 1
561 1 26 SER H 1 48 ILE MG . . 3.520 2.979 2.813 3.159 . 0 0 "[ . 1 . 2]" 1
562 1 26 SER H 1 49 SER H . . 4.660 4.359 4.105 4.615 . 0 0 "[ . 1 . 2]" 1
563 1 26 SER H 1 50 LYS H . . 3.440 3.407 3.119 3.524 0.084 17 0 "[ . 1 . 2]" 1
564 1 26 SER H 1 50 LYS HA . . 5.500 4.898 4.703 4.976 . 0 0 "[ . 1 . 2]" 1
565 1 26 SER H 1 50 LYS HB3 . . 4.230 4.098 3.607 4.276 0.046 9 0 "[ . 1 . 2]" 1
566 1 26 SER H 1 50 LYS QG . . 4.610 3.991 3.320 4.636 0.026 13 0 "[ . 1 . 2]" 1
567 1 26 SER H 1 51 VAL HA . . 3.930 2.958 2.706 3.308 . 0 0 "[ . 1 . 2]" 1
568 1 26 SER H 1 51 VAL QG . . 3.900 3.184 2.709 3.928 0.028 13 0 "[ . 1 . 2]" 1
569 1 26 SER HA 1 27 ILE H . . 2.820 2.279 2.177 2.439 . 0 0 "[ . 1 . 2]" 1
570 1 26 SER HA 1 27 ILE MD . . 5.500 5.201 5.079 5.377 . 0 0 "[ . 1 . 2]" 1
571 1 26 SER HA 1 27 ILE HG12 . . 4.540 3.976 3.870 4.101 . 0 0 "[ . 1 . 2]" 1
572 1 26 SER HA 1 27 ILE MG . . 4.370 3.370 3.130 3.624 . 0 0 "[ . 1 . 2]" 1
573 1 26 SER HB2 1 27 ILE H . . 4.330 4.155 3.942 4.320 . 0 0 "[ . 1 . 2]" 1
574 1 26 SER HB2 1 27 ILE MG . . 5.500 5.050 4.912 5.187 . 0 0 "[ . 1 . 2]" 1
575 1 26 SER HB2 1 48 ILE MG . . 5.060 4.414 3.819 4.769 . 0 0 "[ . 1 . 2]" 1
576 1 26 SER HB2 1 49 SER H . . 4.910 4.577 4.125 4.912 0.002 10 0 "[ . 1 . 2]" 1
577 1 26 SER HB2 1 50 LYS H . . 3.710 3.452 2.898 3.736 0.026 13 0 "[ . 1 . 2]" 1
578 1 26 SER HB2 1 50 LYS HA . . 5.090 4.438 3.919 4.901 . 0 0 "[ . 1 . 2]" 1
579 1 26 SER HB2 1 50 LYS HB2 . . 4.170 3.800 3.539 4.122 . 0 0 "[ . 1 . 2]" 1
580 1 26 SER HB2 1 50 LYS HB3 . . 3.520 2.113 1.971 2.483 . 0 0 "[ . 1 . 2]" 1
581 1 26 SER HB2 1 50 LYS QD . . 4.760 3.201 2.536 4.843 0.083 13 0 "[ . 1 . 2]" 1
582 1 26 SER HB2 1 50 LYS HG2 . . 5.000 2.905 2.062 3.638 . 0 0 "[ . 1 . 2]" 1
583 1 26 SER HB2 1 50 LYS QG . . 4.340 2.849 2.050 3.537 . 0 0 "[ . 1 . 2]" 1
584 1 26 SER HB2 1 50 LYS HG3 . . 5.000 4.243 3.591 4.823 . 0 0 "[ . 1 . 2]" 1
585 1 26 SER HB2 1 51 VAL QG . . 5.440 4.651 4.140 5.245 . 0 0 "[ . 1 . 2]" 1
586 1 26 SER HB3 1 27 ILE H . . 3.440 3.230 2.930 3.485 0.045 12 0 "[ . 1 . 2]" 1
587 1 26 SER HB3 1 27 ILE MG . . 4.760 4.573 4.440 4.770 0.010 16 0 "[ . 1 . 2]" 1
588 1 26 SER HB3 1 49 SER H . . 4.910 3.414 2.993 3.907 . 0 0 "[ . 1 . 2]" 1
589 1 26 SER HB3 1 50 LYS H . . 3.780 2.793 2.238 3.536 . 0 0 "[ . 1 . 2]" 1
590 1 26 SER HB3 1 50 LYS HA . . 5.130 4.494 3.943 5.131 0.001 11 0 "[ . 1 . 2]" 1
591 1 26 SER HB3 1 50 LYS HB2 . . 4.500 3.791 3.111 4.287 . 0 0 "[ . 1 . 2]" 1
592 1 26 SER HB3 1 50 LYS HB3 . . 3.730 2.250 1.980 2.612 . 0 0 "[ . 1 . 2]" 1
593 1 26 SER HB3 1 50 LYS QD . . 4.760 3.939 3.291 4.829 0.069 13 0 "[ . 1 . 2]" 1
594 1 26 SER HB3 1 50 LYS HG2 . . 5.500 4.021 3.137 4.670 . 0 0 "[ . 1 . 2]" 1
595 1 26 SER HB3 1 50 LYS QG . . 4.650 3.857 3.067 4.432 . 0 0 "[ . 1 . 2]" 1
596 1 26 SER HB3 1 50 LYS HG3 . . 5.500 5.010 4.331 5.513 0.013 9 0 "[ . 1 . 2]" 1
597 1 27 ILE H 1 27 ILE HB . . 3.980 3.910 3.835 3.998 0.018 6 0 "[ . 1 . 2]" 1
598 1 27 ILE H 1 27 ILE MD . . 4.250 4.080 3.924 4.243 . 0 0 "[ . 1 . 2]" 1
599 1 27 ILE H 1 27 ILE HG12 . . 3.220 2.513 2.300 2.737 . 0 0 "[ . 1 . 2]" 1
600 1 27 ILE H 1 27 ILE HG13 . . 3.510 3.212 3.030 3.373 . 0 0 "[ . 1 . 2]" 1
601 1 27 ILE H 1 27 ILE MG . . 3.580 2.882 2.783 2.972 . 0 0 "[ . 1 . 2]" 1
602 1 27 ILE H 1 28 ARG H . . 4.510 4.399 4.295 4.470 . 0 0 "[ . 1 . 2]" 1
603 1 27 ILE H 1 48 ILE HA . . 4.930 4.631 4.530 4.703 . 0 0 "[ . 1 . 2]" 1
604 1 27 ILE H 1 49 SER H . . 4.850 3.993 3.584 4.222 . 0 0 "[ . 1 . 2]" 1
605 1 27 ILE H 1 50 LYS H . . 4.890 4.803 4.610 4.917 0.027 20 0 "[ . 1 . 2]" 1
606 1 27 ILE H 1 50 LYS HB3 . . 5.500 5.390 5.128 5.528 0.028 7 0 "[ . 1 . 2]" 1
607 1 27 ILE H 1 82 HIS HE1 . . 5.120 4.402 4.159 4.657 . 0 0 "[ . 1 . 2]" 1
608 1 27 ILE H 1 86 VAL MG2 . . 4.440 4.004 3.675 4.454 0.014 12 0 "[ . 1 . 2]" 1
609 1 27 ILE HA 1 27 ILE MD . . 4.240 4.149 4.128 4.163 . 0 0 "[ . 1 . 2]" 1
610 1 27 ILE HA 1 27 ILE MG . . 3.250 2.435 2.345 2.494 . 0 0 "[ . 1 . 2]" 1
611 1 27 ILE HA 1 28 ARG H . . 3.000 2.299 2.236 2.401 . 0 0 "[ . 1 . 2]" 1
612 1 27 ILE HA 1 28 ARG HG2 . . 5.090 3.905 3.715 4.197 . 0 0 "[ . 1 . 2]" 1
613 1 27 ILE HA 1 46 ILE MG . . 4.650 4.203 3.975 4.640 . 0 0 "[ . 1 . 2]" 1
614 1 27 ILE HA 1 47 PHE H . . 5.470 4.937 4.560 5.151 . 0 0 "[ . 1 . 2]" 1
615 1 27 ILE HA 1 48 ILE H . . 5.500 4.477 4.381 4.635 . 0 0 "[ . 1 . 2]" 1
616 1 27 ILE HA 1 48 ILE HA . . 3.600 2.005 1.973 2.088 . 0 0 "[ . 1 . 2]" 1
617 1 27 ILE HA 1 48 ILE HB . . 5.500 4.979 4.936 5.039 . 0 0 "[ . 1 . 2]" 1
618 1 27 ILE HA 1 48 ILE HG12 . . 4.760 4.138 3.904 4.454 . 0 0 "[ . 1 . 2]" 1
619 1 27 ILE HA 1 48 ILE MG . . 4.130 3.567 3.428 3.746 . 0 0 "[ . 1 . 2]" 1
620 1 27 ILE HA 1 49 SER H . . 3.490 2.136 1.899 2.441 . 0 0 "[ . 1 . 2]" 1
621 1 27 ILE HA 1 49 SER HB2 . . 5.210 4.536 3.791 5.152 . 0 0 "[ . 1 . 2]" 1
622 1 27 ILE HA 1 49 SER QB . . 4.340 3.308 3.083 3.647 . 0 0 "[ . 1 . 2]" 1
623 1 27 ILE HA 1 49 SER HB3 . . 5.210 3.416 3.165 3.779 . 0 0 "[ . 1 . 2]" 1
624 1 27 ILE HA 1 50 LYS H . . 4.120 3.879 3.633 4.045 . 0 0 "[ . 1 . 2]" 1
625 1 27 ILE HB 1 27 ILE MD . . 3.140 2.331 2.262 2.413 . 0 0 "[ . 1 . 2]" 1
626 1 27 ILE HB 1 28 ARG H . . 3.190 2.681 2.412 2.869 . 0 0 "[ . 1 . 2]" 1
627 1 27 ILE HB 1 28 ARG HA . . 5.090 4.582 4.453 4.664 . 0 0 "[ . 1 . 2]" 1
628 1 27 ILE HB 1 46 ILE MG . . 3.200 2.447 2.308 2.749 . 0 0 "[ . 1 . 2]" 1
629 1 27 ILE HB 1 47 PHE H . . 5.100 4.190 3.747 4.537 . 0 0 "[ . 1 . 2]" 1
630 1 27 ILE HB 1 48 ILE H . . 5.500 4.821 4.595 5.111 . 0 0 "[ . 1 . 2]" 1
631 1 27 ILE HB 1 48 ILE HA . . 4.910 3.368 3.083 3.577 . 0 0 "[ . 1 . 2]" 1
632 1 27 ILE HB 1 49 SER H . . 4.960 4.467 4.220 4.781 . 0 0 "[ . 1 . 2]" 1
633 1 27 ILE HB 1 82 HIS HD2 . . 4.620 4.569 4.453 4.634 0.014 17 0 "[ . 1 . 2]" 1
634 1 27 ILE MD 1 28 ARG H . . 4.500 4.358 4.137 4.514 0.014 6 0 "[ . 1 . 2]" 1
635 1 27 ILE MD 1 28 ARG HA . . 5.500 4.876 4.646 5.023 . 0 0 "[ . 1 . 2]" 1
636 1 27 ILE MD 1 30 GLY HA2 . . 5.500 5.463 5.294 5.518 0.018 14 0 "[ . 1 . 2]" 1
637 1 27 ILE MD 1 46 ILE MG . . 2.630 2.121 1.879 2.446 . 0 0 "[ . 1 . 2]" 1
638 1 27 ILE MD 1 47 PHE H . . 5.500 5.193 4.741 5.512 0.012 12 0 "[ . 1 . 2]" 1
639 1 27 ILE MD 1 48 ILE HA . . 5.340 5.011 4.761 5.180 . 0 0 "[ . 1 . 2]" 1
640 1 27 ILE MD 1 82 HIS HA . . 3.750 3.525 3.350 3.739 . 0 0 "[ . 1 . 2]" 1
641 1 27 ILE MD 1 82 HIS HB2 . . 5.500 5.310 5.170 5.488 . 0 0 "[ . 1 . 2]" 1
642 1 27 ILE MD 1 82 HIS HD2 . . 3.610 2.982 2.659 3.302 . 0 0 "[ . 1 . 2]" 1
643 1 27 ILE MD 1 82 HIS HE1 . . 4.890 4.795 4.626 4.905 0.015 7 0 "[ . 1 . 2]" 1
644 1 27 ILE MD 1 85 ALA H . . 4.820 4.774 4.593 4.834 0.014 1 0 "[ . 1 . 2]" 1
645 1 27 ILE MD 1 85 ALA HA . . 4.760 4.565 4.477 4.692 . 0 0 "[ . 1 . 2]" 1
646 1 27 ILE MD 1 85 ALA MB . . 3.000 2.458 2.320 2.608 . 0 0 "[ . 1 . 2]" 1
647 1 27 ILE MD 1 86 VAL H . . 3.710 3.183 2.967 3.353 . 0 0 "[ . 1 . 2]" 1
648 1 27 ILE MD 1 86 VAL HA . . 3.580 2.474 2.232 2.695 . 0 0 "[ . 1 . 2]" 1
649 1 27 ILE MD 1 86 VAL HB . . 4.570 4.246 3.980 4.447 . 0 0 "[ . 1 . 2]" 1
650 1 27 ILE MD 1 86 VAL MG1 . . 4.080 3.683 3.443 3.929 . 0 0 "[ . 1 . 2]" 1
651 1 27 ILE MD 1 86 VAL MG2 . . 3.100 2.101 1.854 2.365 . 0 0 "[ . 1 . 2]" 1
652 1 27 ILE MD 1 87 GLN H . . 5.330 5.202 5.006 5.347 0.017 17 0 "[ . 1 . 2]" 1
653 1 27 ILE MD 1 88 LEU H . . 5.500 5.343 5.161 5.515 0.015 11 0 "[ . 1 . 2]" 1
654 1 27 ILE MD 1 89 LEU H . . 5.020 4.821 4.587 5.026 0.006 16 0 "[ . 1 . 2]" 1
655 1 27 ILE MD 1 89 LEU MD2 . . 3.000 2.538 1.992 2.898 . 0 0 "[ . 1 . 2]" 1
656 1 27 ILE HG12 1 28 ARG H . . 4.790 4.730 4.587 4.807 0.017 19 0 "[ . 1 . 2]" 1
657 1 27 ILE HG12 1 82 HIS HD2 . . 4.890 4.719 4.478 4.897 0.007 12 0 "[ . 1 . 2]" 1
658 1 27 ILE HG12 1 82 HIS HE1 . . 4.570 4.514 4.331 4.580 0.010 18 0 "[ . 1 . 2]" 1
659 1 27 ILE HG12 1 89 LEU MD2 . . 3.550 3.198 2.806 3.494 . 0 0 "[ . 1 . 2]" 1
660 1 27 ILE HG13 1 27 ILE MG . . 3.480 3.189 3.179 3.202 . 0 0 "[ . 1 . 2]" 1
661 1 27 ILE HG13 1 28 ARG H . . 4.320 3.645 3.470 3.778 . 0 0 "[ . 1 . 2]" 1
662 1 27 ILE HG13 1 28 ARG HA . . 4.640 3.659 3.544 3.778 . 0 0 "[ . 1 . 2]" 1
663 1 27 ILE HG13 1 46 ILE MG . . 3.830 3.167 2.893 3.364 . 0 0 "[ . 1 . 2]" 1
664 1 27 ILE HG13 1 82 HIS HA . . 5.500 4.747 4.559 4.891 . 0 0 "[ . 1 . 2]" 1
665 1 27 ILE HG13 1 82 HIS HD2 . . 3.490 3.126 2.916 3.305 . 0 0 "[ . 1 . 2]" 1
666 1 27 ILE HG13 1 82 HIS HE1 . . 3.940 3.712 3.486 3.862 . 0 0 "[ . 1 . 2]" 1
667 1 27 ILE HG13 1 86 VAL MG1 . . 5.470 4.955 4.624 5.356 . 0 0 "[ . 1 . 2]" 1
668 1 27 ILE HG13 1 86 VAL MG2 . . 3.610 2.937 2.658 3.227 . 0 0 "[ . 1 . 2]" 1
669 1 27 ILE MG 1 28 ARG H . . 3.990 3.896 3.741 4.001 0.011 2 0 "[ . 1 . 2]" 1
670 1 27 ILE MG 1 48 ILE H . . 4.730 4.220 3.850 4.537 . 0 0 "[ . 1 . 2]" 1
671 1 27 ILE MG 1 48 ILE HA . . 3.430 2.631 2.421 2.840 . 0 0 "[ . 1 . 2]" 1
672 1 27 ILE MG 1 48 ILE HB . . 5.090 4.708 4.430 4.926 . 0 0 "[ . 1 . 2]" 1
673 1 27 ILE MG 1 48 ILE HG12 . . 3.800 2.676 2.444 2.931 . 0 0 "[ . 1 . 2]" 1
674 1 27 ILE MG 1 49 SER H . . 3.930 3.668 3.497 3.888 . 0 0 "[ . 1 . 2]" 1
675 1 27 ILE MG 1 50 LYS H . . 4.910 4.545 4.358 4.716 . 0 0 "[ . 1 . 2]" 1
676 1 27 ILE MG 1 86 VAL HA . . 5.040 4.221 3.963 4.495 . 0 0 "[ . 1 . 2]" 1
677 1 27 ILE MG 1 89 LEU MD2 . . 2.660 2.500 2.248 2.671 0.011 17 0 "[ . 1 . 2]" 1
678 1 28 ARG H 1 28 ARG HB2 . . 3.950 3.823 3.780 3.886 . 0 0 "[ . 1 . 2]" 1
679 1 28 ARG H 1 28 ARG HB3 . . 3.670 3.137 3.029 3.246 . 0 0 "[ . 1 . 2]" 1
680 1 28 ARG H 1 28 ARG QD . . 4.560 4.235 4.083 4.349 . 0 0 "[ . 1 . 2]" 1
681 1 28 ARG H 1 28 ARG HG2 . . 3.650 2.381 2.213 2.540 . 0 0 "[ . 1 . 2]" 1
682 1 28 ARG H 1 28 ARG HG3 . . 4.450 3.081 2.749 3.429 . 0 0 "[ . 1 . 2]" 1
683 1 28 ARG H 1 29 GLY H . . 4.510 4.324 4.235 4.415 . 0 0 "[ . 1 . 2]" 1
684 1 28 ARG H 1 46 ILE MG . . 3.660 3.262 3.062 3.555 . 0 0 "[ . 1 . 2]" 1
685 1 28 ARG H 1 47 PHE H . . 3.610 3.130 2.889 3.306 . 0 0 "[ . 1 . 2]" 1
686 1 28 ARG H 1 47 PHE HB2 . . 4.840 4.468 4.079 4.621 . 0 0 "[ . 1 . 2]" 1
687 1 28 ARG H 1 47 PHE HB3 . . 5.500 5.429 5.231 5.523 0.023 12 0 "[ . 1 . 2]" 1
688 1 28 ARG H 1 47 PHE QD . . 5.380 5.053 4.539 5.340 . 0 0 "[ . 1 . 2]" 1
689 1 28 ARG H 1 48 ILE HA . . 4.080 3.430 3.239 3.615 . 0 0 "[ . 1 . 2]" 1
690 1 28 ARG H 1 49 SER H . . 3.980 3.570 3.347 3.792 . 0 0 "[ . 1 . 2]" 1
691 1 28 ARG H 1 49 SER QB . . 4.070 3.214 2.904 3.467 . 0 0 "[ . 1 . 2]" 1
692 1 28 ARG H 1 50 LYS H . . 5.500 5.537 5.513 5.565 0.065 18 0 "[ . 1 . 2]" 1
693 1 28 ARG HA 1 28 ARG QD . . 4.910 4.349 4.227 4.518 . 0 0 "[ . 1 . 2]" 1
694 1 28 ARG HA 1 28 ARG HG2 . . 4.130 3.795 3.709 3.874 . 0 0 "[ . 1 . 2]" 1
695 1 28 ARG HA 1 29 GLY H . . 2.940 2.172 2.145 2.238 . 0 0 "[ . 1 . 2]" 1
696 1 28 ARG HA 1 49 SER HB2 . . 5.340 4.814 4.083 5.346 0.006 15 0 "[ . 1 . 2]" 1
697 1 28 ARG HA 1 49 SER HB3 . . 5.340 4.185 3.808 4.657 . 0 0 "[ . 1 . 2]" 1
698 1 28 ARG HA 1 82 HIS HD2 . . 3.880 3.786 3.580 3.895 0.015 6 0 "[ . 1 . 2]" 1
699 1 28 ARG HA 1 82 HIS HE1 . . 3.490 3.273 2.974 3.495 0.005 11 0 "[ . 1 . 2]" 1
700 1 28 ARG HB2 1 28 ARG QD . . 3.810 2.486 2.182 2.838 . 0 0 "[ . 1 . 2]" 1
701 1 28 ARG HB2 1 29 GLY H . . 3.470 3.224 2.900 3.419 . 0 0 "[ . 1 . 2]" 1
702 1 28 ARG HB2 1 29 GLY HA2 . . 5.010 4.367 4.258 4.511 . 0 0 "[ . 1 . 2]" 1
703 1 28 ARG HB2 1 36 GLY QA . . 5.090 3.838 2.142 4.824 . 0 0 "[ . 1 . 2]" 1
704 1 28 ARG HB2 1 47 PHE H . . 5.440 5.163 4.922 5.451 0.011 9 0 "[ . 1 . 2]" 1
705 1 28 ARG HB2 1 49 SER HB2 . . 4.640 4.018 3.453 4.667 0.027 17 0 "[ . 1 . 2]" 1
706 1 28 ARG HB2 1 49 SER HB3 . . 4.640 4.053 3.478 4.604 . 0 0 "[ . 1 . 2]" 1
707 1 28 ARG HB3 1 29 GLY H . . 4.320 4.203 4.008 4.332 0.012 16 0 "[ . 1 . 2]" 1
708 1 28 ARG HB3 1 49 SER H . . 5.330 4.464 4.133 4.728 . 0 0 "[ . 1 . 2]" 1
709 1 28 ARG HB3 1 49 SER HB2 . . 4.040 2.541 1.997 3.140 . 0 0 "[ . 1 . 2]" 1
710 1 28 ARG HB3 1 49 SER QB . . 3.530 2.032 1.931 2.285 . 0 0 "[ . 1 . 2]" 1
711 1 28 ARG HB3 1 49 SER HB3 . . 4.040 2.382 1.984 2.854 . 0 0 "[ . 1 . 2]" 1
712 1 28 ARG HB3 1 82 HIS HE1 . . 5.290 5.010 4.797 5.267 . 0 0 "[ . 1 . 2]" 1
713 1 28 ARG QD 1 29 GLY H . . 5.310 5.221 4.658 5.351 0.041 10 0 "[ . 1 . 2]" 1
714 1 28 ARG QD 1 47 PHE H . . 5.370 4.890 4.370 5.215 . 0 0 "[ . 1 . 2]" 1
715 1 28 ARG QD 1 49 SER HB2 . . 4.240 2.617 1.988 4.040 . 0 0 "[ . 1 . 2]" 1
716 1 28 ARG QD 1 49 SER QB . . 3.730 2.392 1.900 3.404 . 0 0 "[ . 1 . 2]" 1
717 1 28 ARG QD 1 49 SER HB3 . . 4.240 3.342 2.110 3.808 . 0 0 "[ . 1 . 2]" 1
718 1 28 ARG HG2 1 29 GLY H . . 5.260 5.092 4.912 5.269 0.009 18 0 "[ . 1 . 2]" 1
719 1 28 ARG HG2 1 47 PHE H . . 4.370 3.697 3.277 4.051 . 0 0 "[ . 1 . 2]" 1
720 1 28 ARG HG2 1 47 PHE HB2 . . 4.450 3.684 3.271 3.949 . 0 0 "[ . 1 . 2]" 1
721 1 28 ARG HG2 1 47 PHE HB3 . . 5.410 5.027 4.715 5.420 0.010 2 0 "[ . 1 . 2]" 1
722 1 28 ARG HG2 1 47 PHE QD . . 5.290 4.871 4.275 5.305 0.015 18 0 "[ . 1 . 2]" 1
723 1 28 ARG HG2 1 49 SER HB2 . . 4.180 2.871 1.994 3.901 . 0 0 "[ . 1 . 2]" 1
724 1 28 ARG HG2 1 49 SER HB3 . . 4.180 2.860 2.001 3.844 . 0 0 "[ . 1 . 2]" 1
725 1 28 ARG HG3 1 36 GLY QA . . 4.910 3.295 2.040 4.569 . 0 0 "[ . 1 . 2]" 1
726 1 28 ARG HG3 1 47 PHE HB2 . . 4.370 3.681 3.271 4.072 . 0 0 "[ . 1 . 2]" 1
727 1 28 ARG HG3 1 47 PHE QD . . 4.240 4.015 3.397 4.262 0.022 8 0 "[ . 1 . 2]" 1
728 1 29 GLY H 1 30 GLY H . . 4.470 4.355 4.263 4.490 0.020 12 0 "[ . 1 . 2]" 1
729 1 29 GLY H 1 46 ILE MG . . 4.850 4.108 3.752 4.511 . 0 0 "[ . 1 . 2]" 1
730 1 29 GLY H 1 82 HIS HB2 . . 4.930 4.175 3.989 4.426 . 0 0 "[ . 1 . 2]" 1
731 1 29 GLY H 1 82 HIS HD2 . . 3.770 2.954 2.671 3.336 . 0 0 "[ . 1 . 2]" 1
732 1 29 GLY H 1 82 HIS HE1 . . 4.670 4.137 3.900 4.514 . 0 0 "[ . 1 . 2]" 1
733 1 29 GLY HA2 1 30 GLY H . . 3.310 2.973 2.852 3.081 . 0 0 "[ . 1 . 2]" 1
734 1 29 GLY HA2 1 46 ILE MG . . 4.910 4.495 4.240 4.715 . 0 0 "[ . 1 . 2]" 1
735 1 29 GLY HA2 1 47 PHE H . . 5.080 4.756 4.549 5.019 . 0 0 "[ . 1 . 2]" 1
736 1 29 GLY HA3 1 30 GLY H . . 3.210 2.240 2.182 2.318 . 0 0 "[ . 1 . 2]" 1
737 1 29 GLY HA3 1 30 GLY HA2 . . 5.090 4.328 4.296 4.340 . 0 0 "[ . 1 . 2]" 1
738 1 29 GLY HA3 1 30 GLY HA3 . . 5.340 4.404 4.380 4.503 . 0 0 "[ . 1 . 2]" 1
739 1 29 GLY HA3 1 36 GLY QA . . 5.090 4.145 2.869 5.095 0.005 15 0 "[ . 1 . 2]" 1
740 1 29 GLY HA3 1 46 ILE MD . . 4.540 4.079 3.886 4.398 . 0 0 "[ . 1 . 2]" 1
741 1 29 GLY HA3 1 46 ILE MG . . 4.850 3.090 2.823 3.336 . 0 0 "[ . 1 . 2]" 1
742 1 29 GLY HA3 1 47 PHE H . . 4.260 3.630 3.484 3.709 . 0 0 "[ . 1 . 2]" 1
743 1 29 GLY HA3 1 47 PHE QD . . 4.760 4.378 4.140 4.568 . 0 0 "[ . 1 . 2]" 1
744 1 30 GLY H 1 31 ALA H . . 4.390 4.133 3.891 4.373 . 0 0 "[ . 1 . 2]" 1
745 1 30 GLY H 1 31 ALA HA . . 5.230 4.791 4.636 4.933 . 0 0 "[ . 1 . 2]" 1
746 1 30 GLY H 1 44 GLU HB2 . . 5.500 5.449 5.088 5.570 0.070 10 0 "[ . 1 . 2]" 1
747 1 30 GLY H 1 44 GLU QB . . 4.710 4.084 3.830 4.300 . 0 0 "[ . 1 . 2]" 1
748 1 30 GLY H 1 44 GLU HB3 . . 5.500 4.222 3.953 4.491 . 0 0 "[ . 1 . 2]" 1
749 1 30 GLY H 1 45 GLY H . . 5.440 4.948 4.222 5.443 0.003 1 0 "[ . 1 . 2]" 1
750 1 30 GLY H 1 45 GLY HA2 . . 5.090 4.785 4.459 5.104 0.014 17 0 "[ . 1 . 2]" 1
751 1 30 GLY H 1 46 ILE MD . . 3.990 3.033 2.844 3.395 . 0 0 "[ . 1 . 2]" 1
752 1 30 GLY H 1 46 ILE HG12 . . 4.230 1.964 1.891 2.162 . 0 0 "[ . 1 . 2]" 1
753 1 30 GLY H 1 46 ILE HG13 . . 4.320 2.382 2.092 2.791 . 0 0 "[ . 1 . 2]" 1
754 1 30 GLY H 1 46 ILE MG . . 5.340 3.737 3.589 3.997 . 0 0 "[ . 1 . 2]" 1
755 1 30 GLY H 1 47 PHE H . . 5.500 5.488 5.359 5.569 0.069 10 0 "[ . 1 . 2]" 1
756 1 30 GLY HA2 1 31 ALA H . . 3.050 2.289 2.159 2.862 . 0 0 "[ . 1 . 2]" 1
757 1 30 GLY HA2 1 31 ALA HA . . 4.910 4.333 4.299 4.498 . 0 0 "[ . 1 . 2]" 1
758 1 30 GLY HA2 1 31 ALA MB . . 4.540 4.020 3.945 4.095 . 0 0 "[ . 1 . 2]" 1
759 1 30 GLY HA2 1 46 ILE MD . . 3.450 2.367 2.136 2.531 . 0 0 "[ . 1 . 2]" 1
760 1 30 GLY HA2 1 46 ILE HG12 . . 4.360 2.952 2.613 3.131 . 0 0 "[ . 1 . 2]" 1
761 1 30 GLY HA2 1 46 ILE HG13 . . 4.300 3.705 3.568 3.829 . 0 0 "[ . 1 . 2]" 1
762 1 30 GLY HA2 1 81 THR H . . 5.500 5.546 5.509 5.601 0.101 10 0 "[ . 1 . 2]" 1
763 1 30 GLY HA2 1 81 THR MG . . 4.910 4.520 4.158 4.855 . 0 0 "[ . 1 . 2]" 1
764 1 30 GLY HA2 1 82 HIS H . . 3.620 2.469 2.125 2.900 . 0 0 "[ . 1 . 2]" 1
765 1 30 GLY HA2 1 82 HIS HA . . 3.820 3.123 2.756 3.346 . 0 0 "[ . 1 . 2]" 1
766 1 30 GLY HA2 1 85 ALA MB . . 4.780 4.103 3.840 4.367 . 0 0 "[ . 1 . 2]" 1
767 1 30 GLY HA3 1 31 ALA H . . 3.160 2.915 2.303 3.133 . 0 0 "[ . 1 . 2]" 1
768 1 30 GLY HA3 1 31 ALA HA . . 5.060 4.699 4.378 4.831 . 0 0 "[ . 1 . 2]" 1
769 1 30 GLY HA3 1 31 ALA MB . . 4.770 4.585 4.251 4.739 . 0 0 "[ . 1 . 2]" 1
770 1 30 GLY HA3 1 32 ARG H . . 5.500 3.466 2.894 5.515 0.015 19 0 "[ . 1 . 2]" 1
771 1 30 GLY HA3 1 46 ILE MD . . 3.990 3.884 3.700 4.000 0.010 5 0 "[ . 1 . 2]" 1
772 1 30 GLY HA3 1 46 ILE HG12 . . 4.640 3.943 3.766 4.091 . 0 0 "[ . 1 . 2]" 1
773 1 30 GLY HA3 1 46 ILE HG13 . . 5.000 4.911 4.737 5.010 0.010 2 0 "[ . 1 . 2]" 1
774 1 30 GLY HA3 1 82 HIS H . . 4.000 2.138 1.889 2.643 . 0 0 "[ . 1 . 2]" 1
775 1 30 GLY HA3 1 82 HIS HA . . 4.130 3.489 2.839 3.923 . 0 0 "[ . 1 . 2]" 1
776 1 30 GLY HA3 1 82 HIS HB2 . . 4.760 2.300 1.997 2.922 . 0 0 "[ . 1 . 2]" 1
777 1 30 GLY HA3 1 82 HIS HB3 . . 5.090 3.945 3.609 4.552 . 0 0 "[ . 1 . 2]" 1
778 1 31 ALA H 1 31 ALA MB . . 2.840 2.248 2.056 2.469 . 0 0 "[ . 1 . 2]" 1
779 1 31 ALA H 1 32 ARG H . . 4.730 2.961 1.802 4.447 . 0 0 "[ . 1 . 2]" 1
780 1 31 ALA H 1 32 ARG QB . . 5.340 4.684 3.826 5.378 0.038 20 0 "[ . 1 . 2]" 1
781 1 31 ALA H 1 44 GLU QB . . 4.460 3.918 3.520 4.192 . 0 0 "[ . 1 . 2]" 1
782 1 31 ALA H 1 46 ILE MD . . 4.020 3.622 3.167 4.033 0.013 12 0 "[ . 1 . 2]" 1
783 1 31 ALA H 1 46 ILE HG13 . . 5.500 5.129 4.619 5.544 0.044 17 0 "[ . 1 . 2]" 1
784 1 31 ALA H 1 81 THR H . . 4.930 4.662 4.511 4.751 . 0 0 "[ . 1 . 2]" 1
785 1 31 ALA H 1 81 THR HA . . 3.170 1.887 1.865 1.928 . 0 0 "[ . 1 . 2]" 1
786 1 31 ALA H 1 81 THR MG . . 3.880 2.980 2.189 3.696 . 0 0 "[ . 1 . 2]" 1
787 1 31 ALA H 1 82 HIS H . . 4.040 3.092 2.724 3.531 . 0 0 "[ . 1 . 2]" 1
788 1 31 ALA H 1 82 HIS HA . . 5.080 4.875 4.531 5.096 0.016 12 0 "[ . 1 . 2]" 1
789 1 31 ALA HA 1 32 ARG H . . 3.330 3.066 2.142 3.405 0.075 9 0 "[ . 1 . 2]" 1
790 1 31 ALA HA 1 32 ARG QG . . 4.910 4.531 3.506 4.913 0.003 8 0 "[ . 1 . 2]" 1
791 1 31 ALA HA 1 44 GLU H . . 5.500 5.131 4.665 5.535 0.035 6 0 "[ . 1 . 2]" 1
792 1 31 ALA HA 1 44 GLU HA . . 5.280 4.116 3.345 4.483 . 0 0 "[ . 1 . 2]" 1
793 1 31 ALA HA 1 44 GLU HB2 . . 4.080 2.882 2.035 3.470 . 0 0 "[ . 1 . 2]" 1
794 1 31 ALA HA 1 44 GLU QB . . 3.480 1.944 1.795 1.980 . 0 0 "[ . 1 . 2]" 1
795 1 31 ALA HA 1 44 GLU HB3 . . 4.080 1.998 1.955 2.178 . 0 0 "[ . 1 . 2]" 1
796 1 31 ALA HA 1 44 GLU HG2 . . 4.450 2.837 2.001 4.232 . 0 0 "[ . 1 . 2]" 1
797 1 31 ALA HA 1 44 GLU QG . . 3.860 2.520 1.910 3.159 . 0 0 "[ . 1 . 2]" 1
798 1 31 ALA HA 1 44 GLU HG3 . . 4.450 3.284 2.328 4.231 . 0 0 "[ . 1 . 2]" 1
799 1 31 ALA HA 1 81 THR MG . . 4.760 4.356 3.799 4.769 0.009 5 0 "[ . 1 . 2]" 1
800 1 31 ALA MB 1 32 ARG H . . 3.350 3.248 3.030 3.490 0.140 17 0 "[ . 1 . 2]" 1
801 1 31 ALA MB 1 32 ARG HA . . 4.910 4.296 4.113 4.745 . 0 0 "[ . 1 . 2]" 1
802 1 31 ALA MB 1 32 ARG QB . . 4.330 4.013 3.590 4.344 0.014 17 0 "[ . 1 . 2]" 1
803 1 31 ALA MB 1 32 ARG QD . . 4.960 4.117 2.131 4.972 0.012 18 0 "[ . 1 . 2]" 1
804 1 31 ALA MB 1 32 ARG QG . . 4.000 3.181 2.613 3.987 . 0 0 "[ . 1 . 2]" 1
805 1 31 ALA MB 1 33 GLY H . . 4.760 4.676 4.458 4.766 0.006 3 0 "[ . 1 . 2]" 1
806 1 31 ALA MB 1 44 GLU HB2 . . 4.760 3.859 3.110 4.299 . 0 0 "[ . 1 . 2]" 1
807 1 31 ALA MB 1 44 GLU QB . . 3.890 3.211 2.797 3.506 . 0 0 "[ . 1 . 2]" 1
808 1 31 ALA MB 1 44 GLU HB3 . . 4.760 3.498 2.874 3.741 . 0 0 "[ . 1 . 2]" 1
809 1 31 ALA MB 1 44 GLU HG2 . . 5.210 3.678 2.555 5.174 . 0 0 "[ . 1 . 2]" 1
810 1 31 ALA MB 1 44 GLU QG . . 4.490 3.352 2.512 4.002 . 0 0 "[ . 1 . 2]" 1
811 1 31 ALA MB 1 44 GLU HG3 . . 5.210 4.402 3.246 5.231 0.021 18 0 "[ . 1 . 2]" 1
812 1 31 ALA MB 1 79 GLY H . . 4.470 3.546 2.633 4.152 . 0 0 "[ . 1 . 2]" 1
813 1 31 ALA MB 1 79 GLY QA . . 4.010 3.775 3.225 4.022 0.012 8 0 "[ . 1 . 2]" 1
814 1 31 ALA MB 1 80 LEU H . . 4.640 4.259 3.447 4.658 0.018 13 0 "[ . 1 . 2]" 1
815 1 31 ALA MB 1 81 THR H . . 4.430 4.211 3.364 4.458 0.028 16 0 "[ . 1 . 2]" 1
816 1 31 ALA MB 1 81 THR HA . . 3.470 2.760 2.127 3.014 . 0 0 "[ . 1 . 2]" 1
817 1 31 ALA MB 1 82 HIS H . . 4.720 4.537 4.308 4.726 0.006 20 0 "[ . 1 . 2]" 1
818 1 32 ARG H 1 32 ARG QB . . 3.630 2.801 2.414 3.433 . 0 0 "[ . 1 . 2]" 1
819 1 32 ARG H 1 32 ARG HD2 . . 5.410 4.675 2.715 5.366 . 0 0 "[ . 1 . 2]" 1
820 1 32 ARG H 1 32 ARG QD . . 4.570 4.139 2.632 4.581 0.011 6 0 "[ . 1 . 2]" 1
821 1 32 ARG H 1 32 ARG HD3 . . 5.410 4.762 2.755 5.410 . 0 0 "[ . 1 . 2]" 1
822 1 32 ARG H 1 32 ARG QG . . 3.640 2.982 1.977 3.609 . 0 0 "[ . 1 . 2]" 1
823 1 32 ARG H 1 33 GLY H . . 3.570 2.196 1.795 3.019 . 0 0 "[ . 1 . 2]" 1
824 1 32 ARG H 1 44 GLU HA . . 5.500 5.298 4.430 5.587 0.087 11 0 "[ . 1 . 2]" 1
825 1 32 ARG H 1 44 GLU QB . . 5.340 3.867 2.421 4.809 . 0 0 "[ . 1 . 2]" 1
826 1 32 ARG H 1 44 GLU HG2 . . 5.500 4.451 1.899 5.552 0.052 10 0 "[ . 1 . 2]" 1
827 1 32 ARG H 1 44 GLU HG3 . . 5.500 4.457 2.000 5.503 0.003 1 0 "[ . 1 . 2]" 1
828 1 32 ARG H 1 81 THR HA . . 5.500 4.096 3.194 5.522 0.022 6 0 "[ . 1 . 2]" 1
829 1 32 ARG HA 1 32 ARG QD . . 4.530 3.319 2.006 4.529 . 0 0 "[ . 1 . 2]" 1
830 1 32 ARG HA 1 32 ARG QG . . 3.580 2.645 2.261 3.341 . 0 0 "[ . 1 . 2]" 1
831 1 32 ARG HA 1 81 THR MG . . 5.270 4.466 3.634 5.280 0.010 5 0 "[ . 1 . 2]" 1
832 1 32 ARG QB 1 33 GLY H . . 4.310 3.284 2.538 4.021 . 0 0 "[ . 1 . 2]" 1
833 1 32 ARG QB 1 81 THR MG . . 4.050 2.834 2.051 3.610 . 0 0 "[ . 1 . 2]" 1
834 1 32 ARG HB2 1 33 GLY H . . 5.130 3.507 2.614 4.403 . 0 0 "[ . 1 . 2]" 1
835 1 32 ARG HB3 1 33 GLY H . . 5.130 4.062 3.411 4.661 . 0 0 "[ . 1 . 2]" 1
836 1 32 ARG QG 1 33 GLY H . . 4.610 4.211 2.390 4.681 0.071 19 0 "[ . 1 . 2]" 1
837 1 32 ARG QG 1 81 THR MG . . 4.640 2.751 1.915 4.652 0.012 19 0 "[ . 1 . 2]" 1
838 1 33 GLY H 1 81 THR MG . . 5.150 4.476 3.226 5.160 0.010 17 0 "[ . 1 . 2]" 1
839 1 33 GLY QA 1 35 ALA H . . 5.340 4.745 3.023 5.354 0.014 6 0 "[ . 1 . 2]" 1
840 1 34 HIS HA 1 35 ALA H . . 3.470 2.373 2.140 3.508 0.038 2 0 "[ . 1 . 2]" 1
841 1 34 HIS QB 1 34 HIS HD2 . . 3.370 2.913 2.624 3.268 . 0 0 "[ . 1 . 2]" 1
842 1 34 HIS QB 1 35 ALA MB . . 5.340 4.257 3.159 4.922 . 0 0 "[ . 1 . 2]" 1
843 1 34 HIS HB2 1 34 HIS HD2 . . 3.940 3.480 2.689 3.943 0.003 14 0 "[ . 1 . 2]" 1
844 1 34 HIS HB2 1 35 ALA H . . 4.520 4.010 2.814 4.485 . 0 0 "[ . 1 . 2]" 1
845 1 34 HIS HB3 1 34 HIS HD2 . . 3.940 3.393 2.691 3.939 . 0 0 "[ . 1 . 2]" 1
846 1 34 HIS HB3 1 35 ALA H . . 4.520 3.793 3.263 4.443 . 0 0 "[ . 1 . 2]" 1
847 1 35 ALA H 1 35 ALA MB . . 3.300 2.328 2.064 2.900 . 0 0 "[ . 1 . 2]" 1
848 1 35 ALA H 1 36 GLY H . . 4.510 3.974 2.146 4.525 0.015 6 0 "[ . 1 . 2]" 1
849 1 35 ALA HA 1 36 GLY H . . 3.420 2.453 2.145 3.456 0.036 15 0 "[ . 1 . 2]" 1
850 1 35 ALA HA 1 37 ASN H . . 5.180 4.184 3.631 5.048 . 0 0 "[ . 1 . 2]" 1
851 1 35 ALA MB 1 36 GLY H . . 4.180 3.166 2.350 3.693 . 0 0 "[ . 1 . 2]" 1
852 1 35 ALA MB 1 36 GLY QA . . 4.760 4.031 3.503 4.265 . 0 0 "[ . 1 . 2]" 1
853 1 35 ALA MB 1 37 ASN H . . 4.470 3.394 2.633 4.398 . 0 0 "[ . 1 . 2]" 1
854 1 35 ALA MB 1 37 ASN QB . . 5.340 4.330 3.057 5.331 . 0 0 "[ . 1 . 2]" 1
855 1 35 ALA MB 1 41 PRO HA . . 4.080 2.496 1.892 3.518 . 0 0 "[ . 1 . 2]" 1
856 1 35 ALA MB 1 41 PRO HB2 . . 4.990 4.084 2.968 5.018 0.028 11 0 "[ . 1 . 2]" 1
857 1 35 ALA MB 1 41 PRO QB . . 4.330 3.480 2.304 4.159 . 0 0 "[ . 1 . 2]" 1
858 1 35 ALA MB 1 41 PRO HB3 . . 4.990 3.788 2.400 4.440 . 0 0 "[ . 1 . 2]" 1
859 1 36 GLY H 1 37 ASN H . . 3.820 2.875 1.894 3.406 . 0 0 "[ . 1 . 2]" 1
860 1 36 GLY QA 1 37 ASN H . . 3.350 2.646 2.341 2.833 . 0 0 "[ . 1 . 2]" 1
861 1 36 GLY QA 1 47 PHE QD . . 5.460 4.108 2.010 5.224 . 0 0 "[ . 1 . 2]" 1
862 1 37 ASN H 1 37 ASN HB2 . . 3.610 2.703 2.257 3.624 0.014 12 0 "[ . 1 . 2]" 1
863 1 37 ASN H 1 37 ASN HB3 . . 3.610 3.065 2.548 3.620 0.010 19 0 "[ . 1 . 2]" 1
864 1 37 ASN H 1 38 PRO HA . . 5.500 5.265 4.458 5.531 0.031 11 0 "[ . 1 . 2]" 1
865 1 37 ASN H 1 38 PRO QD . . 4.670 4.222 3.649 4.371 . 0 0 "[ . 1 . 2]" 1
866 1 37 ASN QB 1 37 ASN QD . . 3.020 2.144 2.063 2.222 . 0 0 "[ . 1 . 2]" 1
867 1 37 ASN QB 1 38 PRO QD . . 3.890 3.119 2.233 3.585 . 0 0 "[ . 1 . 2]" 1
868 1 37 ASN QB 1 40 ASP H . . 4.820 3.176 2.295 4.574 . 0 0 "[ . 1 . 2]" 1
869 1 37 ASN HB2 1 37 ASN HD22 . . 3.900 3.622 3.434 3.884 . 0 0 "[ . 1 . 2]" 1
870 1 37 ASN HB2 1 38 PRO HD2 . . 5.090 3.926 2.304 4.248 . 0 0 "[ . 1 . 2]" 1
871 1 37 ASN HB2 1 38 PRO HD3 . . 5.090 4.795 3.711 5.040 . 0 0 "[ . 1 . 2]" 1
872 1 37 ASN HB2 1 39 ARG H . . 5.020 4.129 2.355 4.889 . 0 0 "[ . 1 . 2]" 1
873 1 37 ASN HB3 1 37 ASN HD22 . . 3.900 3.639 3.441 3.928 0.028 8 0 "[ . 1 . 2]" 1
874 1 37 ASN HB3 1 38 PRO HD2 . . 5.090 3.611 2.675 4.318 . 0 0 "[ . 1 . 2]" 1
875 1 37 ASN HB3 1 38 PRO HD3 . . 5.090 4.610 3.998 5.047 . 0 0 "[ . 1 . 2]" 1
876 1 37 ASN HB3 1 39 ARG H . . 5.020 3.248 2.281 4.252 . 0 0 "[ . 1 . 2]" 1
877 1 37 ASN QD 1 39 ARG QB . . 4.440 2.999 1.756 4.337 . 0 0 "[ . 1 . 2]" 1
878 1 38 PRO HA 1 40 ASP H . . 5.060 4.851 4.191 5.069 0.009 19 0 "[ . 1 . 2]" 1
879 1 38 PRO QD 1 39 ARG H . . 4.020 2.783 2.603 2.948 . 0 0 "[ . 1 . 2]" 1
880 1 38 PRO HD2 1 39 ARG H . . 4.850 2.845 2.647 3.029 . 0 0 "[ . 1 . 2]" 1
881 1 38 PRO HD3 1 39 ARG H . . 4.850 3.944 3.838 4.045 . 0 0 "[ . 1 . 2]" 1
882 1 38 PRO QG 1 39 ARG H . . 3.730 2.839 1.897 3.275 . 0 0 "[ . 1 . 2]" 1
883 1 39 ARG H 1 39 ARG HB2 . . 4.010 2.450 2.220 2.763 . 0 0 "[ . 1 . 2]" 1
884 1 39 ARG H 1 39 ARG QB . . 3.310 2.308 2.151 2.586 . 0 0 "[ . 1 . 2]" 1
885 1 39 ARG H 1 39 ARG HB3 . . 4.010 3.038 2.447 3.658 . 0 0 "[ . 1 . 2]" 1
886 1 39 ARG H 1 39 ARG QD . . 4.850 4.151 3.515 4.703 . 0 0 "[ . 1 . 2]" 1
887 1 39 ARG H 1 39 ARG QG . . 4.160 3.427 2.011 4.064 . 0 0 "[ . 1 . 2]" 1
888 1 39 ARG H 1 40 ASP H . . 3.460 2.876 2.133 3.374 . 0 0 "[ . 1 . 2]" 1
889 1 39 ARG HA 1 39 ARG QD . . 4.040 3.107 2.010 4.053 0.013 2 0 "[ . 1 . 2]" 1
890 1 39 ARG HA 1 39 ARG QG . . 3.510 2.534 2.201 2.983 . 0 0 "[ . 1 . 2]" 1
891 1 39 ARG HA 1 40 ASP QB . . 5.340 5.212 4.799 5.337 . 0 0 "[ . 1 . 2]" 1
892 1 39 ARG HA 1 41 PRO HD3 . . 5.410 5.131 3.935 5.421 0.011 1 0 "[ . 1 . 2]" 1
893 1 39 ARG QB 1 39 ARG QD . . 3.380 2.254 2.039 2.559 . 0 0 "[ . 1 . 2]" 1
894 1 39 ARG QB 1 40 ASP H . . 3.890 2.153 1.886 2.518 . 0 0 "[ . 1 . 2]" 1
895 1 39 ARG HB2 1 40 ASP H . . 4.760 3.037 1.971 3.840 . 0 0 "[ . 1 . 2]" 1
896 1 39 ARG HB3 1 40 ASP H . . 4.760 2.494 1.895 3.606 . 0 0 "[ . 1 . 2]" 1
897 1 40 ASP H 1 40 ASP HB2 . . 3.960 2.900 2.380 3.891 . 0 0 "[ . 1 . 2]" 1
898 1 40 ASP H 1 40 ASP HB3 . . 3.960 3.599 3.197 3.852 . 0 0 "[ . 1 . 2]" 1
899 1 40 ASP H 1 41 PRO HD2 . . 4.910 4.645 4.340 4.803 . 0 0 "[ . 1 . 2]" 1
900 1 40 ASP H 1 41 PRO HD3 . . 4.910 4.286 3.747 4.652 . 0 0 "[ . 1 . 2]" 1
901 1 40 ASP HA 1 41 PRO HD2 . . 3.020 1.959 1.914 2.030 . 0 0 "[ . 1 . 2]" 1
902 1 40 ASP HA 1 41 PRO HD3 . . 3.090 2.393 2.283 2.715 . 0 0 "[ . 1 . 2]" 1
903 1 40 ASP HA 1 41 PRO QG . . 4.990 3.780 3.766 3.830 . 0 0 "[ . 1 . 2]" 1
904 1 40 ASP HA 1 42 THR H . . 4.660 3.487 3.164 3.702 . 0 0 "[ . 1 . 2]" 1
905 1 40 ASP QB 1 41 PRO HD2 . . 4.000 3.294 3.030 3.736 . 0 0 "[ . 1 . 2]" 1
906 1 40 ASP QB 1 41 PRO HD3 . . 4.580 4.215 4.001 4.408 . 0 0 "[ . 1 . 2]" 1
907 1 40 ASP QB 1 42 THR H . . 4.320 2.795 2.453 3.342 . 0 0 "[ . 1 . 2]" 1
908 1 40 ASP QB 1 42 THR HA . . 5.340 5.076 4.871 5.376 0.036 10 0 "[ . 1 . 2]" 1
909 1 40 ASP QB 1 42 THR HB . . 5.340 4.859 4.455 5.340 0.000 10 0 "[ . 1 . 2]" 1
910 1 40 ASP HB2 1 41 PRO HD2 . . 4.640 4.229 3.268 4.679 0.039 3 0 "[ . 1 . 2]" 1
911 1 40 ASP HB2 1 41 PRO HD3 . . 5.220 4.974 4.434 5.153 . 0 0 "[ . 1 . 2]" 1
912 1 40 ASP HB2 1 42 THR H . . 5.020 3.755 2.537 4.852 . 0 0 "[ . 1 . 2]" 1
913 1 40 ASP HB3 1 41 PRO HD2 . . 4.640 3.537 3.148 4.209 . 0 0 "[ . 1 . 2]" 1
914 1 40 ASP HB3 1 41 PRO HD3 . . 5.220 4.586 4.349 4.940 . 0 0 "[ . 1 . 2]" 1
915 1 40 ASP HB3 1 42 THR H . . 5.020 3.264 2.487 4.653 . 0 0 "[ . 1 . 2]" 1
916 1 41 PRO HA 1 42 THR H . . 3.480 3.402 3.292 3.521 0.041 11 0 "[ . 1 . 2]" 1
917 1 41 PRO HA 1 42 THR MG . . 5.090 4.863 4.593 5.102 0.012 10 0 "[ . 1 . 2]" 1
918 1 41 PRO QB 1 42 THR H . . 3.970 3.526 3.215 3.727 . 0 0 "[ . 1 . 2]" 1
919 1 41 PRO HB2 1 42 THR H . . 4.540 3.725 3.349 3.973 . 0 0 "[ . 1 . 2]" 1
920 1 41 PRO HB3 1 42 THR H . . 4.540 4.366 4.148 4.509 . 0 0 "[ . 1 . 2]" 1
921 1 41 PRO HD2 1 42 THR H . . 4.040 2.821 2.646 3.040 . 0 0 "[ . 1 . 2]" 1
922 1 41 PRO HD2 1 42 THR HA . . 5.500 5.432 5.221 5.530 0.030 15 0 "[ . 1 . 2]" 1
923 1 41 PRO HD2 1 42 THR MG . . 4.450 3.595 3.111 4.070 . 0 0 "[ . 1 . 2]" 1
924 1 41 PRO HD3 1 42 THR H . . 4.760 3.934 3.837 4.049 . 0 0 "[ . 1 . 2]" 1
925 1 41 PRO QG 1 42 THR H . . 3.680 2.895 2.367 3.288 . 0 0 "[ . 1 . 2]" 1
926 1 41 PRO QG 1 42 THR HA . . 4.910 4.318 4.046 4.497 . 0 0 "[ . 1 . 2]" 1
927 1 41 PRO QG 1 42 THR MG . . 3.700 2.972 2.452 3.732 0.032 11 0 "[ . 1 . 2]" 1
928 1 42 THR H 1 42 THR HB . . 4.000 3.471 2.629 3.716 . 0 0 "[ . 1 . 2]" 1
929 1 42 THR H 1 42 THR MG . . 3.300 2.443 1.976 2.965 . 0 0 "[ . 1 . 2]" 1
930 1 42 THR H 1 43 ASP H . . 3.300 2.843 2.087 3.301 0.001 8 0 "[ . 1 . 2]" 1
931 1 42 THR H 1 43 ASP HB2 . . 5.500 4.487 3.978 5.503 0.003 15 0 "[ . 1 . 2]" 1
932 1 42 THR H 1 43 ASP QB . . 4.650 4.099 3.809 4.653 0.003 12 0 "[ . 1 . 2]" 1
933 1 42 THR H 1 43 ASP HB3 . . 5.500 4.911 3.884 5.504 0.004 20 0 "[ . 1 . 2]" 1
934 1 42 THR HA 1 42 THR MG . . 3.040 2.500 2.126 3.201 0.161 10 0 "[ . 1 . 2]" 1
935 1 42 THR HA 1 43 ASP QB . . 5.340 4.892 4.594 5.295 . 0 0 "[ . 1 . 2]" 1
936 1 42 THR HA 1 44 GLU H . . 5.500 5.295 4.775 5.505 0.005 11 0 "[ . 1 . 2]" 1
937 1 42 THR HB 1 43 ASP H . . 4.440 4.194 3.190 4.449 0.009 14 0 "[ . 1 . 2]" 1
938 1 42 THR HB 1 43 ASP QB . . 5.340 5.136 4.435 5.436 0.096 11 0 "[ . 1 . 2]" 1
939 1 42 THR MG 1 43 ASP H . . 4.450 3.899 2.177 4.387 . 0 0 "[ . 1 . 2]" 1
940 1 43 ASP H 1 43 ASP HB2 . . 3.960 2.875 2.181 3.782 . 0 0 "[ . 1 . 2]" 1
941 1 43 ASP H 1 43 ASP QB . . 3.440 2.496 2.160 2.716 . 0 0 "[ . 1 . 2]" 1
942 1 43 ASP H 1 43 ASP HB3 . . 3.960 2.836 2.554 3.485 . 0 0 "[ . 1 . 2]" 1
943 1 43 ASP H 1 44 GLU H . . 4.660 4.145 3.694 4.426 . 0 0 "[ . 1 . 2]" 1
944 1 43 ASP HA 1 44 GLU H . . 3.500 2.162 2.140 2.256 . 0 0 "[ . 1 . 2]" 1
945 1 43 ASP HA 1 45 GLY H . . 5.440 4.133 3.286 5.420 . 0 0 "[ . 1 . 2]" 1
946 1 43 ASP QB 1 45 GLY H . . 4.810 3.686 2.985 4.596 . 0 0 "[ . 1 . 2]" 1
947 1 43 ASP HB2 1 44 GLU H . . 4.720 4.453 3.598 4.634 . 0 0 "[ . 1 . 2]" 1
948 1 43 ASP HB3 1 44 GLU H . . 4.720 4.262 3.773 4.496 . 0 0 "[ . 1 . 2]" 1
949 1 44 GLU H 1 44 GLU HB2 . . 4.040 2.583 2.423 2.841 . 0 0 "[ . 1 . 2]" 1
950 1 44 GLU H 1 44 GLU QB . . 3.460 2.529 2.390 2.754 . 0 0 "[ . 1 . 2]" 1
951 1 44 GLU H 1 44 GLU HB3 . . 4.040 3.631 3.561 3.720 . 0 0 "[ . 1 . 2]" 1
952 1 44 GLU H 1 44 GLU HG2 . . 4.450 3.521 2.036 4.338 . 0 0 "[ . 1 . 2]" 1
953 1 44 GLU H 1 44 GLU QG . . 3.760 2.850 2.023 3.486 . 0 0 "[ . 1 . 2]" 1
954 1 44 GLU H 1 44 GLU HG3 . . 4.450 3.273 2.401 3.681 . 0 0 "[ . 1 . 2]" 1
955 1 44 GLU H 1 45 GLY HA2 . . 5.370 4.908 4.437 5.386 0.016 10 0 "[ . 1 . 2]" 1
956 1 44 GLU HA 1 44 GLU HG2 . . 3.890 3.533 2.819 3.803 . 0 0 "[ . 1 . 2]" 1
957 1 44 GLU HA 1 44 GLU HG3 . . 3.890 2.792 2.391 3.913 0.023 20 0 "[ . 1 . 2]" 1
958 1 44 GLU HA 1 45 GLY H . . 3.520 2.695 2.172 3.229 . 0 0 "[ . 1 . 2]" 1
959 1 44 GLU HB2 1 45 GLY H . . 4.560 4.186 3.630 4.491 . 0 0 "[ . 1 . 2]" 1
960 1 44 GLU HB3 1 45 GLY H . . 4.560 4.312 3.834 4.507 . 0 0 "[ . 1 . 2]" 1
961 1 44 GLU QG 1 45 GLY H . . 4.990 4.758 4.534 4.923 . 0 0 "[ . 1 . 2]" 1
962 1 45 GLY H 1 46 ILE H . . 4.640 4.595 4.505 4.645 0.005 4 0 "[ . 1 . 2]" 1
963 1 45 GLY H 1 47 PHE QD . . 5.500 5.380 5.134 5.539 0.039 3 0 "[ . 1 . 2]" 1
964 1 45 GLY H 1 47 PHE QE . . 4.130 3.839 3.502 4.066 . 0 0 "[ . 1 . 2]" 1
965 1 45 GLY HA2 1 46 ILE H . . 3.280 2.338 2.215 2.512 . 0 0 "[ . 1 . 2]" 1
966 1 45 GLY HA2 1 46 ILE HB . . 5.090 4.601 4.502 4.680 . 0 0 "[ . 1 . 2]" 1
967 1 45 GLY HA2 1 46 ILE MD . . 5.500 4.416 4.242 4.675 . 0 0 "[ . 1 . 2]" 1
968 1 45 GLY HA2 1 46 ILE HG13 . . 5.340 3.388 3.209 3.613 . 0 0 "[ . 1 . 2]" 1
969 1 45 GLY HA2 1 46 ILE MG . . 5.500 5.427 5.408 5.440 . 0 0 "[ . 1 . 2]" 1
970 1 45 GLY HA2 1 47 PHE QD . . 5.180 4.857 4.686 5.103 . 0 0 "[ . 1 . 2]" 1
971 1 45 GLY HA2 1 47 PHE QE . . 4.230 3.443 3.289 3.628 . 0 0 "[ . 1 . 2]" 1
972 1 45 GLY HA2 1 68 ARG HE . . 5.230 4.053 3.332 5.236 0.006 2 0 "[ . 1 . 2]" 1
973 1 45 GLY HA2 1 68 ARG HG3 . . 5.340 5.236 4.782 5.359 0.019 11 0 "[ . 1 . 2]" 1
974 1 45 GLY HA3 1 46 ILE H . . 3.090 2.825 2.615 3.005 . 0 0 "[ . 1 . 2]" 1
975 1 45 GLY HA3 1 46 ILE HB . . 5.500 5.447 5.288 5.552 0.052 6 0 "[ . 1 . 2]" 1
976 1 45 GLY HA3 1 46 ILE HG13 . . 5.090 4.443 4.303 4.654 . 0 0 "[ . 1 . 2]" 1
977 1 45 GLY HA3 1 47 PHE H . . 5.500 5.514 5.477 5.544 0.044 6 0 "[ . 1 . 2]" 1
978 1 45 GLY HA3 1 47 PHE QD . . 4.110 3.910 3.806 4.097 . 0 0 "[ . 1 . 2]" 1
979 1 45 GLY HA3 1 47 PHE QE . . 4.100 1.984 1.957 2.038 . 0 0 "[ . 1 . 2]" 1
980 1 45 GLY HA3 1 68 ARG HE . . 5.090 3.998 3.231 4.975 . 0 0 "[ . 1 . 2]" 1
981 1 45 GLY HA3 1 68 ARG HG3 . . 5.340 4.803 4.421 5.011 . 0 0 "[ . 1 . 2]" 1
982 1 46 ILE H 1 46 ILE HB . . 3.170 2.741 2.619 2.865 . 0 0 "[ . 1 . 2]" 1
983 1 46 ILE H 1 46 ILE MD . . 4.410 3.838 3.659 4.112 . 0 0 "[ . 1 . 2]" 1
984 1 46 ILE H 1 46 ILE HG12 . . 4.370 4.161 4.039 4.284 . 0 0 "[ . 1 . 2]" 1
985 1 46 ILE H 1 46 ILE HG13 . . 3.760 2.867 2.743 2.999 . 0 0 "[ . 1 . 2]" 1
986 1 46 ILE H 1 46 ILE MG . . 4.180 3.888 3.840 3.938 . 0 0 "[ . 1 . 2]" 1
987 1 46 ILE H 1 47 PHE H . . 4.560 4.191 4.092 4.301 . 0 0 "[ . 1 . 2]" 1
988 1 46 ILE H 1 47 PHE QD . . 4.230 3.533 3.335 3.963 . 0 0 "[ . 1 . 2]" 1
989 1 46 ILE H 1 47 PHE QE . . 4.390 3.168 2.933 3.526 . 0 0 "[ . 1 . 2]" 1
990 1 46 ILE H 1 68 ARG HE . . 4.470 3.554 3.022 4.415 . 0 0 "[ . 1 . 2]" 1
991 1 46 ILE H 1 68 ARG HG3 . . 4.290 3.736 3.494 4.018 . 0 0 "[ . 1 . 2]" 1
992 1 46 ILE H 1 69 LEU H . . 5.020 4.933 4.751 5.034 0.014 4 0 "[ . 1 . 2]" 1
993 1 46 ILE HA 1 46 ILE HG12 . . 3.960 2.731 2.612 2.826 . 0 0 "[ . 1 . 2]" 1
994 1 46 ILE HA 1 46 ILE HG13 . . 4.000 2.850 2.760 3.031 . 0 0 "[ . 1 . 2]" 1
995 1 46 ILE HA 1 47 PHE H . . 3.020 2.139 2.139 2.141 . 0 0 "[ . 1 . 2]" 1
996 1 46 ILE HB 1 46 ILE MD . . 3.030 2.337 2.235 2.415 . 0 0 "[ . 1 . 2]" 1
997 1 46 ILE HB 1 47 PHE QE . . 5.500 5.533 5.462 5.570 0.070 4 0 "[ . 1 . 2]" 1
998 1 46 ILE HB 1 69 LEU H . . 4.560 4.435 4.221 4.574 0.014 9 0 "[ . 1 . 2]" 1
999 1 46 ILE HB 1 69 LEU HB2 . . 4.330 3.517 3.212 3.769 . 0 0 "[ . 1 . 2]" 1
1000 1 46 ILE HB 1 69 LEU HB3 . . 4.370 4.187 3.882 4.395 0.025 17 0 "[ . 1 . 2]" 1
1001 1 46 ILE MD 1 47 PHE H . . 5.380 5.341 5.280 5.372 . 0 0 "[ . 1 . 2]" 1
1002 1 46 ILE MD 1 80 LEU H . . 5.350 5.024 4.787 5.239 . 0 0 "[ . 1 . 2]" 1
1003 1 46 ILE MD 1 82 HIS H . . 4.760 4.117 3.619 4.641 . 0 0 "[ . 1 . 2]" 1
1004 1 46 ILE MD 1 82 HIS HA . . 3.550 3.351 3.130 3.526 . 0 0 "[ . 1 . 2]" 1
1005 1 46 ILE MD 1 85 ALA H . . 4.820 4.350 4.090 4.518 . 0 0 "[ . 1 . 2]" 1
1006 1 46 ILE MD 1 85 ALA MB . . 2.640 2.305 2.082 2.443 . 0 0 "[ . 1 . 2]" 1
1007 1 46 ILE MD 1 86 VAL H . . 5.210 5.102 4.828 5.221 0.011 18 0 "[ . 1 . 2]" 1
1008 1 46 ILE HG12 1 46 ILE MG . . 3.250 2.115 2.065 2.221 . 0 0 "[ . 1 . 2]" 1
1009 1 46 ILE HG12 1 47 PHE H . . 5.130 4.638 4.479 4.729 . 0 0 "[ . 1 . 2]" 1
1010 1 46 ILE HG13 1 46 ILE MG . . 3.360 3.159 3.142 3.183 . 0 0 "[ . 1 . 2]" 1
1011 1 46 ILE HG13 1 47 PHE H . . 5.080 4.931 4.858 5.078 . 0 0 "[ . 1 . 2]" 1
1012 1 46 ILE MG 1 47 PHE H . . 3.270 2.633 2.579 2.695 . 0 0 "[ . 1 . 2]" 1
1013 1 46 ILE MG 1 47 PHE HA . . 4.450 3.601 3.465 3.706 . 0 0 "[ . 1 . 2]" 1
1014 1 46 ILE MG 1 47 PHE QD . . 4.250 4.159 4.106 4.217 . 0 0 "[ . 1 . 2]" 1
1015 1 46 ILE MG 1 47 PHE QE . . 5.500 5.463 5.338 5.517 0.017 15 0 "[ . 1 . 2]" 1
1016 1 46 ILE MG 1 48 ILE HA . . 4.910 4.730 4.564 4.917 0.007 5 0 "[ . 1 . 2]" 1
1017 1 46 ILE MG 1 68 ARG HA . . 5.500 5.307 5.183 5.447 . 0 0 "[ . 1 . 2]" 1
1018 1 46 ILE MG 1 69 LEU H . . 4.450 4.143 3.967 4.280 . 0 0 "[ . 1 . 2]" 1
1019 1 46 ILE MG 1 69 LEU HB2 . . 3.410 3.038 2.866 3.207 . 0 0 "[ . 1 . 2]" 1
1020 1 46 ILE MG 1 82 HIS HA . . 4.760 3.778 3.624 3.930 . 0 0 "[ . 1 . 2]" 1
1021 1 46 ILE MG 1 82 HIS HB2 . . 5.090 5.099 5.016 5.122 0.032 6 0 "[ . 1 . 2]" 1
1022 1 47 PHE H 1 47 PHE HB2 . . 3.660 2.808 2.742 2.927 . 0 0 "[ . 1 . 2]" 1
1023 1 47 PHE H 1 47 PHE HB3 . . 3.880 3.850 3.827 3.877 . 0 0 "[ . 1 . 2]" 1
1024 1 47 PHE H 1 47 PHE QD . . 3.070 2.157 1.996 2.230 . 0 0 "[ . 1 . 2]" 1
1025 1 47 PHE H 1 47 PHE QE . . 4.430 4.393 4.171 4.486 0.056 15 0 "[ . 1 . 2]" 1
1026 1 47 PHE H 1 48 ILE HA . . 5.500 5.056 4.954 5.113 . 0 0 "[ . 1 . 2]" 1
1027 1 47 PHE H 1 68 ARG HA . . 5.500 4.979 4.780 5.122 . 0 0 "[ . 1 . 2]" 1
1028 1 47 PHE H 1 69 LEU H . . 5.370 4.877 4.643 5.005 . 0 0 "[ . 1 . 2]" 1
1029 1 47 PHE H 1 69 LEU HB2 . . 5.500 5.169 4.818 5.326 . 0 0 "[ . 1 . 2]" 1
1030 1 47 PHE HA 1 47 PHE QD . . 3.330 3.246 3.212 3.310 . 0 0 "[ . 1 . 2]" 1
1031 1 47 PHE HA 1 47 PHE QE . . 4.910 4.849 4.798 4.953 0.043 6 0 "[ . 1 . 2]" 1
1032 1 47 PHE HA 1 48 ILE H . . 3.030 2.386 2.256 2.656 . 0 0 "[ . 1 . 2]" 1
1033 1 47 PHE HA 1 48 ILE HB . . 5.220 4.866 4.759 5.093 . 0 0 "[ . 1 . 2]" 1
1034 1 47 PHE HA 1 48 ILE HG13 . . 4.300 3.757 3.592 3.904 . 0 0 "[ . 1 . 2]" 1
1035 1 47 PHE HA 1 68 ARG HA . . 3.550 2.401 2.243 2.508 . 0 0 "[ . 1 . 2]" 1
1036 1 47 PHE HA 1 68 ARG HG3 . . 4.540 3.896 3.601 4.154 . 0 0 "[ . 1 . 2]" 1
1037 1 47 PHE HA 1 69 LEU H . . 3.730 2.430 2.189 2.556 . 0 0 "[ . 1 . 2]" 1
1038 1 47 PHE HA 1 69 LEU HB2 . . 4.640 3.537 3.222 3.649 . 0 0 "[ . 1 . 2]" 1
1039 1 47 PHE HA 1 69 LEU HB3 . . 5.340 5.264 4.951 5.369 0.029 14 0 "[ . 1 . 2]" 1
1040 1 47 PHE HA 1 69 LEU HG . . 5.500 4.979 4.641 5.167 . 0 0 "[ . 1 . 2]" 1
1041 1 47 PHE HB2 1 48 ILE H . . 3.910 3.509 2.819 3.833 . 0 0 "[ . 1 . 2]" 1
1042 1 47 PHE HB2 1 104 PHE QE . . 4.390 3.836 3.431 4.384 . 0 0 "[ . 1 . 2]" 1
1043 1 47 PHE HB3 1 48 ILE H . . 3.640 2.568 2.056 2.836 . 0 0 "[ . 1 . 2]" 1
1044 1 47 PHE HB3 1 48 ILE HG13 . . 5.210 4.642 4.081 4.960 . 0 0 "[ . 1 . 2]" 1
1045 1 47 PHE HB3 1 104 PHE QE . . 4.390 3.471 2.802 4.159 . 0 0 "[ . 1 . 2]" 1
1046 1 47 PHE QD 1 48 ILE H . . 4.780 4.238 3.934 4.406 . 0 0 "[ . 1 . 2]" 1
1047 1 47 PHE QD 1 66 GLY HA2 . . 4.940 4.807 4.471 4.952 0.012 7 0 "[ . 1 . 2]" 1
1048 1 47 PHE QD 1 67 LEU HA . . 4.760 4.469 3.940 4.772 0.012 3 0 "[ . 1 . 2]" 1
1049 1 47 PHE QD 1 68 ARG H . . 3.910 3.470 3.054 3.726 . 0 0 "[ . 1 . 2]" 1
1050 1 47 PHE QD 1 68 ARG HA . . 3.260 2.532 2.268 2.766 . 0 0 "[ . 1 . 2]" 1
1051 1 47 PHE QD 1 68 ARG HB2 . . 3.660 2.140 1.991 2.474 . 0 0 "[ . 1 . 2]" 1
1052 1 47 PHE QD 1 68 ARG HB3 . . 4.000 3.771 3.579 4.021 0.021 13 0 "[ . 1 . 2]" 1
1053 1 47 PHE QD 1 68 ARG QD . . 4.510 3.895 3.774 4.477 . 0 0 "[ . 1 . 2]" 1
1054 1 47 PHE QD 1 68 ARG HG2 . . 5.340 4.273 4.060 4.558 . 0 0 "[ . 1 . 2]" 1
1055 1 47 PHE QD 1 68 ARG HG3 . . 3.910 3.083 2.931 3.326 . 0 0 "[ . 1 . 2]" 1
1056 1 47 PHE QD 1 69 LEU H . . 4.500 4.313 4.094 4.432 . 0 0 "[ . 1 . 2]" 1
1057 1 47 PHE QD 1 103 GLY HA2 . . 5.220 4.976 4.273 5.236 0.016 15 0 "[ . 1 . 2]" 1
1058 1 47 PHE QD 1 103 GLY HA3 . . 3.840 3.611 3.248 3.785 . 0 0 "[ . 1 . 2]" 1
1059 1 47 PHE QD 1 104 PHE QE . . 2.980 2.552 1.999 2.989 0.009 15 0 "[ . 1 . 2]" 1
1060 1 47 PHE QD 1 104 PHE HZ . . 3.490 3.065 2.553 3.488 . 0 0 "[ . 1 . 2]" 1
1061 1 47 PHE QE 1 68 ARG H . . 4.500 4.484 4.375 4.550 0.050 18 0 "[ . 1 . 2]" 1
1062 1 47 PHE QE 1 68 ARG HA . . 4.370 3.902 3.746 4.076 . 0 0 "[ . 1 . 2]" 1
1063 1 47 PHE QE 1 68 ARG HB2 . . 3.610 2.030 1.979 2.155 . 0 0 "[ . 1 . 2]" 1
1064 1 47 PHE QE 1 68 ARG HB3 . . 4.100 3.477 3.402 3.648 . 0 0 "[ . 1 . 2]" 1
1065 1 47 PHE QE 1 68 ARG HD2 . . 4.550 2.242 1.990 3.637 . 0 0 "[ . 1 . 2]" 1
1066 1 47 PHE QE 1 68 ARG QD . . 3.820 2.214 1.975 3.423 . 0 0 "[ . 1 . 2]" 1
1067 1 47 PHE QE 1 68 ARG HD3 . . 4.550 3.663 3.220 4.172 . 0 0 "[ . 1 . 2]" 1
1068 1 47 PHE QE 1 68 ARG HE . . 5.020 3.481 2.114 4.361 . 0 0 "[ . 1 . 2]" 1
1069 1 47 PHE QE 1 68 ARG HG3 . . 4.300 2.724 2.630 3.013 . 0 0 "[ . 1 . 2]" 1
1070 1 47 PHE QE 1 70 LEU QD . . 5.440 5.062 4.793 5.420 . 0 0 "[ . 1 . 2]" 1
1071 1 47 PHE QE 1 103 GLY HA2 . . 4.860 4.627 3.857 4.871 0.011 18 0 "[ . 1 . 2]" 1
1072 1 47 PHE QE 1 103 GLY HA3 . . 4.320 4.026 3.623 4.324 0.004 7 0 "[ . 1 . 2]" 1
1073 1 47 PHE HZ 1 68 ARG HD2 . . 5.160 2.817 2.036 4.791 . 0 0 "[ . 1 . 2]" 1
1074 1 47 PHE HZ 1 68 ARG HD3 . . 5.160 4.225 3.715 4.942 . 0 0 "[ . 1 . 2]" 1
1075 1 47 PHE HZ 1 68 ARG HE . . 5.280 3.090 1.940 4.330 . 0 0 "[ . 1 . 2]" 1
1076 1 47 PHE HZ 1 68 ARG HG2 . . 4.940 4.588 4.303 4.945 0.005 2 0 "[ . 1 . 2]" 1
1077 1 48 ILE H 1 48 ILE HB . . 3.240 2.516 2.418 2.648 . 0 0 "[ . 1 . 2]" 1
1078 1 48 ILE H 1 48 ILE MD . . 3.890 3.451 3.127 3.826 . 0 0 "[ . 1 . 2]" 1
1079 1 48 ILE H 1 48 ILE HG12 . . 3.860 3.555 3.175 3.862 0.002 5 0 "[ . 1 . 2]" 1
1080 1 48 ILE H 1 48 ILE HG13 . . 3.800 2.199 1.894 2.528 . 0 0 "[ . 1 . 2]" 1
1081 1 48 ILE H 1 48 ILE MG . . 3.860 3.761 3.746 3.802 . 0 0 "[ . 1 . 2]" 1
1082 1 48 ILE H 1 49 SER H . . 4.840 4.561 4.449 4.631 . 0 0 "[ . 1 . 2]" 1
1083 1 48 ILE H 1 65 VAL HA . . 5.500 4.730 4.335 5.331 . 0 0 "[ . 1 . 2]" 1
1084 1 48 ILE H 1 67 LEU H . . 4.440 4.001 3.689 4.282 . 0 0 "[ . 1 . 2]" 1
1085 1 48 ILE H 1 68 ARG HA . . 4.450 3.613 3.339 3.937 . 0 0 "[ . 1 . 2]" 1
1086 1 48 ILE H 1 69 LEU H . . 4.490 3.959 3.581 4.384 . 0 0 "[ . 1 . 2]" 1
1087 1 48 ILE H 1 69 LEU MD2 . . 4.130 3.295 2.987 3.647 . 0 0 "[ . 1 . 2]" 1
1088 1 48 ILE HA 1 48 ILE MD . . 4.040 3.848 3.785 3.911 . 0 0 "[ . 1 . 2]" 1
1089 1 48 ILE HA 1 48 ILE HG12 . . 3.800 2.624 2.454 2.816 . 0 0 "[ . 1 . 2]" 1
1090 1 48 ILE HA 1 48 ILE HG13 . . 4.000 2.862 2.617 3.074 . 0 0 "[ . 1 . 2]" 1
1091 1 48 ILE HA 1 48 ILE MG . . 3.280 2.451 2.291 2.501 . 0 0 "[ . 1 . 2]" 1
1092 1 48 ILE HA 1 49 SER H . . 3.240 2.174 2.140 2.245 . 0 0 "[ . 1 . 2]" 1
1093 1 48 ILE HA 1 49 SER QB . . 4.490 4.110 3.982 4.399 . 0 0 "[ . 1 . 2]" 1
1094 1 48 ILE HA 1 50 LYS H . . 4.040 3.609 3.470 3.820 . 0 0 "[ . 1 . 2]" 1
1095 1 48 ILE HA 1 69 LEU HG . . 5.410 5.359 5.179 5.442 0.032 8 0 "[ . 1 . 2]" 1
1096 1 48 ILE HB 1 48 ILE MD . . 3.410 2.313 2.134 2.507 . 0 0 "[ . 1 . 2]" 1
1097 1 48 ILE HB 1 50 LYS H . . 5.080 4.517 4.307 4.660 . 0 0 "[ . 1 . 2]" 1
1098 1 48 ILE HB 1 51 VAL QG . . 4.420 3.906 3.625 4.319 . 0 0 "[ . 1 . 2]" 1
1099 1 48 ILE HB 1 65 VAL HA . . 3.750 2.364 2.021 2.847 . 0 0 "[ . 1 . 2]" 1
1100 1 48 ILE HB 1 65 VAL MG1 . . 4.920 3.770 3.354 4.930 0.010 15 0 "[ . 1 . 2]" 1
1101 1 48 ILE HB 1 65 VAL QG . . 4.140 3.433 3.219 3.772 . 0 0 "[ . 1 . 2]" 1
1102 1 48 ILE HB 1 65 VAL MG2 . . 4.920 4.156 3.785 4.805 . 0 0 "[ . 1 . 2]" 1
1103 1 48 ILE HB 1 66 GLY H . . 3.560 1.910 1.850 2.058 . 0 0 "[ . 1 . 2]" 1
1104 1 48 ILE HB 1 67 LEU H . . 3.520 2.956 2.740 3.176 . 0 0 "[ . 1 . 2]" 1
1105 1 48 ILE HB 1 67 LEU HB3 . . 5.500 5.527 5.510 5.550 0.050 18 0 "[ . 1 . 2]" 1
1106 1 48 ILE HB 1 69 LEU MD2 . . 5.040 4.146 4.036 4.273 . 0 0 "[ . 1 . 2]" 1
1107 1 48 ILE MD 1 49 SER H . . 5.350 5.063 4.825 5.260 . 0 0 "[ . 1 . 2]" 1
1108 1 48 ILE MD 1 50 LYS H . . 5.500 5.093 4.767 5.446 . 0 0 "[ . 1 . 2]" 1
1109 1 48 ILE MD 1 51 VAL QG . . 2.960 2.849 2.530 3.080 0.120 6 0 "[ . 1 . 2]" 1
1110 1 48 ILE MD 1 63 LEU HA . . 3.960 3.642 3.059 3.940 . 0 0 "[ . 1 . 2]" 1
1111 1 48 ILE MD 1 63 LEU HB3 . . 4.630 4.437 4.261 4.614 . 0 0 "[ . 1 . 2]" 1
1112 1 48 ILE MD 1 63 LEU MD1 . . 2.440 1.743 1.609 1.906 . 0 0 "[ . 1 . 2]" 1
1113 1 48 ILE MD 1 63 LEU MD2 . . 3.090 1.849 1.628 2.313 . 0 0 "[ . 1 . 2]" 1
1114 1 48 ILE MD 1 64 ARG H . . 4.040 2.832 2.389 3.089 . 0 0 "[ . 1 . 2]" 1
1115 1 48 ILE MD 1 64 ARG HA . . 5.040 4.129 3.779 4.572 . 0 0 "[ . 1 . 2]" 1
1116 1 48 ILE MD 1 65 VAL HA . . 4.540 3.344 3.213 3.500 . 0 0 "[ . 1 . 2]" 1
1117 1 48 ILE MD 1 67 LEU H . . 3.640 2.764 2.336 3.218 . 0 0 "[ . 1 . 2]" 1
1118 1 48 ILE MD 1 67 LEU HA . . 4.760 4.400 4.091 4.740 . 0 0 "[ . 1 . 2]" 1
1119 1 48 ILE MD 1 67 LEU HB2 . . 3.270 2.058 1.918 2.313 . 0 0 "[ . 1 . 2]" 1
1120 1 48 ILE MD 1 67 LEU HB3 . . 3.730 3.450 3.131 3.610 . 0 0 "[ . 1 . 2]" 1
1121 1 48 ILE MD 1 68 ARG H . . 5.500 5.147 4.688 5.517 0.017 9 0 "[ . 1 . 2]" 1
1122 1 48 ILE MD 1 101 CYS H . . 5.500 5.313 4.639 5.515 0.015 1 0 "[ . 1 . 2]" 1
1123 1 48 ILE HG12 1 48 ILE MG . . 2.930 2.257 2.164 2.357 . 0 0 "[ . 1 . 2]" 1
1124 1 48 ILE HG12 1 49 SER H . . 4.850 4.324 4.089 4.477 . 0 0 "[ . 1 . 2]" 1
1125 1 48 ILE HG12 1 50 LYS H . . 5.240 4.858 4.591 5.205 . 0 0 "[ . 1 . 2]" 1
1126 1 48 ILE HG12 1 51 VAL QG . . 4.720 3.916 3.412 4.738 0.018 9 0 "[ . 1 . 2]" 1
1127 1 48 ILE HG12 1 69 LEU MD2 . . 3.520 2.543 2.093 2.944 . 0 0 "[ . 1 . 2]" 1
1128 1 48 ILE HG13 1 49 SER H . . 5.310 4.888 4.654 5.079 . 0 0 "[ . 1 . 2]" 1
1129 1 48 ILE HG13 1 65 VAL HA . . 5.100 4.774 4.546 5.103 0.003 4 0 "[ . 1 . 2]" 1
1130 1 48 ILE HG13 1 66 GLY H . . 4.660 4.121 3.746 4.533 . 0 0 "[ . 1 . 2]" 1
1131 1 48 ILE HG13 1 67 LEU H . . 4.910 4.184 3.671 4.622 . 0 0 "[ . 1 . 2]" 1
1132 1 48 ILE HG13 1 69 LEU H . . 5.120 4.225 3.933 4.513 . 0 0 "[ . 1 . 2]" 1
1133 1 48 ILE HG13 1 69 LEU MD2 . . 3.750 1.977 1.913 2.160 . 0 0 "[ . 1 . 2]" 1
1134 1 48 ILE MG 1 49 SER H . . 3.610 2.459 2.041 2.784 . 0 0 "[ . 1 . 2]" 1
1135 1 48 ILE MG 1 49 SER HB2 . . 5.090 4.988 4.792 5.125 0.035 2 0 "[ . 1 . 2]" 1
1136 1 48 ILE MG 1 49 SER HB3 . . 5.090 4.497 4.160 4.791 . 0 0 "[ . 1 . 2]" 1
1137 1 48 ILE MG 1 50 LYS H . . 3.060 2.045 1.867 2.169 . 0 0 "[ . 1 . 2]" 1
1138 1 48 ILE MG 1 50 LYS HA . . 4.450 3.467 3.259 3.655 . 0 0 "[ . 1 . 2]" 1
1139 1 48 ILE MG 1 50 LYS HB2 . . 5.090 4.886 4.628 5.007 . 0 0 "[ . 1 . 2]" 1
1140 1 48 ILE MG 1 50 LYS HB3 . . 5.090 4.469 4.319 4.552 . 0 0 "[ . 1 . 2]" 1
1141 1 48 ILE MG 1 51 VAL QG . . 2.770 1.919 1.774 2.214 . 0 0 "[ . 1 . 2]" 1
1142 1 48 ILE MG 1 64 ARG H . . 4.450 4.253 4.050 4.478 0.028 20 0 "[ . 1 . 2]" 1
1143 1 48 ILE MG 1 64 ARG HA . . 4.700 4.083 3.636 4.625 . 0 0 "[ . 1 . 2]" 1
1144 1 48 ILE MG 1 65 VAL H . . 4.290 3.514 2.892 3.977 . 0 0 "[ . 1 . 2]" 1
1145 1 48 ILE MG 1 65 VAL HA . . 3.240 1.892 1.820 2.011 . 0 0 "[ . 1 . 2]" 1
1146 1 48 ILE MG 1 66 GLY H . . 3.570 3.111 2.804 3.344 . 0 0 "[ . 1 . 2]" 1
1147 1 48 ILE MG 1 67 LEU H . . 4.440 4.122 3.927 4.435 . 0 0 "[ . 1 . 2]" 1
1148 1 49 SER H 1 50 LYS H . . 2.960 1.998 1.842 2.203 . 0 0 "[ . 1 . 2]" 1
1149 1 49 SER H 1 65 VAL MG1 . . 5.500 4.070 3.579 5.539 0.039 19 0 "[ . 1 . 2]" 1
1150 1 49 SER H 1 65 VAL QG . . 4.500 3.614 3.411 4.108 . 0 0 "[ . 1 . 2]" 1
1151 1 49 SER H 1 65 VAL MG2 . . 5.500 4.374 3.730 5.499 . 0 0 "[ . 1 . 2]" 1
1152 1 49 SER HA 1 65 VAL QG . . 3.430 2.479 2.113 2.866 . 0 0 "[ . 1 . 2]" 1
1153 1 49 SER QB 1 50 LYS H . . 3.940 3.420 3.091 3.761 . 0 0 "[ . 1 . 2]" 1
1154 1 49 SER QB 1 50 LYS HA . . 5.340 4.983 4.844 5.129 . 0 0 "[ . 1 . 2]" 1
1155 1 49 SER QB 1 65 VAL QG . . 4.660 3.812 3.647 4.077 . 0 0 "[ . 1 . 2]" 1
1156 1 49 SER HB2 1 50 LYS H . . 4.640 4.280 4.073 4.399 . 0 0 "[ . 1 . 2]" 1
1157 1 49 SER HB3 1 50 LYS H . . 4.640 3.654 3.169 4.321 . 0 0 "[ . 1 . 2]" 1
1158 1 50 LYS H 1 50 LYS HB2 . . 3.750 3.637 3.466 3.767 0.017 3 0 "[ . 1 . 2]" 1
1159 1 50 LYS H 1 50 LYS HB3 . . 3.550 3.002 2.841 3.188 . 0 0 "[ . 1 . 2]" 1
1160 1 50 LYS H 1 50 LYS QD . . 5.410 5.028 4.757 5.308 . 0 0 "[ . 1 . 2]" 1
1161 1 50 LYS H 1 50 LYS HG2 . . 5.090 4.386 4.085 5.118 0.028 13 0 "[ . 1 . 2]" 1
1162 1 50 LYS H 1 50 LYS QG . . 4.420 4.051 3.864 4.260 . 0 0 "[ . 1 . 2]" 1
1163 1 50 LYS H 1 50 LYS HG3 . . 5.090 4.808 4.555 5.025 . 0 0 "[ . 1 . 2]" 1
1164 1 50 LYS H 1 51 VAL H . . 4.470 4.301 4.144 4.359 . 0 0 "[ . 1 . 2]" 1
1165 1 50 LYS H 1 51 VAL QG . . 4.290 3.528 3.326 4.002 . 0 0 "[ . 1 . 2]" 1
1166 1 50 LYS H 1 65 VAL HA . . 5.080 4.077 3.863 4.262 . 0 0 "[ . 1 . 2]" 1
1167 1 50 LYS H 1 65 VAL HB . . 5.500 5.183 3.110 5.558 0.058 10 0 "[ . 1 . 2]" 1
1168 1 50 LYS H 1 65 VAL MG1 . . 4.540 3.351 2.536 4.585 0.045 15 0 "[ . 1 . 2]" 1
1169 1 50 LYS H 1 65 VAL QG . . 3.930 2.763 2.486 3.776 . 0 0 "[ . 1 . 2]" 1
1170 1 50 LYS H 1 65 VAL MG2 . . 4.540 3.116 2.531 4.035 . 0 0 "[ . 1 . 2]" 1
1171 1 50 LYS HA 1 50 LYS QD . . 4.450 4.108 3.202 4.421 . 0 0 "[ . 1 . 2]" 1
1172 1 50 LYS HA 1 50 LYS QE . . 5.090 4.375 2.002 5.092 0.002 9 0 "[ . 1 . 2]" 1
1173 1 50 LYS HA 1 50 LYS HG2 . . 4.040 3.336 2.992 3.771 . 0 0 "[ . 1 . 2]" 1
1174 1 50 LYS HA 1 50 LYS QG . . 3.450 2.634 2.369 2.792 . 0 0 "[ . 1 . 2]" 1
1175 1 50 LYS HA 1 50 LYS HG3 . . 4.040 2.775 2.435 2.963 . 0 0 "[ . 1 . 2]" 1
1176 1 50 LYS HA 1 51 VAL H . . 2.670 2.324 2.203 2.443 . 0 0 "[ . 1 . 2]" 1
1177 1 50 LYS HA 1 51 VAL HB . . 5.000 4.534 4.337 4.890 . 0 0 "[ . 1 . 2]" 1
1178 1 50 LYS HA 1 51 VAL QG . . 3.940 3.352 3.131 3.811 . 0 0 "[ . 1 . 2]" 1
1179 1 50 LYS HA 1 65 VAL MG1 . . 3.780 2.679 1.878 3.534 . 0 0 "[ . 1 . 2]" 1
1180 1 50 LYS HA 1 65 VAL QG . . 2.910 1.891 1.711 2.674 . 0 0 "[ . 1 . 2]" 1
1181 1 50 LYS HA 1 65 VAL MG2 . . 3.780 2.052 1.767 3.382 . 0 0 "[ . 1 . 2]" 1
1182 1 50 LYS HB2 1 50 LYS QE . . 4.760 3.159 1.922 4.219 . 0 0 "[ . 1 . 2]" 1
1183 1 50 LYS HB2 1 51 VAL H . . 4.000 3.728 3.470 4.042 0.042 6 0 "[ . 1 . 2]" 1
1184 1 50 LYS HB2 1 65 VAL MG1 . . 5.500 4.107 3.367 4.704 . 0 0 "[ . 1 . 2]" 1
1185 1 50 LYS HB2 1 65 VAL QG . . 4.730 3.485 3.198 4.060 . 0 0 "[ . 1 . 2]" 1
1186 1 50 LYS HB2 1 65 VAL MG2 . . 5.500 3.856 3.562 4.525 . 0 0 "[ . 1 . 2]" 1
1187 1 50 LYS HB3 1 50 LYS QE . . 4.760 3.554 2.493 4.151 . 0 0 "[ . 1 . 2]" 1
1188 1 50 LYS HB3 1 51 VAL H . . 4.730 3.916 3.462 4.094 . 0 0 "[ . 1 . 2]" 1
1189 1 50 LYS HB3 1 65 VAL MG1 . . 5.500 4.782 4.025 5.397 . 0 0 "[ . 1 . 2]" 1
1190 1 50 LYS HB3 1 65 VAL MG2 . . 5.500 4.368 4.027 5.322 . 0 0 "[ . 1 . 2]" 1
1191 1 50 LYS QD 1 51 VAL H . . 4.640 4.075 3.758 4.459 . 0 0 "[ . 1 . 2]" 1
1192 1 50 LYS QD 1 65 VAL QG . . 5.440 4.696 3.810 5.439 . 0 0 "[ . 1 . 2]" 1
1193 1 50 LYS QE 1 50 LYS HG2 . . 3.600 2.951 2.135 3.499 . 0 0 "[ . 1 . 2]" 1
1194 1 50 LYS QE 1 50 LYS HG3 . . 3.600 2.496 2.165 3.259 . 0 0 "[ . 1 . 2]" 1
1195 1 50 LYS QE 1 51 VAL H . . 5.050 4.178 2.684 4.825 . 0 0 "[ . 1 . 2]" 1
1196 1 50 LYS QG 1 65 VAL QG . . 4.620 3.452 3.014 4.066 . 0 0 "[ . 1 . 2]" 1
1197 1 50 LYS HG2 1 51 VAL H . . 3.660 2.600 2.045 3.631 . 0 0 "[ . 1 . 2]" 1
1198 1 50 LYS HG3 1 51 VAL H . . 3.660 2.252 1.892 2.952 . 0 0 "[ . 1 . 2]" 1
1199 1 51 VAL H 1 51 VAL HB . . 3.730 3.033 2.747 3.723 . 0 0 "[ . 1 . 2]" 1
1200 1 51 VAL H 1 51 VAL MG1 . . 3.930 3.550 1.974 3.949 0.019 16 0 "[ . 1 . 2]" 1
1201 1 51 VAL H 1 51 VAL QG . . 3.150 2.779 1.966 3.099 . 0 0 "[ . 1 . 2]" 1
1202 1 51 VAL H 1 51 VAL MG2 . . 3.930 3.201 2.937 3.809 . 0 0 "[ . 1 . 2]" 1
1203 1 51 VAL H 1 65 VAL QG . . 3.160 2.586 2.183 3.170 0.010 19 0 "[ . 1 . 2]" 1
1204 1 51 VAL HA 1 51 VAL MG1 . . 3.220 2.550 2.339 3.147 . 0 0 "[ . 1 . 2]" 1
1205 1 51 VAL HA 1 51 VAL MG2 . . 3.220 2.404 2.187 2.603 . 0 0 "[ . 1 . 2]" 1
1206 1 51 VAL HA 1 52 SER H . . 2.750 2.148 2.139 2.171 . 0 0 "[ . 1 . 2]" 1
1207 1 51 VAL HA 1 52 SER QB . . 4.650 4.077 4.049 4.102 . 0 0 "[ . 1 . 2]" 1
1208 1 51 VAL HA 1 57 ALA MB . . 4.640 4.449 4.018 4.666 0.026 6 0 "[ . 1 . 2]" 1
1209 1 51 VAL HA 1 65 VAL QG . . 5.330 4.091 3.739 4.963 . 0 0 "[ . 1 . 2]" 1
1210 1 51 VAL HB 1 52 SER H . . 5.160 4.234 4.062 4.351 . 0 0 "[ . 1 . 2]" 1
1211 1 51 VAL HB 1 57 ALA MB . . 4.650 4.340 3.467 4.642 . 0 0 "[ . 1 . 2]" 1
1212 1 51 VAL HB 1 58 GLY HA2 . . 5.500 4.686 4.218 5.517 0.017 13 0 "[ . 1 . 2]" 1
1213 1 51 VAL QG 1 52 SER H . . 3.280 2.612 2.218 3.014 . 0 0 "[ . 1 . 2]" 1
1214 1 51 VAL QG 1 52 SER QB . . 4.150 3.701 3.483 3.893 . 0 0 "[ . 1 . 2]" 1
1215 1 51 VAL QG 1 53 PRO HA . . 4.510 4.050 3.668 4.304 . 0 0 "[ . 1 . 2]" 1
1216 1 51 VAL QG 1 55 GLY H . . 4.910 4.432 4.222 4.628 . 0 0 "[ . 1 . 2]" 1
1217 1 51 VAL QG 1 57 ALA H . . 4.720 4.010 3.845 4.138 . 0 0 "[ . 1 . 2]" 1
1218 1 51 VAL QG 1 57 ALA MB . . 2.990 2.030 1.860 2.224 . 0 0 "[ . 1 . 2]" 1
1219 1 51 VAL QG 1 58 GLY H . . 3.510 2.464 2.336 2.645 . 0 0 "[ . 1 . 2]" 1
1220 1 51 VAL QG 1 58 GLY HA2 . . 3.310 2.506 2.177 2.729 . 0 0 "[ . 1 . 2]" 1
1221 1 51 VAL QG 1 58 GLY HA3 . . 3.400 2.933 2.793 3.112 . 0 0 "[ . 1 . 2]" 1
1222 1 51 VAL QG 1 59 ARG H . . 4.950 4.622 4.451 4.802 . 0 0 "[ . 1 . 2]" 1
1223 1 51 VAL QG 1 63 LEU HA . . 5.330 4.402 4.011 4.670 . 0 0 "[ . 1 . 2]" 1
1224 1 51 VAL QG 1 63 LEU HB3 . . 3.990 3.079 2.780 3.463 . 0 0 "[ . 1 . 2]" 1
1225 1 51 VAL QG 1 63 LEU HG . . 4.170 3.409 3.095 3.622 . 0 0 "[ . 1 . 2]" 1
1226 1 51 VAL QG 1 64 ARG H . . 4.420 3.601 3.238 3.923 . 0 0 "[ . 1 . 2]" 1
1227 1 51 VAL QG 1 64 ARG HA . . 3.340 2.418 1.938 3.040 . 0 0 "[ . 1 . 2]" 1
1228 1 51 VAL QG 1 65 VAL H . . 3.710 2.740 2.100 3.268 . 0 0 "[ . 1 . 2]" 1
1229 1 51 VAL QG 1 65 VAL HA . . 4.020 2.931 2.573 3.167 . 0 0 "[ . 1 . 2]" 1
1230 1 51 VAL QG 1 65 VAL QG . . 3.100 2.090 1.737 2.977 . 0 0 "[ . 1 . 2]" 1
1231 1 51 VAL QG 1 66 GLY H . . 4.850 4.473 4.139 4.774 . 0 0 "[ . 1 . 2]" 1
1232 1 51 VAL MG1 1 57 ALA MB . . 4.220 2.426 1.874 4.100 . 0 0 "[ . 1 . 2]" 1
1233 1 51 VAL MG1 1 63 LEU HB3 . . 5.050 3.465 3.044 4.222 . 0 0 "[ . 1 . 2]" 1
1234 1 51 VAL MG1 1 63 LEU HG . . 4.820 4.010 3.586 4.832 0.012 13 0 "[ . 1 . 2]" 1
1235 1 51 VAL MG1 1 64 ARG HA . . 4.760 3.193 2.126 4.095 . 0 0 "[ . 1 . 2]" 1
1236 1 51 VAL MG1 1 65 VAL H . . 5.090 4.108 2.273 5.014 . 0 0 "[ . 1 . 2]" 1
1237 1 51 VAL MG2 1 57 ALA MB . . 4.220 3.025 1.951 3.395 . 0 0 "[ . 1 . 2]" 1
1238 1 51 VAL MG2 1 63 LEU HB3 . . 5.050 3.752 2.819 4.317 . 0 0 "[ . 1 . 2]" 1
1239 1 51 VAL MG2 1 63 LEU HG . . 4.820 3.785 3.154 4.092 . 0 0 "[ . 1 . 2]" 1
1240 1 51 VAL MG2 1 64 ARG HA . . 4.760 2.756 1.970 3.692 . 0 0 "[ . 1 . 2]" 1
1241 1 51 VAL MG2 1 65 VAL H . . 5.090 3.202 2.106 4.877 . 0 0 "[ . 1 . 2]" 1
1242 1 52 SER H 1 52 SER HB2 . . 3.110 2.422 2.238 2.661 . 0 0 "[ . 1 . 2]" 1
1243 1 52 SER H 1 52 SER HB3 . . 3.110 2.686 2.432 2.885 . 0 0 "[ . 1 . 2]" 1
1244 1 52 SER H 1 53 PRO HD2 . . 5.090 4.798 4.754 4.829 . 0 0 "[ . 1 . 2]" 1
1245 1 52 SER H 1 53 PRO HD3 . . 5.090 4.894 4.758 4.957 . 0 0 "[ . 1 . 2]" 1
1246 1 52 SER H 1 55 GLY H . . 4.790 4.644 4.366 4.797 0.007 19 0 "[ . 1 . 2]" 1
1247 1 52 SER H 1 57 ALA MB . . 5.100 4.667 4.287 5.061 . 0 0 "[ . 1 . 2]" 1
1248 1 52 SER HA 1 53 PRO HB3 . . 5.060 4.830 4.827 4.843 . 0 0 "[ . 1 . 2]" 1
1249 1 52 SER QB 1 53 PRO QG . . 5.340 4.678 4.534 4.802 . 0 0 "[ . 1 . 2]" 1
1250 1 52 SER QB 1 54 THR H . . 3.930 3.390 2.917 3.936 0.006 19 0 "[ . 1 . 2]" 1
1251 1 52 SER QB 1 55 GLY H . . 3.450 2.547 2.164 2.838 . 0 0 "[ . 1 . 2]" 1
1252 1 52 SER QB 1 55 GLY QA . . 3.980 2.596 2.258 2.944 . 0 0 "[ . 1 . 2]" 1
1253 1 52 SER QB 1 57 ALA MB . . 5.190 4.996 4.487 5.210 0.020 9 0 "[ . 1 . 2]" 1
1254 1 52 SER HB2 1 54 THR H . . 4.760 4.526 4.225 4.777 0.017 16 0 "[ . 1 . 2]" 1
1255 1 52 SER HB3 1 54 THR H . . 4.760 3.516 2.969 4.197 . 0 0 "[ . 1 . 2]" 1
1256 1 53 PRO HA 1 54 THR MG . . 5.090 4.562 4.403 4.754 . 0 0 "[ . 1 . 2]" 1
1257 1 53 PRO HA 1 55 GLY H . . 5.340 3.996 3.774 4.263 . 0 0 "[ . 1 . 2]" 1
1258 1 53 PRO HA 1 58 GLY H . . 5.030 4.670 4.208 4.979 . 0 0 "[ . 1 . 2]" 1
1259 1 53 PRO HA 1 58 GLY HA2 . . 4.080 3.665 2.897 4.025 . 0 0 "[ . 1 . 2]" 1
1260 1 53 PRO HA 1 58 GLY HA3 . . 3.830 2.550 1.987 2.935 . 0 0 "[ . 1 . 2]" 1
1261 1 53 PRO HA 1 59 ARG H . . 5.500 4.795 4.003 5.305 . 0 0 "[ . 1 . 2]" 1
1262 1 53 PRO HB2 1 54 THR H . . 3.910 3.457 3.172 3.830 . 0 0 "[ . 1 . 2]" 1
1263 1 53 PRO HB2 1 54 THR MG . . 3.700 3.214 2.859 3.727 0.027 6 0 "[ . 1 . 2]" 1
1264 1 53 PRO HB2 1 55 GLY H . . 5.500 5.141 4.916 5.492 . 0 0 "[ . 1 . 2]" 1
1265 1 53 PRO HB3 1 54 THR H . . 4.530 4.212 4.046 4.428 . 0 0 "[ . 1 . 2]" 1
1266 1 53 PRO HB3 1 54 THR MG . . 4.710 4.484 4.278 4.697 . 0 0 "[ . 1 . 2]" 1
1267 1 53 PRO QD 1 54 THR H . . 3.390 2.639 2.601 2.807 . 0 0 "[ . 1 . 2]" 1
1268 1 53 PRO QD 1 54 THR MG . . 4.130 3.496 2.868 3.864 . 0 0 "[ . 1 . 2]" 1
1269 1 53 PRO QG 1 54 THR H . . 3.660 2.516 2.167 3.044 . 0 0 "[ . 1 . 2]" 1
1270 1 53 PRO QG 1 54 THR MG . . 3.580 2.311 2.178 2.515 . 0 0 "[ . 1 . 2]" 1
1271 1 53 PRO QG 1 55 GLY H . . 5.080 4.577 4.287 4.927 . 0 0 "[ . 1 . 2]" 1
1272 1 54 THR H 1 54 THR MG . . 3.300 2.262 1.822 2.628 . 0 0 "[ . 1 . 2]" 1
1273 1 54 THR H 1 55 GLY H . . 2.930 2.282 2.011 2.458 . 0 0 "[ . 1 . 2]" 1
1274 1 54 THR H 1 55 GLY QA . . 4.460 4.101 3.887 4.282 . 0 0 "[ . 1 . 2]" 1
1275 1 54 THR HA 1 54 THR MG . . 3.260 2.586 2.422 3.133 . 0 0 "[ . 1 . 2]" 1
1276 1 54 THR HA 1 59 ARG H . . 5.500 4.875 4.140 5.356 . 0 0 "[ . 1 . 2]" 1
1277 1 54 THR HB 1 55 GLY H . . 5.090 4.324 3.994 4.533 . 0 0 "[ . 1 . 2]" 1
1278 1 54 THR MG 1 55 GLY H . . 4.060 3.856 2.912 4.077 0.017 3 0 "[ . 1 . 2]" 1
1279 1 55 GLY H 1 55 GLY QA . . 2.580 2.217 2.193 2.260 . 0 0 "[ . 1 . 2]" 1
1280 1 55 GLY H 1 56 ALA H . . 4.650 4.607 4.561 4.645 . 0 0 "[ . 1 . 2]" 1
1281 1 55 GLY H 1 57 ALA H . . 5.230 4.984 4.808 5.212 . 0 0 "[ . 1 . 2]" 1
1282 1 55 GLY H 1 57 ALA MB . . 5.380 5.292 5.112 5.407 0.027 17 0 "[ . 1 . 2]" 1
1283 1 55 GLY H 1 58 GLY H . . 4.390 3.947 3.645 4.335 . 0 0 "[ . 1 . 2]" 1
1284 1 55 GLY H 1 58 GLY HA3 . . 4.720 3.661 3.264 4.091 . 0 0 "[ . 1 . 2]" 1
1285 1 55 GLY H 1 59 ARG H . . 4.660 4.329 4.029 4.532 . 0 0 "[ . 1 . 2]" 1
1286 1 55 GLY H 1 59 ARG HG2 . . 5.500 5.387 5.132 5.493 . 0 0 "[ . 1 . 2]" 1
1287 1 55 GLY QA 1 56 ALA MB . . 4.300 3.791 3.765 3.803 . 0 0 "[ . 1 . 2]" 1
1288 1 55 GLY QA 1 57 ALA H . . 4.010 3.233 3.071 3.410 . 0 0 "[ . 1 . 2]" 1
1289 1 55 GLY QA 1 58 GLY H . . 5.340 3.477 3.327 3.774 . 0 0 "[ . 1 . 2]" 1
1290 1 55 GLY HA2 1 56 ALA H . . 3.100 2.377 2.227 2.561 . 0 0 "[ . 1 . 2]" 1
1291 1 55 GLY HA2 1 56 ALA MB . . 4.910 4.157 4.094 4.228 . 0 0 "[ . 1 . 2]" 1
1292 1 55 GLY HA2 1 57 ALA H . . 4.560 4.254 3.997 4.492 . 0 0 "[ . 1 . 2]" 1
1293 1 55 GLY HA3 1 56 ALA H . . 3.100 2.776 2.565 2.982 . 0 0 "[ . 1 . 2]" 1
1294 1 55 GLY HA3 1 56 ALA MB . . 4.910 4.376 4.244 4.446 . 0 0 "[ . 1 . 2]" 1
1295 1 55 GLY HA3 1 57 ALA H . . 4.560 3.351 3.188 3.556 . 0 0 "[ . 1 . 2]" 1
1296 1 56 ALA H 1 56 ALA MB . . 2.830 2.199 2.044 2.261 . 0 0 "[ . 1 . 2]" 1
1297 1 56 ALA H 1 57 ALA H . . 3.330 2.802 2.640 2.945 . 0 0 "[ . 1 . 2]" 1
1298 1 56 ALA H 1 57 ALA MB . . 4.760 4.409 4.258 4.545 . 0 0 "[ . 1 . 2]" 1
1299 1 56 ALA H 1 58 GLY H . . 5.010 4.749 4.626 4.960 . 0 0 "[ . 1 . 2]" 1
1300 1 56 ALA H 1 59 ARG H . . 5.330 5.044 4.941 5.133 . 0 0 "[ . 1 . 2]" 1
1301 1 56 ALA H 1 59 ARG QD . . 5.340 4.805 3.257 5.389 0.049 15 0 "[ . 1 . 2]" 1
1302 1 56 ALA HA 1 59 ARG H . . 4.900 4.061 3.864 4.317 . 0 0 "[ . 1 . 2]" 1
1303 1 56 ALA HA 1 59 ARG HD2 . . 4.300 3.985 3.655 4.299 . 0 0 "[ . 1 . 2]" 1
1304 1 56 ALA HA 1 59 ARG QD . . 3.770 2.922 1.961 3.505 . 0 0 "[ . 1 . 2]" 1
1305 1 56 ALA HA 1 59 ARG HD3 . . 4.300 3.071 1.969 3.749 . 0 0 "[ . 1 . 2]" 1
1306 1 56 ALA HA 1 59 ARG HE . . 4.360 2.461 1.890 3.957 . 0 0 "[ . 1 . 2]" 1
1307 1 56 ALA HA 1 59 ARG HG2 . . 3.550 2.379 1.996 2.711 . 0 0 "[ . 1 . 2]" 1
1308 1 56 ALA HA 1 59 ARG QH1 . . 5.090 3.947 3.214 4.495 . 0 0 "[ . 1 . 2]" 1
1309 1 56 ALA MB 1 57 ALA H . . 3.530 2.665 2.492 2.759 . 0 0 "[ . 1 . 2]" 1
1310 1 56 ALA MB 1 59 ARG H . . 5.340 4.978 4.838 5.160 . 0 0 "[ . 1 . 2]" 1
1311 1 56 ALA MB 1 59 ARG HE . . 5.020 3.376 2.884 5.033 0.013 12 0 "[ . 1 . 2]" 1
1312 1 56 ALA MB 1 59 ARG QH1 . . 5.090 4.574 3.976 5.060 . 0 0 "[ . 1 . 2]" 1
1313 1 56 ALA MB 1 59 ARG QH2 . . 5.090 3.199 2.124 5.106 0.016 12 0 "[ . 1 . 2]" 1
1314 1 56 ALA MB 1 60 ASP H . . 5.340 4.808 4.605 5.080 . 0 0 "[ . 1 . 2]" 1
1315 1 56 ALA MB 1 60 ASP HB2 . . 5.230 4.303 3.884 4.850 . 0 0 "[ . 1 . 2]" 1
1316 1 57 ALA H 1 57 ALA MB . . 2.870 2.076 2.039 2.141 . 0 0 "[ . 1 . 2]" 1
1317 1 57 ALA H 1 58 GLY H . . 3.370 2.762 2.655 2.924 . 0 0 "[ . 1 . 2]" 1
1318 1 57 ALA H 1 58 GLY HA2 . . 5.380 5.302 5.207 5.409 0.029 11 0 "[ . 1 . 2]" 1
1319 1 57 ALA H 1 58 GLY HA3 . . 5.410 4.877 4.758 4.998 . 0 0 "[ . 1 . 2]" 1
1320 1 57 ALA H 1 59 ARG H . . 4.320 4.029 3.792 4.176 . 0 0 "[ . 1 . 2]" 1
1321 1 57 ALA H 1 60 ASP H . . 5.120 4.463 4.296 4.597 . 0 0 "[ . 1 . 2]" 1
1322 1 57 ALA H 1 60 ASP HB3 . . 5.500 5.272 4.951 5.525 0.025 6 0 "[ . 1 . 2]" 1
1323 1 57 ALA HA 1 59 ARG H . . 5.370 4.263 4.069 4.433 . 0 0 "[ . 1 . 2]" 1
1324 1 57 ALA HA 1 60 ASP H . . 3.860 3.173 3.041 3.330 . 0 0 "[ . 1 . 2]" 1
1325 1 57 ALA HA 1 60 ASP HA . . 5.500 4.758 4.571 5.090 . 0 0 "[ . 1 . 2]" 1
1326 1 57 ALA HA 1 60 ASP HB2 . . 4.000 2.511 2.272 2.922 . 0 0 "[ . 1 . 2]" 1
1327 1 57 ALA HA 1 60 ASP HB3 . . 3.830 2.634 2.292 2.924 . 0 0 "[ . 1 . 2]" 1
1328 1 57 ALA HA 1 61 GLY H . . 4.760 4.280 3.952 4.666 . 0 0 "[ . 1 . 2]" 1
1329 1 57 ALA HA 1 62 ARG H . . 5.500 5.060 4.782 5.502 0.002 6 0 "[ . 1 . 2]" 1
1330 1 57 ALA HA 1 63 LEU HB3 . . 4.020 3.128 2.832 3.695 . 0 0 "[ . 1 . 2]" 1
1331 1 57 ALA MB 1 58 GLY H . . 3.390 2.332 2.164 2.435 . 0 0 "[ . 1 . 2]" 1
1332 1 57 ALA MB 1 58 GLY HA2 . . 4.760 3.614 3.560 3.655 . 0 0 "[ . 1 . 2]" 1
1333 1 57 ALA MB 1 58 GLY HA3 . . 5.090 4.088 4.028 4.151 . 0 0 "[ . 1 . 2]" 1
1334 1 57 ALA MB 1 59 ARG H . . 4.630 4.341 4.191 4.447 . 0 0 "[ . 1 . 2]" 1
1335 1 57 ALA MB 1 60 ASP H . . 4.850 4.275 4.158 4.509 . 0 0 "[ . 1 . 2]" 1
1336 1 57 ALA MB 1 60 ASP HB2 . . 5.090 4.129 3.932 4.479 . 0 0 "[ . 1 . 2]" 1
1337 1 57 ALA MB 1 60 ASP HB3 . . 4.760 3.838 3.578 4.158 . 0 0 "[ . 1 . 2]" 1
1338 1 57 ALA MB 1 61 GLY H . . 4.850 4.723 4.454 4.902 0.052 17 0 "[ . 1 . 2]" 1
1339 1 57 ALA MB 1 62 ARG H . . 5.500 5.346 5.011 5.537 0.037 17 0 "[ . 1 . 2]" 1
1340 1 57 ALA MB 1 63 LEU H . . 4.430 4.075 3.827 4.362 . 0 0 "[ . 1 . 2]" 1
1341 1 57 ALA MB 1 63 LEU HB2 . . 4.000 2.661 2.312 2.881 . 0 0 "[ . 1 . 2]" 1
1342 1 57 ALA MB 1 63 LEU HB3 . . 3.930 1.925 1.818 2.056 . 0 0 "[ . 1 . 2]" 1
1343 1 57 ALA MB 1 63 LEU MD1 . . 2.740 2.270 1.960 2.666 . 0 0 "[ . 1 . 2]" 1
1344 1 57 ALA MB 1 63 LEU HG . . 3.510 1.962 1.769 2.256 . 0 0 "[ . 1 . 2]" 1
1345 1 58 GLY H 1 59 ARG H . . 3.250 2.983 2.843 3.086 . 0 0 "[ . 1 . 2]" 1
1346 1 58 GLY H 1 59 ARG HB3 . . 5.500 5.386 5.192 5.563 0.063 12 0 "[ . 1 . 2]" 1
1347 1 58 GLY H 1 59 ARG HG2 . . 5.160 4.559 4.227 4.696 . 0 0 "[ . 1 . 2]" 1
1348 1 58 GLY H 1 60 ASP H . . 4.720 4.133 3.989 4.492 . 0 0 "[ . 1 . 2]" 1
1349 1 58 GLY H 1 61 GLY H . . 5.500 5.487 5.429 5.532 0.032 9 0 "[ . 1 . 2]" 1
1350 1 58 GLY H 1 63 LEU HG . . 5.500 5.329 4.704 5.522 0.022 18 0 "[ . 1 . 2]" 1
1351 1 58 GLY HA2 1 61 GLY H . . 4.730 4.390 4.212 4.634 . 0 0 "[ . 1 . 2]" 1
1352 1 58 GLY HA3 1 59 ARG H . . 3.440 2.810 2.720 2.911 . 0 0 "[ . 1 . 2]" 1
1353 1 59 ARG H 1 59 ARG HB2 . . 3.620 3.616 3.592 3.639 0.019 8 0 "[ . 1 . 2]" 1
1354 1 59 ARG H 1 59 ARG HB3 . . 2.980 2.562 2.448 2.814 . 0 0 "[ . 1 . 2]" 1
1355 1 59 ARG H 1 59 ARG HD2 . . 4.910 4.675 3.651 4.921 0.011 9 0 "[ . 1 . 2]" 1
1356 1 59 ARG H 1 59 ARG QD . . 4.170 3.871 3.273 4.201 0.031 18 0 "[ . 1 . 2]" 1
1357 1 59 ARG H 1 59 ARG HD3 . . 4.910 4.143 3.698 4.573 . 0 0 "[ . 1 . 2]" 1
1358 1 59 ARG H 1 59 ARG HE . . 5.310 4.960 4.595 5.334 0.024 10 0 "[ . 1 . 2]" 1
1359 1 59 ARG H 1 59 ARG HG2 . . 3.440 2.228 1.869 2.400 . 0 0 "[ . 1 . 2]" 1
1360 1 59 ARG H 1 59 ARG HG3 . . 3.690 3.322 2.931 3.507 . 0 0 "[ . 1 . 2]" 1
1361 1 59 ARG H 1 60 ASP H . . 3.270 2.412 2.237 2.571 . 0 0 "[ . 1 . 2]" 1
1362 1 59 ARG H 1 60 ASP HB2 . . 5.080 4.634 4.450 4.822 . 0 0 "[ . 1 . 2]" 1
1363 1 59 ARG H 1 60 ASP HB3 . . 5.180 4.729 4.404 4.930 . 0 0 "[ . 1 . 2]" 1
1364 1 59 ARG H 1 61 GLY H . . 4.940 4.752 4.485 4.916 . 0 0 "[ . 1 . 2]" 1
1365 1 59 ARG HA 1 59 ARG HD2 . . 5.220 4.722 4.407 4.924 . 0 0 "[ . 1 . 2]" 1
1366 1 59 ARG HA 1 59 ARG QD . . 4.450 4.241 4.181 4.260 . 0 0 "[ . 1 . 2]" 1
1367 1 59 ARG HA 1 59 ARG HD3 . . 5.220 4.865 4.558 5.325 0.105 12 0 "[ . 1 . 2]" 1
1368 1 59 ARG HA 1 59 ARG HG2 . . 3.950 3.802 3.614 3.936 . 0 0 "[ . 1 . 2]" 1
1369 1 59 ARG HA 1 59 ARG HG3 . . 4.010 3.704 3.610 3.938 . 0 0 "[ . 1 . 2]" 1
1370 1 59 ARG HA 1 60 ASP HA . . 5.500 4.898 4.834 4.962 . 0 0 "[ . 1 . 2]" 1
1371 1 59 ARG HA 1 61 GLY H . . 5.090 4.755 4.371 5.066 . 0 0 "[ . 1 . 2]" 1
1372 1 59 ARG HB2 1 59 ARG HD2 . . 4.200 2.579 2.249 3.012 . 0 0 "[ . 1 . 2]" 1
1373 1 59 ARG HB2 1 59 ARG QD . . 3.600 2.386 2.198 2.923 . 0 0 "[ . 1 . 2]" 1
1374 1 59 ARG HB2 1 59 ARG HD3 . . 4.200 3.036 2.309 3.946 . 0 0 "[ . 1 . 2]" 1
1375 1 59 ARG HB2 1 59 ARG HE . . 4.760 4.257 2.926 4.603 . 0 0 "[ . 1 . 2]" 1
1376 1 59 ARG HB2 1 60 ASP H . . 4.300 3.987 3.750 4.159 . 0 0 "[ . 1 . 2]" 1
1377 1 59 ARG HB3 1 59 ARG HD2 . . 4.080 3.027 2.055 3.681 . 0 0 "[ . 1 . 2]" 1
1378 1 59 ARG HB3 1 59 ARG HD3 . . 4.080 2.675 2.347 3.350 . 0 0 "[ . 1 . 2]" 1
1379 1 59 ARG HB3 1 59 ARG HE . . 4.640 4.411 3.569 4.751 0.111 10 0 "[ . 1 . 2]" 1
1380 1 59 ARG HB3 1 60 ASP H . . 4.240 3.961 3.679 4.165 . 0 0 "[ . 1 . 2]" 1
1381 1 59 ARG QD 1 59 ARG QH2 . . 3.780 3.616 3.610 3.651 . 0 0 "[ . 1 . 2]" 1
1382 1 59 ARG HD2 1 59 ARG QH1 . . 4.450 2.481 1.899 3.351 . 0 0 "[ . 1 . 2]" 1
1383 1 59 ARG HD2 1 59 ARG QH2 . . 4.370 4.090 4.001 4.226 . 0 0 "[ . 1 . 2]" 1
1384 1 59 ARG HD3 1 59 ARG QH1 . . 4.450 2.116 1.784 2.609 . 0 0 "[ . 1 . 2]" 1
1385 1 59 ARG HD3 1 59 ARG QH2 . . 4.370 4.034 3.986 4.109 . 0 0 "[ . 1 . 2]" 1
1386 1 59 ARG HG2 1 59 ARG QH2 . . 5.340 4.574 4.002 5.310 . 0 0 "[ . 1 . 2]" 1
1387 1 59 ARG HG2 1 60 ASP H . . 4.560 2.665 2.075 3.099 . 0 0 "[ . 1 . 2]" 1
1388 1 59 ARG HG2 1 60 ASP HA . . 5.140 4.388 4.093 4.820 . 0 0 "[ . 1 . 2]" 1
1389 1 59 ARG HG2 1 60 ASP HB2 . . 5.050 4.226 3.686 4.722 . 0 0 "[ . 1 . 2]" 1
1390 1 59 ARG HG2 1 60 ASP HB3 . . 5.360 5.091 4.719 5.379 0.019 18 0 "[ . 1 . 2]" 1
1391 1 59 ARG HG3 1 59 ARG QH2 . . 5.090 4.546 4.238 4.845 . 0 0 "[ . 1 . 2]" 1
1392 1 59 ARG HG3 1 60 ASP H . . 4.720 2.605 2.156 3.218 . 0 0 "[ . 1 . 2]" 1
1393 1 59 ARG HG3 1 60 ASP HA . . 5.340 3.147 2.908 3.673 . 0 0 "[ . 1 . 2]" 1
1394 1 59 ARG HG3 1 60 ASP HB3 . . 5.500 4.822 4.244 5.392 . 0 0 "[ . 1 . 2]" 1
1395 1 60 ASP H 1 60 ASP HB2 . . 3.390 2.459 2.323 2.657 . 0 0 "[ . 1 . 2]" 1
1396 1 60 ASP H 1 60 ASP HB3 . . 3.380 2.624 2.420 2.816 . 0 0 "[ . 1 . 2]" 1
1397 1 60 ASP H 1 61 GLY H . . 3.270 3.069 2.881 3.218 . 0 0 "[ . 1 . 2]" 1
1398 1 60 ASP H 1 61 GLY QA . . 5.230 4.664 4.545 4.754 . 0 0 "[ . 1 . 2]" 1
1399 1 60 ASP HA 1 61 GLY QA . . 5.340 4.268 4.250 4.288 . 0 0 "[ . 1 . 2]" 1
1400 1 60 ASP HA 1 62 ARG H . . 5.340 4.398 4.197 4.561 . 0 0 "[ . 1 . 2]" 1
1401 1 60 ASP HA 1 62 ARG QG . . 5.500 4.877 4.421 5.359 . 0 0 "[ . 1 . 2]" 1
1402 1 60 ASP HB2 1 61 GLY H . . 3.870 3.606 3.459 3.844 . 0 0 "[ . 1 . 2]" 1
1403 1 60 ASP HB2 1 62 ARG H . . 4.510 4.176 4.085 4.265 . 0 0 "[ . 1 . 2]" 1
1404 1 60 ASP HB2 1 62 ARG HB2 . . 5.500 5.334 5.087 5.510 0.010 18 0 "[ . 1 . 2]" 1
1405 1 60 ASP HB2 1 62 ARG QG . . 5.500 5.037 4.751 5.508 0.008 11 0 "[ . 1 . 2]" 1
1406 1 60 ASP HB3 1 61 GLY H . . 3.460 2.132 1.992 2.428 . 0 0 "[ . 1 . 2]" 1
1407 1 60 ASP HB3 1 62 ARG H . . 4.290 2.692 2.426 2.986 . 0 0 "[ . 1 . 2]" 1
1408 1 60 ASP HB3 1 62 ARG HB2 . . 4.910 4.284 4.101 4.540 . 0 0 "[ . 1 . 2]" 1
1409 1 60 ASP HB3 1 62 ARG QG . . 5.100 4.222 3.863 4.876 . 0 0 "[ . 1 . 2]" 1
1410 1 60 ASP HB3 1 63 LEU HB2 . . 4.910 3.688 3.226 4.169 . 0 0 "[ . 1 . 2]" 1
1411 1 61 GLY H 1 62 ARG H . . 3.520 2.338 2.112 2.589 . 0 0 "[ . 1 . 2]" 1
1412 1 61 GLY H 1 62 ARG HB2 . . 5.260 4.875 4.670 5.180 . 0 0 "[ . 1 . 2]" 1
1413 1 61 GLY H 1 62 ARG QG . . 4.990 4.219 3.976 4.572 . 0 0 "[ . 1 . 2]" 1
1414 1 61 GLY H 1 63 LEU H . . 4.430 3.249 2.743 4.098 . 0 0 "[ . 1 . 2]" 1
1415 1 61 GLY H 1 63 LEU HB2 . . 5.500 4.857 4.478 5.339 . 0 0 "[ . 1 . 2]" 1
1416 1 61 GLY QA 1 62 ARG HA . . 5.050 4.008 4.003 4.013 . 0 0 "[ . 1 . 2]" 1
1417 1 61 GLY QA 1 62 ARG QG . . 4.560 3.503 3.354 3.634 . 0 0 "[ . 1 . 2]" 1
1418 1 61 GLY QA 1 63 LEU H . . 5.100 4.282 3.581 5.089 . 0 0 "[ . 1 . 2]" 1
1419 1 62 ARG H 1 62 ARG HB2 . . 3.240 2.694 2.514 2.810 . 0 0 "[ . 1 . 2]" 1
1420 1 62 ARG H 1 62 ARG HD2 . . 4.910 4.702 4.303 4.918 0.008 15 0 "[ . 1 . 2]" 1
1421 1 62 ARG H 1 62 ARG HD3 . . 4.910 4.744 4.568 4.897 . 0 0 "[ . 1 . 2]" 1
1422 1 62 ARG H 1 62 ARG HE . . 3.720 3.308 2.958 3.579 . 0 0 "[ . 1 . 2]" 1
1423 1 62 ARG H 1 62 ARG QG . . 2.860 2.263 1.984 2.527 . 0 0 "[ . 1 . 2]" 1
1424 1 62 ARG H 1 63 LEU H . . 3.080 2.248 1.972 2.629 . 0 0 "[ . 1 . 2]" 1
1425 1 62 ARG H 1 63 LEU HA . . 5.500 4.885 4.674 5.151 . 0 0 "[ . 1 . 2]" 1
1426 1 62 ARG H 1 63 LEU HB3 . . 5.310 4.598 4.274 4.808 . 0 0 "[ . 1 . 2]" 1
1427 1 62 ARG HA 1 62 ARG HD2 . . 4.880 4.152 3.921 4.482 . 0 0 "[ . 1 . 2]" 1
1428 1 62 ARG HA 1 62 ARG QD . . 4.130 3.242 2.949 4.134 0.004 11 0 "[ . 1 . 2]" 1
1429 1 62 ARG HA 1 62 ARG HD3 . . 4.880 3.422 3.034 4.856 . 0 0 "[ . 1 . 2]" 1
1430 1 62 ARG HA 1 62 ARG HE . . 4.760 2.428 1.987 4.774 0.014 11 0 "[ . 1 . 2]" 1
1431 1 62 ARG HA 1 62 ARG QG . . 3.620 2.910 2.505 3.055 . 0 0 "[ . 1 . 2]" 1
1432 1 62 ARG HA 1 63 LEU HA . . 5.500 4.702 4.482 4.879 . 0 0 "[ . 1 . 2]" 1
1433 1 62 ARG HB2 1 62 ARG QD . . 3.680 3.264 2.518 3.394 . 0 0 "[ . 1 . 2]" 1
1434 1 62 ARG HB2 1 62 ARG HE . . 4.110 3.813 2.199 4.074 . 0 0 "[ . 1 . 2]" 1
1435 1 62 ARG HB2 1 63 LEU H . . 3.840 2.737 1.898 3.749 . 0 0 "[ . 1 . 2]" 1
1436 1 62 ARG HB2 1 63 LEU HA . . 4.550 4.200 3.902 4.551 0.001 13 0 "[ . 1 . 2]" 1
1437 1 62 ARG HB3 1 62 ARG QD . . 3.470 2.248 2.136 2.493 . 0 0 "[ . 1 . 2]" 1
1438 1 62 ARG HB3 1 62 ARG HE . . 4.370 3.425 3.201 3.812 . 0 0 "[ . 1 . 2]" 1
1439 1 62 ARG HB3 1 63 LEU H . . 4.910 3.877 3.268 4.498 . 0 0 "[ . 1 . 2]" 1
1440 1 62 ARG HE 1 62 ARG QG . . 3.550 2.340 2.248 2.465 . 0 0 "[ . 1 . 2]" 1
1441 1 62 ARG HE 1 63 LEU H . . 5.240 4.765 3.964 5.127 . 0 0 "[ . 1 . 2]" 1
1442 1 62 ARG QG 1 63 LEU H . . 4.220 3.809 3.492 4.138 . 0 0 "[ . 1 . 2]" 1
1443 1 63 LEU H 1 63 LEU HB2 . . 2.820 2.430 2.163 2.842 0.022 19 0 "[ . 1 . 2]" 1
1444 1 63 LEU H 1 63 LEU HB3 . . 3.390 2.775 2.595 2.995 . 0 0 "[ . 1 . 2]" 1
1445 1 63 LEU H 1 63 LEU MD1 . . 5.130 4.210 4.041 4.373 . 0 0 "[ . 1 . 2]" 1
1446 1 63 LEU H 1 63 LEU MD2 . . 4.450 3.840 3.506 4.237 . 0 0 "[ . 1 . 2]" 1
1447 1 63 LEU H 1 64 ARG H . . 4.630 4.500 4.248 4.628 . 0 0 "[ . 1 . 2]" 1
1448 1 63 LEU HA 1 63 LEU MD1 . . 2.950 2.764 2.404 2.989 0.039 11 0 "[ . 1 . 2]" 1
1449 1 63 LEU HA 1 63 LEU MD2 . . 3.450 2.038 1.908 2.306 . 0 0 "[ . 1 . 2]" 1
1450 1 63 LEU HA 1 64 ARG H . . 2.900 2.167 2.140 2.238 . 0 0 "[ . 1 . 2]" 1
1451 1 63 LEU HA 1 64 ARG HG2 . . 5.500 4.221 3.600 5.061 . 0 0 "[ . 1 . 2]" 1
1452 1 63 LEU HA 1 64 ARG QG . . 4.690 3.648 3.313 4.138 . 0 0 "[ . 1 . 2]" 1
1453 1 63 LEU HA 1 64 ARG HG3 . . 5.500 4.347 3.370 5.534 0.034 19 0 "[ . 1 . 2]" 1
1454 1 63 LEU HA 1 67 LEU MD1 . . 4.540 2.289 1.950 3.628 . 0 0 "[ . 1 . 2]" 1
1455 1 63 LEU HA 1 67 LEU QD . . 3.150 2.179 1.948 2.776 . 0 0 "[ . 1 . 2]" 1
1456 1 63 LEU HA 1 67 LEU MD2 . . 4.540 4.265 2.882 4.559 0.019 15 0 "[ . 1 . 2]" 1
1457 1 63 LEU HB3 1 63 LEU MD1 . . 2.780 2.261 2.134 2.390 . 0 0 "[ . 1 . 2]" 1
1458 1 63 LEU HB3 1 63 LEU MD2 . . 3.260 3.184 3.166 3.196 . 0 0 "[ . 1 . 2]" 1
1459 1 63 LEU HB3 1 64 ARG H . . 4.250 3.963 3.637 4.198 . 0 0 "[ . 1 . 2]" 1
1460 1 63 LEU MD1 1 64 ARG H . . 3.510 2.128 1.865 2.528 . 0 0 "[ . 1 . 2]" 1
1461 1 63 LEU MD1 1 64 ARG HA . . 3.530 2.881 2.630 3.193 . 0 0 "[ . 1 . 2]" 1
1462 1 63 LEU MD2 1 64 ARG H . . 4.760 2.700 2.230 3.340 . 0 0 "[ . 1 . 2]" 1
1463 1 63 LEU MD2 1 67 LEU QD . . 3.070 2.304 1.910 3.070 0.000 18 0 "[ . 1 . 2]" 1
1464 1 63 LEU HG 1 64 ARG H . . 5.090 4.557 4.236 5.039 . 0 0 "[ . 1 . 2]" 1
1465 1 64 ARG H 1 64 ARG HB2 . . 4.180 3.593 2.849 4.027 . 0 0 "[ . 1 . 2]" 1
1466 1 64 ARG H 1 64 ARG QB . . 3.390 3.136 2.782 3.374 . 0 0 "[ . 1 . 2]" 1
1467 1 64 ARG H 1 64 ARG HB3 . . 4.180 3.658 3.170 3.974 . 0 0 "[ . 1 . 2]" 1
1468 1 64 ARG H 1 64 ARG QD . . 4.720 4.208 2.564 4.749 0.029 20 0 "[ . 1 . 2]" 1
1469 1 64 ARG H 1 64 ARG HG2 . . 4.080 3.280 2.431 4.053 . 0 0 "[ . 1 . 2]" 1
1470 1 64 ARG H 1 64 ARG HG3 . . 4.080 3.098 2.281 4.106 0.026 19 0 "[ . 1 . 2]" 1
1471 1 64 ARG H 1 65 VAL H . . 4.430 4.338 4.217 4.418 . 0 0 "[ . 1 . 2]" 1
1472 1 64 ARG H 1 67 LEU H . . 4.610 4.017 3.763 4.196 . 0 0 "[ . 1 . 2]" 1
1473 1 64 ARG H 1 67 LEU HB2 . . 3.600 3.539 3.228 3.661 0.061 15 0 "[ . 1 . 2]" 1
1474 1 64 ARG H 1 67 LEU QD . . 2.810 1.955 1.733 2.143 . 0 0 "[ . 1 . 2]" 1
1475 1 64 ARG H 1 67 LEU HG . . 4.840 3.339 2.192 4.884 0.044 18 0 "[ . 1 . 2]" 1
1476 1 64 ARG HA 1 64 ARG QD . . 4.460 3.949 2.448 4.490 0.030 12 0 "[ . 1 . 2]" 1
1477 1 64 ARG HA 1 65 VAL H . . 2.930 2.337 2.185 2.580 . 0 0 "[ . 1 . 2]" 1
1478 1 64 ARG HA 1 65 VAL HA . . 4.540 4.314 4.302 4.342 . 0 0 "[ . 1 . 2]" 1
1479 1 64 ARG HA 1 65 VAL HB . . 5.160 4.937 4.744 5.154 . 0 0 "[ . 1 . 2]" 1
1480 1 64 ARG HA 1 65 VAL QG . . 3.610 3.477 3.259 3.646 0.036 17 0 "[ . 1 . 2]" 1
1481 1 64 ARG HA 1 66 GLY H . . 5.500 5.402 5.129 5.523 0.023 19 0 "[ . 1 . 2]" 1
1482 1 64 ARG HA 1 67 LEU QD . . 4.420 4.140 3.807 4.404 . 0 0 "[ . 1 . 2]" 1
1483 1 64 ARG QB 1 64 ARG QD . . 3.120 2.209 2.037 2.539 . 0 0 "[ . 1 . 2]" 1
1484 1 64 ARG QB 1 65 VAL H . . 3.290 2.597 2.191 2.999 . 0 0 "[ . 1 . 2]" 1
1485 1 64 ARG QB 1 65 VAL QG . . 4.140 3.797 2.983 4.153 0.013 17 0 "[ . 1 . 2]" 1
1486 1 64 ARG QB 1 67 LEU QD . . 4.100 3.288 2.251 3.916 . 0 0 "[ . 1 . 2]" 1
1487 1 64 ARG HB2 1 64 ARG QD . . 3.620 2.577 2.082 3.404 . 0 0 "[ . 1 . 2]" 1
1488 1 64 ARG HB2 1 65 VAL H . . 4.040 2.970 2.478 3.848 . 0 0 "[ . 1 . 2]" 1
1489 1 64 ARG HB3 1 64 ARG QD . . 3.620 2.686 2.059 3.485 . 0 0 "[ . 1 . 2]" 1
1490 1 64 ARG HB3 1 65 VAL H . . 4.040 3.380 2.226 4.042 0.002 18 0 "[ . 1 . 2]" 1
1491 1 64 ARG QD 1 65 VAL H . . 5.030 4.364 3.300 5.095 0.065 19 0 "[ . 1 . 2]" 1
1492 1 64 ARG QD 1 67 LEU MD1 . . 4.940 3.567 1.967 4.945 0.005 20 0 "[ . 1 . 2]" 1
1493 1 64 ARG QD 1 67 LEU MD2 . . 4.940 4.029 2.200 4.956 0.016 4 0 "[ . 1 . 2]" 1
1494 1 64 ARG QG 1 65 VAL H . . 4.600 4.100 3.562 4.453 . 0 0 "[ . 1 . 2]" 1
1495 1 64 ARG QG 1 67 LEU QD . . 3.100 2.309 1.658 3.104 0.004 15 0 "[ . 1 . 2]" 1
1496 1 64 ARG HG2 1 67 LEU MD1 . . 5.500 3.026 1.853 4.587 . 0 0 "[ . 1 . 2]" 1
1497 1 64 ARG HG2 1 67 LEU MD2 . . 5.500 4.215 3.240 5.534 0.034 15 0 "[ . 1 . 2]" 1
1498 1 64 ARG HG3 1 67 LEU MD1 . . 5.500 2.737 1.885 3.811 . 0 0 "[ . 1 . 2]" 1
1499 1 64 ARG HG3 1 67 LEU MD2 . . 5.500 3.789 3.248 4.569 . 0 0 "[ . 1 . 2]" 1
1500 1 65 VAL H 1 65 VAL HB . . 3.060 2.639 2.428 2.926 . 0 0 "[ . 1 . 2]" 1
1501 1 65 VAL H 1 65 VAL MG1 . . 3.850 3.486 1.820 3.805 . 0 0 "[ . 1 . 2]" 1
1502 1 65 VAL H 1 65 VAL QG . . 2.820 1.967 1.816 2.321 . 0 0 "[ . 1 . 2]" 1
1503 1 65 VAL H 1 65 VAL MG2 . . 3.850 2.247 1.868 3.745 . 0 0 "[ . 1 . 2]" 1
1504 1 65 VAL H 1 66 GLY H . . 4.390 4.267 4.099 4.372 . 0 0 "[ . 1 . 2]" 1
1505 1 65 VAL H 1 67 LEU H . . 5.500 5.066 4.866 5.186 . 0 0 "[ . 1 . 2]" 1
1506 1 65 VAL HA 1 65 VAL MG1 . . 3.320 2.446 2.184 3.141 . 0 0 "[ . 1 . 2]" 1
1507 1 65 VAL HA 1 65 VAL MG2 . . 3.320 2.473 2.371 2.612 . 0 0 "[ . 1 . 2]" 1
1508 1 65 VAL HA 1 66 GLY H . . 2.850 2.201 2.164 2.282 . 0 0 "[ . 1 . 2]" 1
1509 1 65 VAL HA 1 66 GLY HA3 . . 4.640 4.440 4.415 4.486 . 0 0 "[ . 1 . 2]" 1
1510 1 65 VAL HA 1 67 LEU H . . 4.050 3.753 3.596 3.960 . 0 0 "[ . 1 . 2]" 1
1511 1 65 VAL HB 1 66 GLY H . . 4.540 4.387 4.229 4.486 . 0 0 "[ . 1 . 2]" 1
1512 1 65 VAL QG 1 66 GLY H . . 3.270 3.087 2.858 3.379 0.109 20 0 "[ . 1 . 2]" 1
1513 1 65 VAL QG 1 66 GLY HA2 . . 4.870 3.534 3.342 3.846 . 0 0 "[ . 1 . 2]" 1
1514 1 65 VAL QG 1 66 GLY HA3 . . 4.800 3.955 3.563 4.247 . 0 0 "[ . 1 . 2]" 1
1515 1 65 VAL QG 1 67 LEU H . . 4.680 4.509 4.340 4.666 . 0 0 "[ . 1 . 2]" 1
1516 1 65 VAL MG1 1 66 GLY H . . 4.480 3.341 2.908 4.364 . 0 0 "[ . 1 . 2]" 1
1517 1 65 VAL MG1 1 67 LEU H . . 5.500 4.890 4.583 5.397 . 0 0 "[ . 1 . 2]" 1
1518 1 65 VAL MG2 1 66 GLY H . . 4.480 4.096 3.125 4.368 . 0 0 "[ . 1 . 2]" 1
1519 1 65 VAL MG2 1 67 LEU H . . 5.500 5.375 4.773 5.524 0.024 16 0 "[ . 1 . 2]" 1
1520 1 66 GLY H 1 67 LEU H . . 3.410 1.943 1.784 2.192 . 0 0 "[ . 1 . 2]" 1
1521 1 66 GLY H 1 67 LEU HB2 . . 5.020 4.031 3.867 4.117 . 0 0 "[ . 1 . 2]" 1
1522 1 66 GLY H 1 67 LEU QD . . 5.440 4.179 3.264 4.652 . 0 0 "[ . 1 . 2]" 1
1523 1 67 LEU H 1 67 LEU HB2 . . 3.240 2.453 2.304 2.642 . 0 0 "[ . 1 . 2]" 1
1524 1 67 LEU H 1 67 LEU HB3 . . 3.670 3.595 3.559 3.635 . 0 0 "[ . 1 . 2]" 1
1525 1 67 LEU H 1 67 LEU MD1 . . 3.940 3.294 1.890 3.792 . 0 0 "[ . 1 . 2]" 1
1526 1 67 LEU H 1 67 LEU MD2 . . 3.940 3.558 2.587 4.006 0.066 18 0 "[ . 1 . 2]" 1
1527 1 67 LEU H 1 67 LEU HG . . 3.620 2.598 2.117 3.637 0.017 18 0 "[ . 1 . 2]" 1
1528 1 67 LEU H 1 68 ARG H . . 4.590 4.536 4.385 4.622 0.032 13 0 "[ . 1 . 2]" 1
1529 1 67 LEU H 1 102 ASP HA . . 5.460 5.397 4.926 5.480 0.020 3 0 "[ . 1 . 2]" 1
1530 1 67 LEU H 1 103 GLY H . . 4.780 4.595 4.012 4.784 0.004 8 0 "[ . 1 . 2]" 1
1531 1 67 LEU H 1 104 PHE H . . 5.500 5.176 4.573 5.501 0.001 16 0 "[ . 1 . 2]" 1
1532 1 67 LEU HA 1 67 LEU MD1 . . 4.300 3.733 2.869 3.930 . 0 0 "[ . 1 . 2]" 1
1533 1 67 LEU HA 1 67 LEU QD . . 2.980 2.327 1.960 2.875 . 0 0 "[ . 1 . 2]" 1
1534 1 67 LEU HA 1 67 LEU MD2 . . 4.300 2.478 1.965 3.757 . 0 0 "[ . 1 . 2]" 1
1535 1 67 LEU HA 1 68 ARG H . . 2.950 2.188 2.139 2.367 . 0 0 "[ . 1 . 2]" 1
1536 1 67 LEU HA 1 101 CYS H . . 4.430 3.638 3.368 3.908 . 0 0 "[ . 1 . 2]" 1
1537 1 67 LEU HA 1 103 GLY H . . 3.810 2.452 2.018 2.739 . 0 0 "[ . 1 . 2]" 1
1538 1 67 LEU HB2 1 67 LEU MD1 . . 3.260 2.220 2.038 2.500 . 0 0 "[ . 1 . 2]" 1
1539 1 67 LEU HB2 1 67 LEU MD2 . . 3.260 3.052 2.374 3.194 . 0 0 "[ . 1 . 2]" 1
1540 1 67 LEU HB2 1 68 ARG H . . 4.720 4.115 3.739 4.379 . 0 0 "[ . 1 . 2]" 1
1541 1 67 LEU HB2 1 100 VAL HB . . 4.240 3.021 2.724 3.368 . 0 0 "[ . 1 . 2]" 1
1542 1 67 LEU HB2 1 101 CYS H . . 4.510 4.165 3.675 4.486 . 0 0 "[ . 1 . 2]" 1
1543 1 67 LEU HB2 1 103 GLY H . . 5.500 5.265 4.611 5.510 0.010 17 0 "[ . 1 . 2]" 1
1544 1 67 LEU HB3 1 67 LEU MD1 . . 3.630 2.581 2.117 3.186 . 0 0 "[ . 1 . 2]" 1
1545 1 67 LEU HB3 1 67 LEU MD2 . . 3.630 2.248 2.023 2.530 . 0 0 "[ . 1 . 2]" 1
1546 1 67 LEU HB3 1 100 VAL HA . . 4.140 4.061 3.717 4.157 0.017 6 0 "[ . 1 . 2]" 1
1547 1 67 LEU HB3 1 100 VAL HB . . 3.830 1.996 1.973 2.118 . 0 0 "[ . 1 . 2]" 1
1548 1 67 LEU HB3 1 101 CYS H . . 3.610 2.490 1.947 2.767 . 0 0 "[ . 1 . 2]" 1
1549 1 67 LEU HB3 1 101 CYS QB . . 5.340 5.183 4.828 5.375 0.035 11 0 "[ . 1 . 2]" 1
1550 1 67 LEU HB3 1 103 GLY H . . 5.150 4.539 4.166 5.039 . 0 0 "[ . 1 . 2]" 1
1551 1 67 LEU QD 1 100 VAL H . . 5.440 4.929 4.676 5.127 . 0 0 "[ . 1 . 2]" 1
1552 1 67 LEU QD 1 100 VAL HA . . 5.440 4.468 4.104 4.718 . 0 0 "[ . 1 . 2]" 1
1553 1 67 LEU QD 1 100 VAL HB . . 3.700 2.928 2.162 3.193 . 0 0 "[ . 1 . 2]" 1
1554 1 67 LEU QD 1 101 CYS H . . 3.440 2.901 2.225 3.331 . 0 0 "[ . 1 . 2]" 1
1555 1 67 LEU QD 1 101 CYS HA . . 5.440 2.930 2.332 3.490 . 0 0 "[ . 1 . 2]" 1
1556 1 67 LEU QD 1 102 ASP H . . 4.810 2.992 2.670 3.546 . 0 0 "[ . 1 . 2]" 1
1557 1 67 LEU QD 1 102 ASP HA . . 3.130 2.072 1.818 2.981 . 0 0 "[ . 1 . 2]" 1
1558 1 67 LEU QD 1 102 ASP QB . . 3.900 3.415 2.981 3.905 0.005 18 0 "[ . 1 . 2]" 1
1559 1 67 LEU QD 1 103 GLY H . . 3.660 2.775 2.345 3.405 . 0 0 "[ . 1 . 2]" 1
1560 1 67 LEU MD1 1 100 VAL HB . . 4.620 3.490 2.688 4.584 . 0 0 "[ . 1 . 2]" 1
1561 1 67 LEU MD1 1 101 CYS H . . 4.450 4.174 3.673 4.498 0.048 7 0 "[ . 1 . 2]" 1
1562 1 67 LEU MD2 1 100 VAL HB . . 4.620 3.456 2.168 4.115 . 0 0 "[ . 1 . 2]" 1
1563 1 67 LEU MD2 1 101 CYS H . . 4.450 3.018 2.231 3.779 . 0 0 "[ . 1 . 2]" 1
1564 1 67 LEU HG 1 68 ARG H . . 5.360 4.890 3.895 5.371 0.011 2 0 "[ . 1 . 2]" 1
1565 1 67 LEU HG 1 101 CYS H . . 5.500 4.981 3.322 5.504 0.004 5 0 "[ . 1 . 2]" 1
1566 1 67 LEU HG 1 103 GLY H . . 5.020 4.169 2.668 4.941 . 0 0 "[ . 1 . 2]" 1
1567 1 68 ARG H 1 68 ARG HB2 . . 3.240 2.646 2.497 2.839 . 0 0 "[ . 1 . 2]" 1
1568 1 68 ARG H 1 68 ARG HB3 . . 3.330 2.512 2.447 2.589 . 0 0 "[ . 1 . 2]" 1
1569 1 68 ARG H 1 100 VAL HA . . 5.010 4.525 3.963 4.802 . 0 0 "[ . 1 . 2]" 1
1570 1 68 ARG H 1 100 VAL HB . . 4.320 3.890 3.451 4.119 . 0 0 "[ . 1 . 2]" 1
1571 1 68 ARG H 1 103 GLY HA3 . . 4.780 3.297 2.920 4.022 . 0 0 "[ . 1 . 2]" 1
1572 1 68 ARG HA 1 68 ARG HG2 . . 4.180 2.993 2.910 3.115 . 0 0 "[ . 1 . 2]" 1
1573 1 68 ARG HA 1 68 ARG HG3 . . 4.040 2.648 2.501 2.789 . 0 0 "[ . 1 . 2]" 1
1574 1 68 ARG HA 1 69 LEU H . . 3.090 2.144 2.141 2.166 . 0 0 "[ . 1 . 2]" 1
1575 1 68 ARG HA 1 69 LEU HB2 . . 4.760 4.220 4.214 4.236 . 0 0 "[ . 1 . 2]" 1
1576 1 68 ARG HA 1 69 LEU HB3 . . 5.500 5.549 5.538 5.560 0.060 3 0 "[ . 1 . 2]" 1
1577 1 68 ARG HA 1 70 LEU QD . . 5.440 4.577 4.195 5.370 . 0 0 "[ . 1 . 2]" 1
1578 1 68 ARG HB2 1 68 ARG QD . . 3.660 2.471 2.361 2.864 . 0 0 "[ . 1 . 2]" 1
1579 1 68 ARG HB2 1 68 ARG HE . . 4.720 4.304 3.105 4.696 . 0 0 "[ . 1 . 2]" 1
1580 1 68 ARG HB2 1 69 LEU H . . 4.640 4.318 4.190 4.399 . 0 0 "[ . 1 . 2]" 1
1581 1 68 ARG HB2 1 103 GLY H . . 5.500 5.212 4.874 5.507 0.007 13 0 "[ . 1 . 2]" 1
1582 1 68 ARG HB2 1 103 GLY HA2 . . 4.910 4.324 3.538 4.636 . 0 0 "[ . 1 . 2]" 1
1583 1 68 ARG HB2 1 103 GLY HA3 . . 4.910 3.554 3.197 3.870 . 0 0 "[ . 1 . 2]" 1
1584 1 68 ARG HB3 1 68 ARG QD . . 3.700 2.315 2.119 2.407 . 0 0 "[ . 1 . 2]" 1
1585 1 68 ARG HB3 1 68 ARG HE . . 5.020 4.412 3.876 4.695 . 0 0 "[ . 1 . 2]" 1
1586 1 68 ARG HB3 1 69 LEU H . . 4.360 4.254 4.138 4.332 . 0 0 "[ . 1 . 2]" 1
1587 1 68 ARG HB3 1 70 LEU QD . . 3.730 2.968 2.568 3.716 . 0 0 "[ . 1 . 2]" 1
1588 1 68 ARG HB3 1 100 VAL HA . . 5.350 4.568 4.359 4.736 . 0 0 "[ . 1 . 2]" 1
1589 1 68 ARG HB3 1 103 GLY HA2 . . 5.340 4.724 4.108 5.210 . 0 0 "[ . 1 . 2]" 1
1590 1 68 ARG HB3 1 103 GLY HA3 . . 5.090 4.392 4.047 4.854 . 0 0 "[ . 1 . 2]" 1
1591 1 68 ARG QD 1 70 LEU QD . . 3.840 2.531 2.165 3.091 . 0 0 "[ . 1 . 2]" 1
1592 1 68 ARG HE 1 68 ARG HG3 . . 4.150 2.492 2.198 3.203 . 0 0 "[ . 1 . 2]" 1
1593 1 68 ARG HE 1 70 LEU QD . . 4.440 3.885 2.824 4.438 . 0 0 "[ . 1 . 2]" 1
1594 1 68 ARG HG2 1 69 LEU H . . 4.240 3.141 2.859 3.463 . 0 0 "[ . 1 . 2]" 1
1595 1 68 ARG HG2 1 70 LEU QD . . 4.060 2.750 2.405 3.279 . 0 0 "[ . 1 . 2]" 1
1596 1 68 ARG HG3 1 69 LEU H . . 3.670 3.511 3.186 3.641 . 0 0 "[ . 1 . 2]" 1
1597 1 68 ARG HG3 1 70 LEU QD . . 4.560 4.080 3.817 4.457 . 0 0 "[ . 1 . 2]" 1
1598 1 68 ARG QH1 1 70 LEU QD . . 4.570 3.391 1.676 4.341 . 0 0 "[ . 1 . 2]" 1
1599 1 69 LEU H 1 69 LEU HB2 . . 3.570 2.116 2.109 2.128 . 0 0 "[ . 1 . 2]" 1
1600 1 69 LEU H 1 69 LEU HB3 . . 3.620 3.429 3.418 3.446 . 0 0 "[ . 1 . 2]" 1
1601 1 69 LEU H 1 69 LEU MD1 . . 4.640 4.175 4.108 4.239 . 0 0 "[ . 1 . 2]" 1
1602 1 69 LEU H 1 69 LEU MD2 . . 4.470 2.417 2.280 2.545 . 0 0 "[ . 1 . 2]" 1
1603 1 69 LEU H 1 69 LEU HG . . 4.240 3.998 3.937 4.064 . 0 0 "[ . 1 . 2]" 1
1604 1 69 LEU H 1 70 LEU H . . 4.930 4.379 4.315 4.451 . 0 0 "[ . 1 . 2]" 1
1605 1 69 LEU H 1 100 VAL MG1 . . 4.760 3.862 3.599 4.029 . 0 0 "[ . 1 . 2]" 1
1606 1 69 LEU HA 1 69 LEU MD1 . . 3.860 2.333 2.176 2.457 . 0 0 "[ . 1 . 2]" 1
1607 1 69 LEU HA 1 69 LEU MD2 . . 3.700 2.109 1.963 2.197 . 0 0 "[ . 1 . 2]" 1
1608 1 69 LEU HA 1 69 LEU HG . . 4.240 3.664 3.658 3.672 . 0 0 "[ . 1 . 2]" 1
1609 1 69 LEU HA 1 70 LEU H . . 3.070 2.153 2.140 2.173 . 0 0 "[ . 1 . 2]" 1
1610 1 69 LEU HA 1 100 VAL H . . 4.660 4.202 3.995 4.401 . 0 0 "[ . 1 . 2]" 1
1611 1 69 LEU HA 1 100 VAL HA . . 3.730 2.952 2.636 3.148 . 0 0 "[ . 1 . 2]" 1
1612 1 69 LEU HA 1 100 VAL HB . . 4.760 3.623 3.367 3.927 . 0 0 "[ . 1 . 2]" 1
1613 1 69 LEU HA 1 100 VAL MG1 . . 3.190 1.972 1.908 2.074 . 0 0 "[ . 1 . 2]" 1
1614 1 69 LEU HA 1 101 CYS H . . 5.500 4.774 4.473 4.925 . 0 0 "[ . 1 . 2]" 1
1615 1 69 LEU HB2 1 70 LEU H . . 4.640 4.551 4.513 4.584 . 0 0 "[ . 1 . 2]" 1
1616 1 69 LEU HB2 1 77 LEU MD1 . . 4.370 2.942 2.723 3.127 . 0 0 "[ . 1 . 2]" 1
1617 1 69 LEU HB2 1 100 VAL MG1 . . 4.100 4.058 3.970 4.135 0.035 7 0 "[ . 1 . 2]" 1
1618 1 69 LEU HB3 1 69 LEU MD2 . . 3.560 3.168 3.160 3.176 . 0 0 "[ . 1 . 2]" 1
1619 1 69 LEU HB3 1 70 LEU H . . 4.450 3.756 3.642 3.868 . 0 0 "[ . 1 . 2]" 1
1620 1 69 LEU HB3 1 71 GLU H . . 5.120 4.473 4.259 4.595 . 0 0 "[ . 1 . 2]" 1
1621 1 69 LEU HB3 1 77 LEU MD1 . . 3.290 1.882 1.781 1.994 . 0 0 "[ . 1 . 2]" 1
1622 1 69 LEU HB3 1 100 VAL MG1 . . 3.960 3.949 3.871 4.004 0.044 8 0 "[ . 1 . 2]" 1
1623 1 69 LEU MD1 1 70 LEU H . . 3.740 3.256 3.069 3.580 . 0 0 "[ . 1 . 2]" 1
1624 1 69 LEU MD1 1 71 GLU H . . 3.530 3.488 3.361 3.558 0.028 9 0 "[ . 1 . 2]" 1
1625 1 69 LEU MD1 1 98 VAL HA . . 4.080 3.706 3.476 3.864 . 0 0 "[ . 1 . 2]" 1
1626 1 69 LEU MD1 1 98 VAL HB . . 3.220 2.668 2.239 2.979 . 0 0 "[ . 1 . 2]" 1
1627 1 69 LEU MD1 1 99 LEU H . . 4.110 3.828 3.601 3.958 . 0 0 "[ . 1 . 2]" 1
1628 1 69 LEU MD1 1 100 VAL HA . . 4.450 4.246 3.870 4.465 0.015 5 0 "[ . 1 . 2]" 1
1629 1 69 LEU MD2 1 70 LEU H . . 4.370 3.986 3.895 4.086 . 0 0 "[ . 1 . 2]" 1
1630 1 69 LEU MD2 1 71 GLU H . . 5.500 5.331 5.165 5.474 . 0 0 "[ . 1 . 2]" 1
1631 1 69 LEU MD2 1 98 VAL HA . . 5.500 5.528 5.505 5.543 0.043 1 0 "[ . 1 . 2]" 1
1632 1 69 LEU MD2 1 98 VAL HB . . 4.240 3.842 3.718 3.939 . 0 0 "[ . 1 . 2]" 1
1633 1 69 LEU MD2 1 99 LEU H . . 5.500 5.510 5.469 5.527 0.027 5 0 "[ . 1 . 2]" 1
1634 1 69 LEU MD2 1 100 VAL HA . . 4.910 3.909 3.582 4.165 . 0 0 "[ . 1 . 2]" 1
1635 1 69 LEU MD2 1 100 VAL HB . . 5.090 3.221 2.931 3.498 . 0 0 "[ . 1 . 2]" 1
1636 1 69 LEU MD2 1 100 VAL MG1 . . 2.700 1.732 1.693 1.763 . 0 0 "[ . 1 . 2]" 1
1637 1 69 LEU MD2 1 101 CYS H . . 5.090 4.711 4.379 4.904 . 0 0 "[ . 1 . 2]" 1
1638 1 70 LEU H 1 70 LEU HB2 . . 4.080 2.243 2.162 2.387 . 0 0 "[ . 1 . 2]" 1
1639 1 70 LEU H 1 70 LEU HB3 . . 4.130 3.524 3.467 3.620 . 0 0 "[ . 1 . 2]" 1
1640 1 70 LEU H 1 70 LEU MD1 . . 3.950 3.343 2.292 3.935 . 0 0 "[ . 1 . 2]" 1
1641 1 70 LEU H 1 70 LEU QD . . 3.390 2.683 2.245 3.400 0.010 9 0 "[ . 1 . 2]" 1
1642 1 70 LEU H 1 70 LEU MD2 . . 3.950 3.333 2.264 3.963 0.013 14 0 "[ . 1 . 2]" 1
1643 1 70 LEU H 1 71 GLU H . . 3.140 2.449 2.318 2.560 . 0 0 "[ . 1 . 2]" 1
1644 1 70 LEU H 1 71 GLU QG . . 4.890 4.570 4.363 4.797 . 0 0 "[ . 1 . 2]" 1
1645 1 70 LEU H 1 98 VAL HA . . 5.500 5.425 5.306 5.510 0.010 18 0 "[ . 1 . 2]" 1
1646 1 70 LEU H 1 99 LEU H . . 4.510 3.845 3.738 3.923 . 0 0 "[ . 1 . 2]" 1
1647 1 70 LEU H 1 99 LEU HA . . 5.500 5.229 5.053 5.330 . 0 0 "[ . 1 . 2]" 1
1648 1 70 LEU H 1 99 LEU HB3 . . 4.390 3.572 3.328 3.762 . 0 0 "[ . 1 . 2]" 1
1649 1 70 LEU H 1 99 LEU HG . . 5.220 4.854 4.526 5.110 . 0 0 "[ . 1 . 2]" 1
1650 1 70 LEU H 1 100 VAL HA . . 3.740 2.583 2.430 2.780 . 0 0 "[ . 1 . 2]" 1
1651 1 70 LEU H 1 100 VAL HB . . 5.020 4.487 4.120 4.769 . 0 0 "[ . 1 . 2]" 1
1652 1 70 LEU H 1 100 VAL MG1 . . 3.600 3.010 2.676 3.288 . 0 0 "[ . 1 . 2]" 1
1653 1 70 LEU H 1 101 CYS H . . 5.030 4.941 4.819 5.034 0.004 18 0 "[ . 1 . 2]" 1
1654 1 70 LEU HA 1 70 LEU MD1 . . 3.870 2.688 1.920 3.856 . 0 0 "[ . 1 . 2]" 1
1655 1 70 LEU HA 1 70 LEU QD . . 2.720 2.110 1.893 2.543 . 0 0 "[ . 1 . 2]" 1
1656 1 70 LEU HA 1 70 LEU MD2 . . 3.870 2.918 1.959 3.815 . 0 0 "[ . 1 . 2]" 1
1657 1 70 LEU HA 1 77 LEU HG . . 4.910 4.791 4.525 4.922 0.012 11 0 "[ . 1 . 2]" 1
1658 1 70 LEU HB2 1 71 GLU H . . 3.220 2.560 2.359 2.784 . 0 0 "[ . 1 . 2]" 1
1659 1 70 LEU HB2 1 71 GLU QG . . 4.450 3.399 2.982 3.847 . 0 0 "[ . 1 . 2]" 1
1660 1 70 LEU HB2 1 99 LEU HB3 . . 4.540 2.050 1.991 2.232 . 0 0 "[ . 1 . 2]" 1
1661 1 70 LEU HB2 1 99 LEU MD2 . . 4.040 3.189 3.018 3.417 . 0 0 "[ . 1 . 2]" 1
1662 1 70 LEU HB2 1 99 LEU HG . . 3.600 2.818 2.520 3.151 . 0 0 "[ . 1 . 2]" 1
1663 1 70 LEU HB2 1 100 VAL H . . 4.870 4.198 3.705 4.508 . 0 0 "[ . 1 . 2]" 1
1664 1 70 LEU HB3 1 71 GLU H . . 4.240 3.169 2.967 3.372 . 0 0 "[ . 1 . 2]" 1
1665 1 70 LEU HB3 1 71 GLU QG . . 4.450 2.331 2.113 2.746 . 0 0 "[ . 1 . 2]" 1
1666 1 70 LEU HB3 1 99 LEU HB3 . . 4.370 2.671 2.195 3.043 . 0 0 "[ . 1 . 2]" 1
1667 1 70 LEU HB3 1 99 LEU MD2 . . 4.030 2.565 2.198 2.957 . 0 0 "[ . 1 . 2]" 1
1668 1 70 LEU QD 1 99 LEU HA . . 4.870 4.426 4.149 4.801 . 0 0 "[ . 1 . 2]" 1
1669 1 70 LEU QD 1 100 VAL HA . . 4.040 2.658 1.969 3.682 . 0 0 "[ . 1 . 2]" 1
1670 1 70 LEU QD 1 101 CYS H . . 4.410 3.644 3.206 4.381 . 0 0 "[ . 1 . 2]" 1
1671 1 70 LEU QD 1 101 CYS QB . . 4.190 2.932 2.462 3.375 . 0 0 "[ . 1 . 2]" 1
1672 1 70 LEU MD1 1 100 VAL HA . . 4.760 3.644 2.102 4.776 0.016 7 0 "[ . 1 . 2]" 1
1673 1 70 LEU MD2 1 100 VAL HA . . 4.760 3.498 1.971 4.762 0.002 9 0 "[ . 1 . 2]" 1
1674 1 71 GLU H 1 71 GLU HB2 . . 3.870 3.061 2.920 3.166 . 0 0 "[ . 1 . 2]" 1
1675 1 71 GLU H 1 71 GLU QG . . 3.680 2.997 2.733 3.307 . 0 0 "[ . 1 . 2]" 1
1676 1 71 GLU H 1 72 VAL H . . 4.590 4.256 4.184 4.324 . 0 0 "[ . 1 . 2]" 1
1677 1 71 GLU H 1 72 VAL MG2 . . 4.360 3.968 3.769 4.108 . 0 0 "[ . 1 . 2]" 1
1678 1 71 GLU H 1 98 VAL HA . . 4.480 4.166 3.993 4.360 . 0 0 "[ . 1 . 2]" 1
1679 1 71 GLU H 1 99 LEU H . . 3.440 2.553 2.392 2.662 . 0 0 "[ . 1 . 2]" 1
1680 1 71 GLU H 1 99 LEU HB2 . . 4.240 3.599 3.425 3.764 . 0 0 "[ . 1 . 2]" 1
1681 1 71 GLU H 1 99 LEU HB3 . . 3.490 2.366 2.060 2.559 . 0 0 "[ . 1 . 2]" 1
1682 1 71 GLU H 1 99 LEU MD1 . . 5.500 5.075 4.856 5.223 . 0 0 "[ . 1 . 2]" 1
1683 1 71 GLU H 1 99 LEU MD2 . . 4.240 3.979 3.691 4.136 . 0 0 "[ . 1 . 2]" 1
1684 1 71 GLU H 1 99 LEU HG . . 5.500 4.603 4.218 4.858 . 0 0 "[ . 1 . 2]" 1
1685 1 71 GLU H 1 100 VAL H . . 5.370 4.265 3.926 4.540 . 0 0 "[ . 1 . 2]" 1
1686 1 71 GLU H 1 100 VAL HA . . 4.720 4.525 4.340 4.737 0.017 15 0 "[ . 1 . 2]" 1
1687 1 71 GLU H 1 100 VAL MG1 . . 5.240 4.026 3.618 4.350 . 0 0 "[ . 1 . 2]" 1
1688 1 71 GLU HA 1 71 GLU QG . . 3.830 2.548 2.373 2.694 . 0 0 "[ . 1 . 2]" 1
1689 1 71 GLU HA 1 72 VAL H . . 2.830 2.212 2.171 2.249 . 0 0 "[ . 1 . 2]" 1
1690 1 71 GLU HA 1 72 VAL HA . . 4.910 4.394 4.383 4.405 . 0 0 "[ . 1 . 2]" 1
1691 1 71 GLU HA 1 72 VAL HB . . 4.910 4.548 4.489 4.596 . 0 0 "[ . 1 . 2]" 1
1692 1 71 GLU HA 1 72 VAL MG2 . . 4.370 3.640 3.507 3.844 . 0 0 "[ . 1 . 2]" 1
1693 1 71 GLU HA 1 74 GLN H . . 5.500 5.404 5.329 5.506 0.006 11 0 "[ . 1 . 2]" 1
1694 1 71 GLU HA 1 75 GLN H . . 4.360 4.163 4.016 4.292 . 0 0 "[ . 1 . 2]" 1
1695 1 71 GLU HA 1 76 SER H . . 5.010 4.748 4.538 4.898 . 0 0 "[ . 1 . 2]" 1
1696 1 71 GLU HA 1 76 SER HA . . 3.860 2.810 2.590 2.943 . 0 0 "[ . 1 . 2]" 1
1697 1 71 GLU HA 1 77 LEU H . . 3.650 2.970 2.781 3.186 . 0 0 "[ . 1 . 2]" 1
1698 1 71 GLU HA 1 77 LEU MD1 . . 4.170 3.621 3.137 4.035 . 0 0 "[ . 1 . 2]" 1
1699 1 71 GLU HA 1 77 LEU MD2 . . 4.310 3.141 2.893 3.471 . 0 0 "[ . 1 . 2]" 1
1700 1 71 GLU HA 1 77 LEU HG . . 3.860 2.446 2.158 2.808 . 0 0 "[ . 1 . 2]" 1
1701 1 71 GLU HA 1 78 LEU H . . 5.500 5.474 5.397 5.530 0.030 4 0 "[ . 1 . 2]" 1
1702 1 71 GLU HA 1 99 LEU MD2 . . 5.410 5.063 4.817 5.276 . 0 0 "[ . 1 . 2]" 1
1703 1 71 GLU HB2 1 72 VAL H . . 4.450 3.868 3.659 3.994 . 0 0 "[ . 1 . 2]" 1
1704 1 71 GLU HB2 1 74 GLN H . . 4.510 3.881 3.680 4.269 . 0 0 "[ . 1 . 2]" 1
1705 1 71 GLU HB2 1 74 GLN HA . . 4.910 3.828 3.567 4.283 . 0 0 "[ . 1 . 2]" 1
1706 1 71 GLU HB2 1 75 GLN H . . 4.560 4.013 3.692 4.532 . 0 0 "[ . 1 . 2]" 1
1707 1 71 GLU HB2 1 76 SER HA . . 4.760 4.304 4.100 4.614 . 0 0 "[ . 1 . 2]" 1
1708 1 71 GLU HB2 1 99 LEU HB2 . . 3.960 2.829 2.475 3.112 . 0 0 "[ . 1 . 2]" 1
1709 1 71 GLU HB2 1 99 LEU HB3 . . 3.960 2.990 2.588 3.430 . 0 0 "[ . 1 . 2]" 1
1710 1 71 GLU HB2 1 99 LEU MD2 . . 4.300 3.055 2.608 3.441 . 0 0 "[ . 1 . 2]" 1
1711 1 71 GLU HB3 1 72 VAL H . . 4.180 3.007 2.862 3.183 . 0 0 "[ . 1 . 2]" 1
1712 1 71 GLU HB3 1 74 GLN H . . 4.080 3.824 3.549 4.050 . 0 0 "[ . 1 . 2]" 1
1713 1 71 GLU HB3 1 74 GLN HA . . 4.040 3.471 3.330 3.699 . 0 0 "[ . 1 . 2]" 1
1714 1 71 GLU HB3 1 75 GLN H . . 3.850 2.839 2.731 2.966 . 0 0 "[ . 1 . 2]" 1
1715 1 71 GLU HB3 1 76 SER H . . 4.660 3.619 3.278 4.196 . 0 0 "[ . 1 . 2]" 1
1716 1 71 GLU HB3 1 76 SER HA . . 4.370 2.941 2.597 3.471 . 0 0 "[ . 1 . 2]" 1
1717 1 71 GLU HB3 1 76 SER HB2 . . 5.070 4.398 3.919 4.999 . 0 0 "[ . 1 . 2]" 1
1718 1 71 GLU HB3 1 99 LEU MD2 . . 4.640 4.257 3.940 4.593 . 0 0 "[ . 1 . 2]" 1
1719 1 71 GLU QG 1 72 VAL H . . 4.370 4.242 4.025 4.374 0.004 20 0 "[ . 1 . 2]" 1
1720 1 71 GLU QG 1 74 GLN H . . 5.500 5.542 5.512 5.563 0.063 20 0 "[ . 1 . 2]" 1
1721 1 71 GLU QG 1 74 GLN HA . . 5.390 5.005 4.958 5.045 . 0 0 "[ . 1 . 2]" 1
1722 1 71 GLU QG 1 75 GLN H . . 4.870 4.788 4.574 4.869 . 0 0 "[ . 1 . 2]" 1
1723 1 71 GLU QG 1 76 SER H . . 4.150 3.989 3.831 4.079 . 0 0 "[ . 1 . 2]" 1
1724 1 71 GLU QG 1 76 SER HA . . 3.510 2.069 1.988 2.267 . 0 0 "[ . 1 . 2]" 1
1725 1 71 GLU QG 1 76 SER HB2 . . 4.300 3.343 2.971 3.648 . 0 0 "[ . 1 . 2]" 1
1726 1 71 GLU QG 1 76 SER HB3 . . 4.540 4.514 4.359 4.556 0.016 14 0 "[ . 1 . 2]" 1
1727 1 71 GLU QG 1 77 LEU H . . 3.850 3.290 3.055 3.681 . 0 0 "[ . 1 . 2]" 1
1728 1 71 GLU QG 1 77 LEU HG . . 4.910 4.146 3.812 4.447 . 0 0 "[ . 1 . 2]" 1
1729 1 71 GLU QG 1 78 LEU H . . 5.310 4.882 4.688 5.086 . 0 0 "[ . 1 . 2]" 1
1730 1 71 GLU QG 1 99 LEU HB2 . . 3.960 3.703 3.411 3.904 . 0 0 "[ . 1 . 2]" 1
1731 1 71 GLU QG 1 99 LEU HB3 . . 3.960 2.913 2.648 3.350 . 0 0 "[ . 1 . 2]" 1
1732 1 71 GLU QG 1 99 LEU MD2 . . 3.220 2.425 2.123 2.691 . 0 0 "[ . 1 . 2]" 1
1733 1 71 GLU QG 1 99 LEU HG . . 5.030 4.331 3.899 4.869 . 0 0 "[ . 1 . 2]" 1
1734 1 72 VAL H 1 72 VAL HB . . 3.210 2.580 2.494 2.642 . 0 0 "[ . 1 . 2]" 1
1735 1 72 VAL H 1 72 VAL MG1 . . 4.130 3.821 3.777 3.849 . 0 0 "[ . 1 . 2]" 1
1736 1 72 VAL H 1 72 VAL MG2 . . 3.440 2.817 2.657 2.938 . 0 0 "[ . 1 . 2]" 1
1737 1 72 VAL H 1 73 ASN H . . 4.290 4.189 4.121 4.255 . 0 0 "[ . 1 . 2]" 1
1738 1 72 VAL H 1 74 GLN H . . 4.510 4.348 4.219 4.465 . 0 0 "[ . 1 . 2]" 1
1739 1 72 VAL H 1 74 GLN HA . . 5.380 5.266 5.114 5.392 0.012 1 0 "[ . 1 . 2]" 1
1740 1 72 VAL H 1 75 GLN H . . 3.390 2.931 2.826 3.067 . 0 0 "[ . 1 . 2]" 1
1741 1 72 VAL H 1 75 GLN HB2 . . 3.980 3.405 3.252 3.605 . 0 0 "[ . 1 . 2]" 1
1742 1 72 VAL H 1 75 GLN HB3 . . 5.060 4.772 4.601 4.888 . 0 0 "[ . 1 . 2]" 1
1743 1 72 VAL H 1 75 GLN QG . . 5.340 4.752 4.558 5.053 . 0 0 "[ . 1 . 2]" 1
1744 1 72 VAL H 1 76 SER H . . 4.930 4.944 4.912 4.963 0.033 7 0 "[ . 1 . 2]" 1
1745 1 72 VAL H 1 76 SER HA . . 4.240 4.076 3.919 4.197 . 0 0 "[ . 1 . 2]" 1
1746 1 72 VAL H 1 77 LEU H . . 4.750 4.323 4.188 4.452 . 0 0 "[ . 1 . 2]" 1
1747 1 72 VAL H 1 77 LEU MD1 . . 4.390 3.930 3.617 4.217 . 0 0 "[ . 1 . 2]" 1
1748 1 72 VAL H 1 77 LEU MD2 . . 3.320 2.489 2.103 2.981 . 0 0 "[ . 1 . 2]" 1
1749 1 72 VAL H 1 77 LEU HG . . 3.790 3.308 2.912 3.572 . 0 0 "[ . 1 . 2]" 1
1750 1 72 VAL H 1 88 LEU MD2 . . 4.640 3.682 2.925 3.814 . 0 0 "[ . 1 . 2]" 1
1751 1 72 VAL H 1 98 VAL HA . . 5.310 5.021 4.928 5.143 . 0 0 "[ . 1 . 2]" 1
1752 1 72 VAL HA 1 72 VAL MG1 . . 3.350 2.401 2.356 2.428 . 0 0 "[ . 1 . 2]" 1
1753 1 72 VAL HA 1 73 ASN H . . 2.900 2.154 2.148 2.158 . 0 0 "[ . 1 . 2]" 1
1754 1 72 VAL HA 1 73 ASN HA . . 4.540 4.368 4.366 4.370 . 0 0 "[ . 1 . 2]" 1
1755 1 72 VAL HA 1 74 GLN H . . 4.320 3.990 3.953 4.023 . 0 0 "[ . 1 . 2]" 1
1756 1 72 VAL HA 1 88 LEU MD2 . . 4.780 4.241 4.000 4.307 . 0 0 "[ . 1 . 2]" 1
1757 1 72 VAL HA 1 96 LEU MD1 . . 4.300 3.274 3.135 3.390 . 0 0 "[ . 1 . 2]" 1
1758 1 72 VAL HA 1 96 LEU MD2 . . 5.500 5.516 5.389 5.567 0.067 17 0 "[ . 1 . 2]" 1
1759 1 72 VAL HA 1 97 THR H . . 4.890 4.400 4.238 4.728 . 0 0 "[ . 1 . 2]" 1
1760 1 72 VAL HA 1 97 THR HB . . 5.210 4.911 4.811 5.088 . 0 0 "[ . 1 . 2]" 1
1761 1 72 VAL HA 1 98 VAL HA . . 3.640 2.683 2.575 2.844 . 0 0 "[ . 1 . 2]" 1
1762 1 72 VAL HA 1 98 VAL HB . . 4.640 4.331 4.234 4.444 . 0 0 "[ . 1 . 2]" 1
1763 1 72 VAL HA 1 99 LEU H . . 4.270 3.944 3.708 4.132 . 0 0 "[ . 1 . 2]" 1
1764 1 72 VAL HB 1 73 ASN H . . 4.560 4.389 4.355 4.415 . 0 0 "[ . 1 . 2]" 1
1765 1 72 VAL HB 1 75 GLN H . . 4.760 4.484 4.438 4.582 . 0 0 "[ . 1 . 2]" 1
1766 1 72 VAL HB 1 77 LEU MD2 . . 3.150 2.457 2.237 2.674 . 0 0 "[ . 1 . 2]" 1
1767 1 72 VAL HB 1 88 LEU MD2 . . 3.240 1.966 1.770 2.034 . 0 0 "[ . 1 . 2]" 1
1768 1 72 VAL MG1 1 73 ASN H . . 3.400 2.845 2.794 2.900 . 0 0 "[ . 1 . 2]" 1
1769 1 72 VAL MG1 1 73 ASN HB2 . . 4.300 2.672 2.614 2.761 . 0 0 "[ . 1 . 2]" 1
1770 1 72 VAL MG1 1 73 ASN QB . . 3.680 2.641 2.585 2.726 . 0 0 "[ . 1 . 2]" 1
1771 1 72 VAL MG1 1 73 ASN HB3 . . 4.300 4.155 4.093 4.221 . 0 0 "[ . 1 . 2]" 1
1772 1 72 VAL MG1 1 73 ASN HD21 . . 4.180 3.226 2.753 3.558 . 0 0 "[ . 1 . 2]" 1
1773 1 72 VAL MG1 1 73 ASN HD22 . . 4.370 3.965 3.730 4.131 . 0 0 "[ . 1 . 2]" 1
1774 1 72 VAL MG1 1 74 GLN H . . 5.010 4.820 4.780 4.856 . 0 0 "[ . 1 . 2]" 1
1775 1 72 VAL MG1 1 75 GLN H . . 5.090 4.761 4.671 4.858 . 0 0 "[ . 1 . 2]" 1
1776 1 72 VAL MG1 1 89 LEU HA . . 3.700 1.977 1.824 2.098 . 0 0 "[ . 1 . 2]" 1
1777 1 72 VAL MG1 1 91 SER H . . 4.470 4.415 4.232 4.481 0.011 1 0 "[ . 1 . 2]" 1
1778 1 72 VAL MG1 1 92 VAL QG . . 3.680 3.481 2.875 3.740 0.060 7 0 "[ . 1 . 2]" 1
1779 1 72 VAL MG1 1 96 LEU HA . . 5.210 4.780 4.608 4.888 . 0 0 "[ . 1 . 2]" 1
1780 1 72 VAL MG1 1 97 THR H . . 4.530 3.805 3.589 4.131 . 0 0 "[ . 1 . 2]" 1
1781 1 72 VAL MG1 1 97 THR HB . . 5.500 5.344 5.239 5.511 0.011 4 0 "[ . 1 . 2]" 1
1782 1 72 VAL MG1 1 98 VAL HA . . 4.760 4.204 4.030 4.380 . 0 0 "[ . 1 . 2]" 1
1783 1 72 VAL MG2 1 73 ASN H . . 4.340 4.121 4.025 4.182 . 0 0 "[ . 1 . 2]" 1
1784 1 72 VAL MG2 1 74 GLN H . . 5.500 5.522 5.502 5.539 0.039 17 0 "[ . 1 . 2]" 1
1785 1 72 VAL MG2 1 89 LEU HA . . 4.240 3.247 3.039 3.446 . 0 0 "[ . 1 . 2]" 1
1786 1 72 VAL MG2 1 98 VAL HA . . 4.170 3.540 3.313 3.806 . 0 0 "[ . 1 . 2]" 1
1787 1 73 ASN H 1 73 ASN HA . . 2.940 2.275 2.274 2.276 . 0 0 "[ . 1 . 2]" 1
1788 1 73 ASN H 1 73 ASN QB . . 3.700 3.171 3.163 3.176 . 0 0 "[ . 1 . 2]" 1
1789 1 73 ASN H 1 73 ASN HD21 . . 5.120 4.891 4.474 5.142 0.022 12 0 "[ . 1 . 2]" 1
1790 1 73 ASN H 1 73 ASN HD22 . . 5.440 5.265 5.053 5.405 . 0 0 "[ . 1 . 2]" 1
1791 1 73 ASN H 1 74 GLN H . . 3.530 2.640 2.632 2.652 . 0 0 "[ . 1 . 2]" 1
1792 1 73 ASN H 1 74 GLN HA . . 5.030 4.892 4.885 4.902 . 0 0 "[ . 1 . 2]" 1
1793 1 73 ASN H 1 74 GLN HB2 . . 5.500 5.565 5.552 5.575 0.075 7 0 "[ . 1 . 2]" 1
1794 1 73 ASN H 1 75 GLN H . . 4.430 4.021 3.967 4.081 . 0 0 "[ . 1 . 2]" 1
1795 1 73 ASN H 1 96 LEU HA . . 5.010 4.943 4.708 5.025 0.015 20 0 "[ . 1 . 2]" 1
1796 1 73 ASN H 1 96 LEU MD1 . . 3.950 3.656 3.475 3.816 . 0 0 "[ . 1 . 2]" 1
1797 1 73 ASN H 1 96 LEU HG . . 5.040 3.977 3.797 4.135 . 0 0 "[ . 1 . 2]" 1
1798 1 73 ASN H 1 97 THR H . . 3.710 2.691 2.544 2.974 . 0 0 "[ . 1 . 2]" 1
1799 1 73 ASN H 1 97 THR HA . . 5.230 4.351 4.289 4.521 . 0 0 "[ . 1 . 2]" 1
1800 1 73 ASN H 1 97 THR HB . . 3.820 2.988 2.887 3.168 . 0 0 "[ . 1 . 2]" 1
1801 1 73 ASN H 1 97 THR MG . . 4.360 4.237 4.126 4.362 0.002 4 0 "[ . 1 . 2]" 1
1802 1 73 ASN H 1 98 VAL H . . 5.020 4.451 4.401 4.607 . 0 0 "[ . 1 . 2]" 1
1803 1 73 ASN H 1 98 VAL HA . . 3.870 3.402 3.336 3.499 . 0 0 "[ . 1 . 2]" 1
1804 1 73 ASN H 1 98 VAL HB . . 5.500 5.521 5.507 5.535 0.035 6 0 "[ . 1 . 2]" 1
1805 1 73 ASN H 1 99 LEU H . . 5.150 4.805 4.607 5.010 . 0 0 "[ . 1 . 2]" 1
1806 1 73 ASN HA 1 73 ASN HD21 . . 4.780 4.297 4.138 4.353 . 0 0 "[ . 1 . 2]" 1
1807 1 73 ASN HA 1 73 ASN HD22 . . 4.780 4.428 4.328 4.463 . 0 0 "[ . 1 . 2]" 1
1808 1 73 ASN HA 1 74 GLN H . . 3.260 2.787 2.776 2.796 . 0 0 "[ . 1 . 2]" 1
1809 1 73 ASN HA 1 74 GLN HA . . 5.000 4.767 4.758 4.773 . 0 0 "[ . 1 . 2]" 1
1810 1 73 ASN HA 1 74 GLN HB2 . . 4.760 4.188 4.173 4.199 . 0 0 "[ . 1 . 2]" 1
1811 1 73 ASN HA 1 74 GLN HE21 . . 5.370 3.567 3.285 3.978 . 0 0 "[ . 1 . 2]" 1
1812 1 73 ASN HA 1 74 GLN QE . . 4.660 3.500 3.238 3.878 . 0 0 "[ . 1 . 2]" 1
1813 1 73 ASN HA 1 74 GLN HE22 . . 5.370 5.081 4.895 5.371 0.001 6 0 "[ . 1 . 2]" 1
1814 1 73 ASN HA 1 74 GLN HG2 . . 5.500 5.518 5.512 5.527 0.027 13 0 "[ . 1 . 2]" 1
1815 1 73 ASN HA 1 74 GLN QG . . 4.690 3.759 3.753 3.769 . 0 0 "[ . 1 . 2]" 1
1816 1 73 ASN HA 1 74 GLN HG3 . . 5.500 3.826 3.819 3.836 . 0 0 "[ . 1 . 2]" 1
1817 1 73 ASN HA 1 75 GLN H . . 4.670 4.530 4.469 4.618 . 0 0 "[ . 1 . 2]" 1
1818 1 73 ASN HA 1 97 THR H . . 3.730 2.339 2.135 2.477 . 0 0 "[ . 1 . 2]" 1
1819 1 73 ASN HA 1 97 THR HB . . 3.530 2.445 2.216 2.645 . 0 0 "[ . 1 . 2]" 1
1820 1 73 ASN HA 1 97 THR MG . . 4.440 4.095 3.916 4.269 . 0 0 "[ . 1 . 2]" 1
1821 1 73 ASN QB 1 73 ASN HD22 . . 3.330 3.214 3.212 3.220 . 0 0 "[ . 1 . 2]" 1
1822 1 73 ASN QB 1 74 GLN H . . 3.960 3.860 3.856 3.865 . 0 0 "[ . 1 . 2]" 1
1823 1 73 ASN QB 1 75 GLN H . . 4.180 3.974 3.891 4.086 . 0 0 "[ . 1 . 2]" 1
1824 1 73 ASN QB 1 75 GLN QE . . 3.920 2.968 2.466 3.937 0.017 18 0 "[ . 1 . 2]" 1
1825 1 73 ASN QB 1 92 VAL QG . . 4.530 4.095 3.599 4.530 . 0 0 "[ . 1 . 2]" 1
1826 1 73 ASN QB 1 96 LEU MD1 . . 4.960 4.135 3.859 4.297 . 0 0 "[ . 1 . 2]" 1
1827 1 73 ASN QB 1 97 THR H . . 4.710 3.726 3.663 3.835 . 0 0 "[ . 1 . 2]" 1
1828 1 73 ASN QB 1 97 THR HB . . 5.340 4.620 4.426 4.781 . 0 0 "[ . 1 . 2]" 1
1829 1 73 ASN HB2 1 73 ASN HD22 . . 3.900 3.488 3.440 3.535 . 0 0 "[ . 1 . 2]" 1
1830 1 73 ASN HB2 1 74 GLN H . . 4.510 4.337 4.325 4.353 . 0 0 "[ . 1 . 2]" 1
1831 1 73 ASN HB2 1 75 GLN H . . 4.780 4.326 4.228 4.463 . 0 0 "[ . 1 . 2]" 1
1832 1 73 ASN HB2 1 88 LEU MD2 . . 4.820 2.945 2.836 3.101 . 0 0 "[ . 1 . 2]" 1
1833 1 73 ASN HB2 1 97 THR H . . 5.500 4.045 3.944 4.203 . 0 0 "[ . 1 . 2]" 1
1834 1 73 ASN HB3 1 73 ASN HD22 . . 3.900 3.769 3.691 3.880 . 0 0 "[ . 1 . 2]" 1
1835 1 73 ASN HB3 1 74 GLN H . . 4.510 4.327 4.320 4.334 . 0 0 "[ . 1 . 2]" 1
1836 1 73 ASN HB3 1 75 GLN H . . 4.780 4.631 4.527 4.748 . 0 0 "[ . 1 . 2]" 1
1837 1 73 ASN HB3 1 88 LEU MD2 . . 4.820 3.935 3.821 4.152 . 0 0 "[ . 1 . 2]" 1
1838 1 73 ASN HB3 1 97 THR H . . 5.500 4.363 4.279 4.469 . 0 0 "[ . 1 . 2]" 1
1839 1 73 ASN HD21 1 91 SER QB . . 4.500 4.498 4.410 4.526 0.026 12 0 "[ . 1 . 2]" 1
1840 1 73 ASN HD21 1 92 VAL H . . 5.040 4.844 4.407 4.975 . 0 0 "[ . 1 . 2]" 1
1841 1 73 ASN HD21 1 92 VAL HA . . 4.200 3.338 3.113 3.485 . 0 0 "[ . 1 . 2]" 1
1842 1 73 ASN HD21 1 92 VAL HB . . 5.060 3.354 2.488 5.084 0.024 13 0 "[ . 1 . 2]" 1
1843 1 73 ASN HD21 1 92 VAL MG1 . . 4.180 3.937 3.387 4.190 0.010 8 0 "[ . 1 . 2]" 1
1844 1 73 ASN HD21 1 92 VAL QG . . 3.600 3.019 2.105 3.616 0.016 20 0 "[ . 1 . 2]" 1
1845 1 73 ASN HD21 1 92 VAL MG2 . . 4.180 3.160 2.125 3.962 . 0 0 "[ . 1 . 2]" 1
1846 1 73 ASN HD21 1 93 GLY H . . 5.230 5.095 4.827 5.249 0.019 2 0 "[ . 1 . 2]" 1
1847 1 73 ASN HD21 1 96 LEU HA . . 4.430 4.196 4.049 4.384 . 0 0 "[ . 1 . 2]" 1
1848 1 73 ASN HD21 1 96 LEU HB3 . . 5.020 4.337 3.909 4.659 . 0 0 "[ . 1 . 2]" 1
1849 1 73 ASN HD21 1 96 LEU MD1 . . 4.390 4.104 3.588 4.400 0.010 12 0 "[ . 1 . 2]" 1
1850 1 73 ASN HD21 1 97 THR H . . 4.780 4.497 4.288 4.719 . 0 0 "[ . 1 . 2]" 1
1851 1 73 ASN HD22 1 92 VAL HA . . 4.260 2.785 2.463 2.992 . 0 0 "[ . 1 . 2]" 1
1852 1 73 ASN HD22 1 92 VAL HB . . 4.160 2.573 1.879 4.182 0.022 6 0 "[ . 1 . 2]" 1
1853 1 73 ASN HD22 1 92 VAL MG1 . . 4.180 3.087 1.878 3.652 . 0 0 "[ . 1 . 2]" 1
1854 1 73 ASN HD22 1 92 VAL QG . . 3.510 1.964 1.673 2.464 . 0 0 "[ . 1 . 2]" 1
1855 1 73 ASN HD22 1 92 VAL MG2 . . 4.180 2.028 1.862 2.506 . 0 0 "[ . 1 . 2]" 1
1856 1 73 ASN HD22 1 93 GLY H . . 4.660 3.964 3.734 4.078 . 0 0 "[ . 1 . 2]" 1
1857 1 73 ASN HD22 1 96 LEU HA . . 4.130 2.784 2.624 2.944 . 0 0 "[ . 1 . 2]" 1
1858 1 73 ASN HD22 1 96 LEU HB3 . . 4.720 3.138 2.742 3.412 . 0 0 "[ . 1 . 2]" 1
1859 1 73 ASN HD22 1 96 LEU MD1 . . 4.290 3.965 3.610 4.196 . 0 0 "[ . 1 . 2]" 1
1860 1 73 ASN HD22 1 96 LEU MD2 . . 5.090 4.841 4.519 5.060 . 0 0 "[ . 1 . 2]" 1
1861 1 73 ASN HD22 1 97 THR H . . 4.360 3.932 3.826 4.075 . 0 0 "[ . 1 . 2]" 1
1862 1 74 GLN H 1 74 GLN HA . . 2.850 2.275 2.274 2.275 . 0 0 "[ . 1 . 2]" 1
1863 1 74 GLN H 1 74 GLN HB2 . . 3.700 3.500 3.489 3.508 . 0 0 "[ . 1 . 2]" 1
1864 1 74 GLN H 1 74 GLN QE . . 4.550 4.063 3.901 4.277 . 0 0 "[ . 1 . 2]" 1
1865 1 74 GLN H 1 74 GLN QG . . 3.590 2.756 2.734 2.782 . 0 0 "[ . 1 . 2]" 1
1866 1 74 GLN H 1 75 GLN H . . 3.260 2.614 2.597 2.637 . 0 0 "[ . 1 . 2]" 1
1867 1 74 GLN H 1 97 THR H . . 5.230 4.540 4.282 4.660 . 0 0 "[ . 1 . 2]" 1
1868 1 74 GLN H 1 97 THR HB . . 3.750 3.004 2.777 3.264 . 0 0 "[ . 1 . 2]" 1
1869 1 74 GLN H 1 97 THR MG . . 4.850 4.038 3.888 4.165 . 0 0 "[ . 1 . 2]" 1
1870 1 74 GLN H 1 98 VAL HA . . 5.370 4.984 4.887 5.090 . 0 0 "[ . 1 . 2]" 1
1871 1 74 GLN HA 1 74 GLN HG2 . . 3.560 2.774 2.721 2.810 . 0 0 "[ . 1 . 2]" 1
1872 1 74 GLN HA 1 74 GLN HG3 . . 3.560 2.680 2.657 2.713 . 0 0 "[ . 1 . 2]" 1
1873 1 74 GLN HA 1 75 GLN H . . 3.410 2.894 2.843 2.927 . 0 0 "[ . 1 . 2]" 1
1874 1 74 GLN HA 1 75 GLN HA . . 4.450 4.431 4.402 4.451 0.001 11 0 "[ . 1 . 2]" 1
1875 1 74 GLN HB2 1 74 GLN QE . . 4.060 3.034 2.677 3.300 . 0 0 "[ . 1 . 2]" 1
1876 1 74 GLN HB2 1 75 GLN H . . 5.340 4.141 4.103 4.196 . 0 0 "[ . 1 . 2]" 1
1877 1 74 GLN HB3 1 75 GLN H . . 4.910 4.415 4.409 4.422 . 0 0 "[ . 1 . 2]" 1
1878 1 74 GLN QE 1 97 THR HB . . 4.350 3.289 3.155 3.440 . 0 0 "[ . 1 . 2]" 1
1879 1 74 GLN QE 1 97 THR MG . . 3.890 3.507 3.131 3.890 0.000 2 0 "[ . 1 . 2]" 1
1880 1 74 GLN HE21 1 97 THR HB . . 5.010 3.337 3.196 3.504 . 0 0 "[ . 1 . 2]" 1
1881 1 74 GLN HE22 1 97 THR HB . . 5.010 4.983 4.863 5.027 0.017 9 0 "[ . 1 . 2]" 1
1882 1 74 GLN QG 1 75 GLN H . . 4.830 4.522 4.517 4.527 . 0 0 "[ . 1 . 2]" 1
1883 1 74 GLN QG 1 97 THR MG . . 4.360 3.398 3.154 3.566 . 0 0 "[ . 1 . 2]" 1
1884 1 74 GLN HG2 1 75 GLN H . . 5.500 5.471 5.428 5.500 . 0 0 "[ . 1 . 2]" 1
1885 1 74 GLN HG2 1 97 THR MG . . 5.060 4.531 4.177 4.751 . 0 0 "[ . 1 . 2]" 1
1886 1 74 GLN HG3 1 75 GLN H . . 5.500 4.820 4.803 4.847 . 0 0 "[ . 1 . 2]" 1
1887 1 74 GLN HG3 1 97 THR MG . . 5.060 3.512 3.264 3.686 . 0 0 "[ . 1 . 2]" 1
1888 1 75 GLN H 1 75 GLN HB2 . . 2.930 2.719 2.653 2.780 . 0 0 "[ . 1 . 2]" 1
1889 1 75 GLN H 1 75 GLN HB3 . . 3.990 3.814 3.779 3.853 . 0 0 "[ . 1 . 2]" 1
1890 1 75 GLN H 1 75 GLN HG2 . . 3.860 3.577 2.669 3.827 . 0 0 "[ . 1 . 2]" 1
1891 1 75 GLN H 1 75 GLN QG . . 3.220 2.914 2.613 3.029 . 0 0 "[ . 1 . 2]" 1
1892 1 75 GLN H 1 75 GLN HG3 . . 3.860 3.129 2.994 3.728 . 0 0 "[ . 1 . 2]" 1
1893 1 75 GLN H 1 76 SER H . . 3.980 3.786 3.722 3.834 . 0 0 "[ . 1 . 2]" 1
1894 1 75 GLN H 1 88 LEU MD1 . . 5.060 4.303 4.084 4.569 . 0 0 "[ . 1 . 2]" 1
1895 1 75 GLN H 1 88 LEU MD2 . . 4.020 4.015 3.697 4.043 0.023 5 0 "[ . 1 . 2]" 1
1896 1 75 GLN HA 1 75 GLN HG2 . . 3.860 2.476 2.400 2.891 . 0 0 "[ . 1 . 2]" 1
1897 1 75 GLN HA 1 75 GLN HG3 . . 3.860 3.454 3.292 3.879 0.019 18 0 "[ . 1 . 2]" 1
1898 1 75 GLN HA 1 76 SER H . . 2.580 2.246 2.232 2.259 . 0 0 "[ . 1 . 2]" 1
1899 1 75 GLN HA 1 76 SER HB2 . . 4.760 4.648 4.466 4.762 0.002 14 0 "[ . 1 . 2]" 1
1900 1 75 GLN HA 1 88 LEU MD2 . . 5.260 4.641 4.404 4.700 . 0 0 "[ . 1 . 2]" 1
1901 1 75 GLN HB2 1 75 GLN QE . . 4.280 3.718 3.006 4.035 . 0 0 "[ . 1 . 2]" 1
1902 1 75 GLN HB2 1 75 GLN HE22 . . 4.980 4.613 4.194 5.022 0.042 18 0 "[ . 1 . 2]" 1
1903 1 75 GLN HB2 1 76 SER H . . 4.450 4.450 4.403 4.478 0.028 4 0 "[ . 1 . 2]" 1
1904 1 75 GLN HB2 1 88 LEU HB3 . . 5.220 4.892 4.784 4.997 . 0 0 "[ . 1 . 2]" 1
1905 1 75 GLN HB2 1 88 LEU MD1 . . 3.610 2.119 1.980 2.495 . 0 0 "[ . 1 . 2]" 1
1906 1 75 GLN HB2 1 88 LEU MD2 . . 3.550 1.979 1.894 2.075 . 0 0 "[ . 1 . 2]" 1
1907 1 75 GLN HB2 1 88 LEU HG . . 4.880 3.939 3.574 4.035 . 0 0 "[ . 1 . 2]" 1
1908 1 75 GLN HB3 1 75 GLN QE . . 4.510 3.813 3.339 3.989 . 0 0 "[ . 1 . 2]" 1
1909 1 75 GLN HB3 1 75 GLN HE22 . . 5.270 4.395 4.022 4.569 . 0 0 "[ . 1 . 2]" 1
1910 1 75 GLN HB3 1 76 SER H . . 3.980 4.008 3.974 4.031 0.051 11 0 "[ . 1 . 2]" 1
1911 1 75 GLN HB3 1 88 LEU MD1 . . 3.750 2.314 2.058 2.497 . 0 0 "[ . 1 . 2]" 1
1912 1 75 GLN HB3 1 88 LEU MD2 . . 4.200 2.990 2.880 3.099 . 0 0 "[ . 1 . 2]" 1
1913 1 75 GLN HB3 1 88 LEU HG . . 5.370 4.019 3.670 4.172 . 0 0 "[ . 1 . 2]" 1
1914 1 75 GLN QE 1 75 GLN QG . . 3.090 2.136 2.068 2.204 . 0 0 "[ . 1 . 2]" 1
1915 1 75 GLN QE 1 88 LEU MD2 . . 3.690 2.966 2.003 3.472 . 0 0 "[ . 1 . 2]" 1
1916 1 75 GLN QG 1 88 LEU MD1 . . 4.510 3.653 3.287 4.026 . 0 0 "[ . 1 . 2]" 1
1917 1 75 GLN QG 1 88 LEU MD2 . . 3.440 2.756 2.144 3.063 . 0 0 "[ . 1 . 2]" 1
1918 1 75 GLN HG2 1 88 LEU MD2 . . 4.040 3.925 3.467 4.055 0.015 4 0 "[ . 1 . 2]" 1
1919 1 75 GLN HG3 1 88 LEU MD2 . . 4.040 2.817 2.165 3.172 . 0 0 "[ . 1 . 2]" 1
1920 1 76 SER H 1 76 SER HB2 . . 2.960 2.417 2.248 2.528 . 0 0 "[ . 1 . 2]" 1
1921 1 76 SER H 1 76 SER HB3 . . 2.890 2.704 2.576 2.895 0.005 6 0 "[ . 1 . 2]" 1
1922 1 76 SER H 1 77 LEU H . . 4.840 4.555 4.515 4.604 . 0 0 "[ . 1 . 2]" 1
1923 1 76 SER H 1 78 LEU H . . 5.240 5.144 5.066 5.223 . 0 0 "[ . 1 . 2]" 1
1924 1 76 SER H 1 88 LEU MD1 . . 5.030 4.894 4.682 4.977 . 0 0 "[ . 1 . 2]" 1
1925 1 76 SER HA 1 77 LEU H . . 2.940 2.161 2.143 2.198 . 0 0 "[ . 1 . 2]" 1
1926 1 76 SER HA 1 77 LEU MD2 . . 4.540 3.949 3.620 4.427 . 0 0 "[ . 1 . 2]" 1
1927 1 76 SER HA 1 77 LEU HG . . 4.010 3.724 3.438 4.013 0.003 8 0 "[ . 1 . 2]" 1
1928 1 76 SER HA 1 78 LEU QB . . 5.410 4.624 4.524 4.776 . 0 0 "[ . 1 . 2]" 1
1929 1 76 SER HB2 1 77 LEU H . . 4.410 4.227 4.062 4.393 . 0 0 "[ . 1 . 2]" 1
1930 1 76 SER HB2 1 78 LEU H . . 4.390 4.174 4.119 4.288 . 0 0 "[ . 1 . 2]" 1
1931 1 76 SER HB2 1 78 LEU QB . . 5.360 4.352 4.256 4.542 . 0 0 "[ . 1 . 2]" 1
1932 1 76 SER HB3 1 77 LEU H . . 4.320 4.113 3.938 4.219 . 0 0 "[ . 1 . 2]" 1
1933 1 76 SER HB3 1 77 LEU HA . . 5.500 5.039 4.831 5.163 . 0 0 "[ . 1 . 2]" 1
1934 1 76 SER HB3 1 78 LEU H . . 3.960 3.275 3.005 3.502 . 0 0 "[ . 1 . 2]" 1
1935 1 76 SER HB3 1 78 LEU QB . . 4.240 3.667 3.316 3.955 . 0 0 "[ . 1 . 2]" 1
1936 1 77 LEU H 1 77 LEU HB2 . . 3.750 2.611 2.431 2.741 . 0 0 "[ . 1 . 2]" 1
1937 1 77 LEU H 1 77 LEU HB3 . . 3.750 3.623 3.604 3.654 . 0 0 "[ . 1 . 2]" 1
1938 1 77 LEU H 1 77 LEU MD1 . . 4.000 3.715 3.398 3.974 . 0 0 "[ . 1 . 2]" 1
1939 1 77 LEU H 1 77 LEU MD2 . . 3.520 3.061 2.711 3.379 . 0 0 "[ . 1 . 2]" 1
1940 1 77 LEU H 1 77 LEU HG . . 3.100 2.249 1.960 2.544 . 0 0 "[ . 1 . 2]" 1
1941 1 77 LEU H 1 78 LEU QB . . 4.320 4.082 3.955 4.240 . 0 0 "[ . 1 . 2]" 1
1942 1 77 LEU HA 1 77 LEU MD2 . . 3.050 2.122 1.972 2.318 . 0 0 "[ . 1 . 2]" 1
1943 1 77 LEU HA 1 77 LEU HG . . 4.230 3.343 3.177 3.490 . 0 0 "[ . 1 . 2]" 1
1944 1 77 LEU HA 1 78 LEU H . . 3.340 3.189 3.075 3.262 . 0 0 "[ . 1 . 2]" 1
1945 1 77 LEU HA 1 78 LEU QB . . 5.500 4.950 4.879 5.053 . 0 0 "[ . 1 . 2]" 1
1946 1 77 LEU HA 1 80 LEU H . . 4.590 4.199 4.019 4.650 0.060 20 0 "[ . 1 . 2]" 1
1947 1 77 LEU HA 1 80 LEU MD1 . . 3.050 2.229 2.082 2.355 . 0 0 "[ . 1 . 2]" 1
1948 1 77 LEU HA 1 80 LEU MD2 . . 3.560 2.158 1.953 2.386 . 0 0 "[ . 1 . 2]" 1
1949 1 77 LEU HA 1 80 LEU HG . . 3.860 2.882 2.728 3.117 . 0 0 "[ . 1 . 2]" 1
1950 1 77 LEU HA 1 85 ALA MB . . 4.760 4.016 3.770 4.385 . 0 0 "[ . 1 . 2]" 1
1951 1 77 LEU QB 1 77 LEU MD2 . . 3.220 2.327 2.178 2.477 . 0 0 "[ . 1 . 2]" 1
1952 1 77 LEU QB 1 78 LEU H . . 3.940 3.500 3.370 3.646 . 0 0 "[ . 1 . 2]" 1
1953 1 77 LEU QB 1 80 LEU H . . 5.170 4.752 4.565 5.046 . 0 0 "[ . 1 . 2]" 1
1954 1 77 LEU QB 1 85 ALA MB . . 4.210 2.643 2.181 2.982 . 0 0 "[ . 1 . 2]" 1
1955 1 77 LEU HB2 1 77 LEU MD1 . . 2.980 2.348 2.180 2.508 . 0 0 "[ . 1 . 2]" 1
1956 1 77 LEU HB3 1 77 LEU MD1 . . 2.980 2.349 2.246 2.468 . 0 0 "[ . 1 . 2]" 1
1957 1 77 LEU MD1 1 85 ALA HA . . 4.540 3.968 3.407 4.444 . 0 0 "[ . 1 . 2]" 1
1958 1 77 LEU MD2 1 78 LEU H . . 4.750 4.499 4.229 4.754 0.004 3 0 "[ . 1 . 2]" 1
1959 1 77 LEU MD2 1 85 ALA HA . . 3.800 2.785 2.289 3.231 . 0 0 "[ . 1 . 2]" 1
1960 1 77 LEU MD2 1 85 ALA MB . . 3.450 2.842 2.419 3.151 . 0 0 "[ . 1 . 2]" 1
1961 1 77 LEU MD2 1 88 LEU HB3 . . 3.530 2.953 2.686 3.140 . 0 0 "[ . 1 . 2]" 1
1962 1 77 LEU HG 1 78 LEU H . . 5.400 4.599 4.360 4.866 . 0 0 "[ . 1 . 2]" 1
1963 1 78 LEU H 1 78 LEU QB . . 2.540 2.201 2.114 2.259 . 0 0 "[ . 1 . 2]" 1
1964 1 78 LEU H 1 78 LEU MD1 . . 4.390 4.221 3.923 4.357 . 0 0 "[ . 1 . 2]" 1
1965 1 78 LEU H 1 78 LEU QD . . 3.760 3.480 2.507 3.658 . 0 0 "[ . 1 . 2]" 1
1966 1 78 LEU H 1 78 LEU MD2 . . 4.390 3.742 2.522 4.362 . 0 0 "[ . 1 . 2]" 1
1967 1 78 LEU H 1 79 GLY H . . 4.760 4.487 4.377 4.606 . 0 0 "[ . 1 . 2]" 1
1968 1 78 LEU H 1 80 LEU H . . 5.120 4.562 4.341 4.684 . 0 0 "[ . 1 . 2]" 1
1969 1 78 LEU HA 1 78 LEU MD1 . . 3.470 2.682 2.390 3.495 0.025 20 0 "[ . 1 . 2]" 1
1970 1 78 LEU HA 1 78 LEU QD . . 2.970 2.059 1.908 3.116 0.146 20 0 "[ . 1 . 2]" 1
1971 1 78 LEU HA 1 78 LEU MD2 . . 3.470 2.205 1.940 3.778 0.308 14 0 "[ . 1 . 2]" 1
1972 1 78 LEU HA 1 79 GLY H . . 2.670 2.168 2.143 2.338 . 0 0 "[ . 1 . 2]" 1
1973 1 78 LEU HA 1 79 GLY QA . . 4.450 3.927 3.900 4.036 . 0 0 "[ . 1 . 2]" 1
1974 1 78 LEU HA 1 80 LEU H . . 4.080 3.761 3.221 3.957 . 0 0 "[ . 1 . 2]" 1
1975 1 78 LEU HA 1 80 LEU MD2 . . 5.270 3.866 3.568 4.265 . 0 0 "[ . 1 . 2]" 1
1976 1 78 LEU QB 1 78 LEU MD1 . . 3.010 2.203 2.038 2.343 . 0 0 "[ . 1 . 2]" 1
1977 1 78 LEU QB 1 78 LEU MD2 . . 3.010 2.249 1.961 2.509 . 0 0 "[ . 1 . 2]" 1
1978 1 78 LEU QB 1 79 GLY H . . 3.800 3.689 3.305 3.833 0.033 2 0 "[ . 1 . 2]" 1
1979 1 78 LEU QB 1 79 GLY HA2 . . 4.930 4.814 4.393 4.941 0.011 20 0 "[ . 1 . 2]" 1
1980 1 78 LEU QB 1 79 GLY QA . . 4.140 4.012 3.754 4.123 . 0 0 "[ . 1 . 2]" 1
1981 1 78 LEU QB 1 79 GLY HA3 . . 4.930 4.295 4.070 4.417 . 0 0 "[ . 1 . 2]" 1
1982 1 78 LEU QD 1 79 GLY H . . 3.510 2.406 1.894 3.142 . 0 0 "[ . 1 . 2]" 1
1983 1 78 LEU MD1 1 79 GLY H . . 4.240 2.565 1.924 3.654 . 0 0 "[ . 1 . 2]" 1
1984 1 78 LEU MD1 1 79 GLY HA2 . . 5.500 3.265 2.790 5.306 . 0 0 "[ . 1 . 2]" 1
1985 1 78 LEU MD1 1 79 GLY HA3 . . 5.500 3.554 3.090 5.584 0.084 14 0 "[ . 1 . 2]" 1
1986 1 78 LEU MD1 1 80 LEU H . . 5.500 4.644 4.240 5.698 0.198 20 0 "[ . 1 . 2]" 1
1987 1 78 LEU MD2 1 79 GLY H . . 4.240 3.157 2.653 3.638 . 0 0 "[ . 1 . 2]" 1
1988 1 78 LEU MD2 1 79 GLY HA2 . . 5.500 4.689 3.025 5.534 0.034 13 0 "[ . 1 . 2]" 1
1989 1 78 LEU MD2 1 79 GLY HA3 . . 5.500 5.042 2.550 5.599 0.099 13 0 "[ . 1 . 2]" 1
1990 1 78 LEU MD2 1 80 LEU H . . 5.500 5.168 4.167 5.491 . 0 0 "[ . 1 . 2]" 1
1991 1 79 GLY H 1 80 LEU H . . 3.210 2.809 2.677 3.092 . 0 0 "[ . 1 . 2]" 1
1992 1 79 GLY QA 1 80 LEU H . . 3.050 2.763 2.684 2.869 . 0 0 "[ . 1 . 2]" 1
1993 1 79 GLY QA 1 80 LEU MD2 . . 4.450 3.267 3.095 3.401 . 0 0 "[ . 1 . 2]" 1
1994 1 79 GLY HA2 1 80 LEU MD2 . . 5.090 4.454 4.324 4.597 . 0 0 "[ . 1 . 2]" 1
1995 1 79 GLY HA3 1 80 LEU MD2 . . 5.090 3.361 3.170 3.504 . 0 0 "[ . 1 . 2]" 1
1996 1 80 LEU H 1 80 LEU QB . . 2.890 2.889 2.791 2.982 0.092 20 0 "[ . 1 . 2]" 1
1997 1 80 LEU H 1 80 LEU MD1 . . 3.790 3.654 3.589 3.802 0.012 20 0 "[ . 1 . 2]" 1
1998 1 80 LEU H 1 80 LEU MD2 . . 3.120 1.908 1.823 2.209 . 0 0 "[ . 1 . 2]" 1
1999 1 80 LEU H 1 80 LEU HG . . 3.070 2.128 1.999 2.274 . 0 0 "[ . 1 . 2]" 1
2000 1 80 LEU H 1 81 THR H . . 4.620 4.575 4.524 4.611 . 0 0 "[ . 1 . 2]" 1
2001 1 80 LEU H 1 81 THR MG . . 5.500 5.283 5.168 5.421 . 0 0 "[ . 1 . 2]" 1
2002 1 80 LEU H 1 84 GLU HB2 . . 5.500 5.369 5.325 5.419 . 0 0 "[ . 1 . 2]" 1
2003 1 80 LEU H 1 85 ALA MB . . 5.500 5.184 5.005 5.404 . 0 0 "[ . 1 . 2]" 1
2004 1 80 LEU HA 1 80 LEU MD1 . . 4.150 4.107 4.073 4.123 . 0 0 "[ . 1 . 2]" 1
2005 1 80 LEU HA 1 80 LEU MD2 . . 3.660 3.349 3.191 3.451 . 0 0 "[ . 1 . 2]" 1
2006 1 80 LEU HA 1 80 LEU HG . . 3.860 3.697 3.679 3.715 . 0 0 "[ . 1 . 2]" 1
2007 1 80 LEU HA 1 81 THR H . . 2.910 2.413 2.318 2.488 . 0 0 "[ . 1 . 2]" 1
2008 1 80 LEU HA 1 81 THR MG . . 3.960 3.531 3.358 3.754 . 0 0 "[ . 1 . 2]" 1
2009 1 80 LEU HA 1 84 GLU H . . 5.500 5.518 5.508 5.530 0.030 18 0 "[ . 1 . 2]" 1
2010 1 80 LEU HA 1 84 GLU HB2 . . 4.760 3.570 3.472 3.667 . 0 0 "[ . 1 . 2]" 1
2011 1 80 LEU HA 1 84 GLU HB3 . . 4.760 4.028 3.870 4.217 . 0 0 "[ . 1 . 2]" 1
2012 1 80 LEU HA 1 85 ALA H . . 5.500 5.409 5.244 5.511 0.011 12 0 "[ . 1 . 2]" 1
2013 1 80 LEU QB 1 80 LEU MD1 . . 3.100 1.952 1.921 2.017 . 0 0 "[ . 1 . 2]" 1
2014 1 80 LEU QB 1 80 LEU MD2 . . 3.170 2.072 1.989 2.185 . 0 0 "[ . 1 . 2]" 1
2015 1 80 LEU QB 1 81 THR H . . 3.400 2.380 2.223 2.578 . 0 0 "[ . 1 . 2]" 1
2016 1 80 LEU QB 1 81 THR MG . . 4.750 4.357 4.210 4.569 . 0 0 "[ . 1 . 2]" 1
2017 1 80 LEU QB 1 84 GLU H . . 4.180 3.936 3.859 4.043 . 0 0 "[ . 1 . 2]" 1
2018 1 80 LEU QB 1 84 GLU HB2 . . 3.920 1.977 1.969 1.983 . 0 0 "[ . 1 . 2]" 1
2019 1 80 LEU QB 1 84 GLU QG . . 4.370 3.151 2.873 3.464 . 0 0 "[ . 1 . 2]" 1
2020 1 80 LEU QB 1 85 ALA H . . 3.840 3.048 2.818 3.274 . 0 0 "[ . 1 . 2]" 1
2021 1 80 LEU QB 1 85 ALA MB . . 4.580 3.678 3.541 3.823 . 0 0 "[ . 1 . 2]" 1
2022 1 80 LEU MD1 1 81 THR H . . 4.130 4.019 3.823 4.146 0.016 12 0 "[ . 1 . 2]" 1
2023 1 80 LEU MD1 1 84 GLU H . . 4.570 4.430 4.300 4.549 . 0 0 "[ . 1 . 2]" 1
2024 1 80 LEU MD1 1 84 GLU HA . . 4.130 4.123 4.055 4.157 0.027 15 0 "[ . 1 . 2]" 1
2025 1 80 LEU MD1 1 84 GLU HB2 . . 3.640 3.084 2.941 3.200 . 0 0 "[ . 1 . 2]" 1
2026 1 80 LEU MD1 1 84 GLU HB3 . . 3.600 2.386 2.217 2.558 . 0 0 "[ . 1 . 2]" 1
2027 1 80 LEU MD1 1 84 GLU QG . . 4.300 4.173 4.052 4.292 . 0 0 "[ . 1 . 2]" 1
2028 1 80 LEU MD1 1 85 ALA H . . 3.570 2.557 2.335 2.766 . 0 0 "[ . 1 . 2]" 1
2029 1 80 LEU MD1 1 85 ALA HA . . 3.180 1.906 1.816 2.080 . 0 0 "[ . 1 . 2]" 1
2030 1 80 LEU MD1 1 87 GLN QB . . 5.500 5.209 5.088 5.387 . 0 0 "[ . 1 . 2]" 1
2031 1 80 LEU HG 1 81 THR H . . 4.400 4.356 4.263 4.414 0.014 5 0 "[ . 1 . 2]" 1
2032 1 80 LEU HG 1 84 GLU HB2 . . 4.570 4.508 4.431 4.574 0.004 18 0 "[ . 1 . 2]" 1
2033 1 80 LEU HG 1 84 GLU HB3 . . 4.540 4.382 4.293 4.468 . 0 0 "[ . 1 . 2]" 1
2034 1 80 LEU HG 1 85 ALA HA . . 4.290 4.173 4.006 4.288 . 0 0 "[ . 1 . 2]" 1
2035 1 81 THR H 1 81 THR MG . . 3.100 2.668 2.341 2.883 . 0 0 "[ . 1 . 2]" 1
2036 1 81 THR H 1 82 HIS H . . 4.780 4.521 4.444 4.564 . 0 0 "[ . 1 . 2]" 1
2037 1 81 THR H 1 84 GLU H . . 4.060 3.337 3.212 3.569 . 0 0 "[ . 1 . 2]" 1
2038 1 81 THR H 1 84 GLU HA . . 5.170 4.930 4.801 5.172 0.002 12 0 "[ . 1 . 2]" 1
2039 1 81 THR H 1 84 GLU HB2 . . 3.270 2.012 1.890 2.242 . 0 0 "[ . 1 . 2]" 1
2040 1 81 THR H 1 84 GLU HB3 . . 3.660 3.442 3.303 3.664 0.004 12 0 "[ . 1 . 2]" 1
2041 1 81 THR H 1 84 GLU QG . . 4.370 3.053 2.670 3.591 . 0 0 "[ . 1 . 2]" 1
2042 1 81 THR H 1 85 ALA H . . 4.320 3.857 3.648 4.132 . 0 0 "[ . 1 . 2]" 1
2043 1 81 THR H 1 85 ALA MB . . 5.090 4.750 4.594 4.924 . 0 0 "[ . 1 . 2]" 1
2044 1 81 THR HA 1 82 HIS H . . 3.520 2.459 2.353 2.655 . 0 0 "[ . 1 . 2]" 1
2045 1 81 THR HB 1 82 HIS H . . 3.690 2.289 1.902 2.509 . 0 0 "[ . 1 . 2]" 1
2046 1 81 THR MG 1 82 HIS H . . 3.740 3.600 3.445 3.744 0.004 4 0 "[ . 1 . 2]" 1
2047 1 81 THR MG 1 83 GLY H . . 5.380 4.739 4.627 4.937 . 0 0 "[ . 1 . 2]" 1
2048 1 81 THR MG 1 84 GLU H . . 4.910 4.599 4.381 4.776 . 0 0 "[ . 1 . 2]" 1
2049 1 81 THR MG 1 84 GLU HB2 . . 4.770 4.282 3.999 4.472 . 0 0 "[ . 1 . 2]" 1
2050 1 81 THR MG 1 84 GLU QG . . 4.760 4.335 3.721 4.760 0.000 12 0 "[ . 1 . 2]" 1
2051 1 82 HIS H 1 82 HIS HB2 . . 3.680 2.211 2.178 2.244 . 0 0 "[ . 1 . 2]" 1
2052 1 82 HIS H 1 82 HIS HB3 . . 3.330 3.008 2.873 3.094 . 0 0 "[ . 1 . 2]" 1
2053 1 82 HIS H 1 82 HIS HD2 . . 4.610 4.402 4.265 4.573 . 0 0 "[ . 1 . 2]" 1
2054 1 82 HIS H 1 83 GLY H . . 3.610 3.128 2.926 3.293 . 0 0 "[ . 1 . 2]" 1
2055 1 82 HIS H 1 84 GLU H . . 5.020 4.467 4.357 4.589 . 0 0 "[ . 1 . 2]" 1
2056 1 82 HIS H 1 85 ALA H . . 5.120 4.687 4.616 4.857 . 0 0 "[ . 1 . 2]" 1
2057 1 82 HIS HA 1 82 HIS HD2 . . 3.610 2.491 2.395 2.597 . 0 0 "[ . 1 . 2]" 1
2058 1 82 HIS HA 1 85 ALA H . . 4.300 3.677 3.561 3.863 . 0 0 "[ . 1 . 2]" 1
2059 1 82 HIS HA 1 85 ALA MB . . 3.500 2.590 2.490 2.812 . 0 0 "[ . 1 . 2]" 1
2060 1 82 HIS HA 1 86 VAL H . . 4.640 3.820 3.616 4.009 . 0 0 "[ . 1 . 2]" 1
2061 1 82 HIS HA 1 86 VAL MG2 . . 3.790 3.527 3.342 3.795 0.005 20 0 "[ . 1 . 2]" 1
2062 1 82 HIS HB2 1 82 HIS HD2 . . 3.520 3.166 3.103 3.225 . 0 0 "[ . 1 . 2]" 1
2063 1 82 HIS HB2 1 83 GLY H . . 4.080 3.434 3.335 3.540 . 0 0 "[ . 1 . 2]" 1
2064 1 82 HIS HB2 1 85 ALA MB . . 5.090 4.892 4.770 5.036 . 0 0 "[ . 1 . 2]" 1
2065 1 82 HIS HB3 1 83 GLY H . . 3.330 2.232 2.024 2.363 . 0 0 "[ . 1 . 2]" 1
2066 1 82 HIS HB3 1 83 GLY HA2 . . 5.340 3.885 3.829 3.941 . 0 0 "[ . 1 . 2]" 1
2067 1 82 HIS HB3 1 83 GLY HA3 . . 5.340 4.198 4.123 4.273 . 0 0 "[ . 1 . 2]" 1
2068 1 82 HIS HB3 1 84 GLU H . . 5.020 4.929 4.800 5.021 0.001 7 0 "[ . 1 . 2]" 1
2069 1 82 HIS HB3 1 85 ALA MB . . 5.210 5.026 4.892 5.159 . 0 0 "[ . 1 . 2]" 1
2070 1 82 HIS HB3 1 86 VAL MG2 . . 5.340 4.065 3.808 4.310 . 0 0 "[ . 1 . 2]" 1
2071 1 82 HIS HD2 1 83 GLY H . . 5.500 5.512 5.440 5.534 0.034 7 0 "[ . 1 . 2]" 1
2072 1 82 HIS HD2 1 86 VAL MG2 . . 4.400 3.869 3.665 4.205 . 0 0 "[ . 1 . 2]" 1
2073 1 82 HIS HE1 1 86 VAL MG2 . . 3.800 3.661 3.234 3.807 0.007 5 0 "[ . 1 . 2]" 1
2074 1 83 GLY H 1 83 GLY HA3 . . 2.910 2.299 2.294 2.311 . 0 0 "[ . 1 . 2]" 1
2075 1 83 GLY H 1 84 GLU H . . 3.470 2.918 2.826 3.071 . 0 0 "[ . 1 . 2]" 1
2076 1 83 GLY H 1 84 GLU HB2 . . 5.370 4.850 4.743 4.983 . 0 0 "[ . 1 . 2]" 1
2077 1 83 GLY H 1 84 GLU QG . . 5.500 5.189 4.994 5.318 . 0 0 "[ . 1 . 2]" 1
2078 1 83 GLY H 1 85 ALA H . . 4.660 4.416 4.255 4.606 . 0 0 "[ . 1 . 2]" 1
2079 1 83 GLY H 1 85 ALA MB . . 5.500 4.845 4.728 4.932 . 0 0 "[ . 1 . 2]" 1
2080 1 83 GLY H 1 86 VAL H . . 5.120 4.860 4.735 4.929 . 0 0 "[ . 1 . 2]" 1
2081 1 83 GLY H 1 86 VAL HB . . 5.500 5.337 5.101 5.462 . 0 0 "[ . 1 . 2]" 1
2082 1 83 GLY H 1 86 VAL MG2 . . 4.560 4.389 4.234 4.554 . 0 0 "[ . 1 . 2]" 1
2083 1 83 GLY HA2 1 84 GLU QG . . 5.500 5.506 5.456 5.528 0.028 15 0 "[ . 1 . 2]" 1
2084 1 83 GLY HA2 1 85 ALA H . . 5.080 4.791 4.498 5.083 0.003 2 0 "[ . 1 . 2]" 1
2085 1 83 GLY HA2 1 86 VAL H . . 4.060 3.900 3.672 4.070 0.010 10 0 "[ . 1 . 2]" 1
2086 1 83 GLY HA2 1 86 VAL HB . . 3.860 3.119 2.780 3.335 . 0 0 "[ . 1 . 2]" 1
2087 1 83 GLY HA2 1 86 VAL MG1 . . 4.570 4.323 4.038 4.500 . 0 0 "[ . 1 . 2]" 1
2088 1 83 GLY HA2 1 86 VAL MG2 . . 3.830 3.222 3.042 3.504 . 0 0 "[ . 1 . 2]" 1
2089 1 83 GLY HA2 1 87 GLN H . . 4.560 4.190 3.886 4.418 . 0 0 "[ . 1 . 2]" 1
2090 1 83 GLY HA3 1 84 GLU H . . 3.430 2.728 2.611 2.813 . 0 0 "[ . 1 . 2]" 1
2091 1 83 GLY HA3 1 84 GLU HB2 . . 5.500 4.905 4.851 4.964 . 0 0 "[ . 1 . 2]" 1
2092 1 83 GLY HA3 1 84 GLU QG . . 5.500 4.415 4.358 4.468 . 0 0 "[ . 1 . 2]" 1
2093 1 83 GLY HA3 1 85 ALA H . . 5.340 4.877 4.586 5.123 . 0 0 "[ . 1 . 2]" 1
2094 1 83 GLY HA3 1 86 VAL H . . 5.500 4.984 4.773 5.136 . 0 0 "[ . 1 . 2]" 1
2095 1 84 GLU H 1 84 GLU HB2 . . 2.960 2.213 2.177 2.270 . 0 0 "[ . 1 . 2]" 1
2096 1 84 GLU H 1 84 GLU HB3 . . 3.700 3.509 3.484 3.540 . 0 0 "[ . 1 . 2]" 1
2097 1 84 GLU H 1 84 GLU QG . . 3.830 2.785 2.613 2.926 . 0 0 "[ . 1 . 2]" 1
2098 1 84 GLU H 1 85 ALA H . . 3.210 2.717 2.599 2.792 . 0 0 "[ . 1 . 2]" 1
2099 1 84 GLU H 1 85 ALA MB . . 4.420 4.292 4.120 4.425 0.005 12 0 "[ . 1 . 2]" 1
2100 1 84 GLU H 1 86 VAL H . . 4.390 4.297 4.154 4.396 0.006 12 0 "[ . 1 . 2]" 1
2101 1 84 GLU HA 1 84 GLU QG . . 3.110 2.376 2.144 2.608 . 0 0 "[ . 1 . 2]" 1
2102 1 84 GLU HA 1 85 ALA MB . . 5.060 5.025 5.010 5.037 . 0 0 "[ . 1 . 2]" 1
2103 1 84 GLU HB2 1 85 ALA H . . 3.390 2.637 2.509 2.745 . 0 0 "[ . 1 . 2]" 1
2104 1 84 GLU HB2 1 85 ALA HA . . 4.910 4.618 4.570 4.661 . 0 0 "[ . 1 . 2]" 1
2105 1 84 GLU HB2 1 85 ALA MB . . 4.450 4.197 4.137 4.262 . 0 0 "[ . 1 . 2]" 1
2106 1 84 GLU HB2 1 86 VAL H . . 5.380 5.225 5.068 5.320 . 0 0 "[ . 1 . 2]" 1
2107 1 84 GLU HB3 1 85 ALA H . . 3.810 3.141 2.886 3.351 . 0 0 "[ . 1 . 2]" 1
2108 1 84 GLU HB3 1 85 ALA HA . . 4.910 4.010 3.905 4.106 . 0 0 "[ . 1 . 2]" 1
2109 1 84 GLU HB3 1 85 ALA MB . . 4.760 4.428 4.344 4.514 . 0 0 "[ . 1 . 2]" 1
2110 1 84 GLU QG 1 85 ALA H . . 4.640 4.260 4.210 4.310 . 0 0 "[ . 1 . 2]" 1
2111 1 85 ALA H 1 85 ALA MB . . 2.890 2.176 2.033 2.237 . 0 0 "[ . 1 . 2]" 1
2112 1 85 ALA H 1 86 VAL H . . 3.300 2.869 2.738 2.974 . 0 0 "[ . 1 . 2]" 1
2113 1 85 ALA H 1 86 VAL HA . . 5.500 5.426 5.321 5.511 0.011 11 0 "[ . 1 . 2]" 1
2114 1 85 ALA H 1 86 VAL HB . . 5.310 4.977 4.764 5.133 . 0 0 "[ . 1 . 2]" 1
2115 1 85 ALA H 1 86 VAL MG2 . . 4.550 4.384 4.230 4.521 . 0 0 "[ . 1 . 2]" 1
2116 1 85 ALA H 1 87 GLN H . . 4.860 4.625 4.527 4.755 . 0 0 "[ . 1 . 2]" 1
2117 1 85 ALA H 1 87 GLN QB . . 5.500 5.309 5.209 5.417 . 0 0 "[ . 1 . 2]" 1
2118 1 85 ALA H 1 88 LEU H . . 5.150 4.882 4.812 4.929 . 0 0 "[ . 1 . 2]" 1
2119 1 85 ALA HA 1 87 GLN QB . . 5.410 5.346 5.227 5.418 0.008 7 0 "[ . 1 . 2]" 1
2120 1 85 ALA HA 1 88 LEU H . . 3.800 3.613 3.511 3.711 . 0 0 "[ . 1 . 2]" 1
2121 1 85 ALA HA 1 88 LEU HB2 . . 3.750 2.817 2.681 2.929 . 0 0 "[ . 1 . 2]" 1
2122 1 85 ALA HA 1 88 LEU HB3 . . 3.830 3.228 3.147 3.315 . 0 0 "[ . 1 . 2]" 1
2123 1 85 ALA HA 1 88 LEU MD1 . . 3.680 2.987 2.819 3.192 . 0 0 "[ . 1 . 2]" 1
2124 1 85 ALA HA 1 89 LEU H . . 5.000 4.811 4.685 4.918 . 0 0 "[ . 1 . 2]" 1
2125 1 85 ALA MB 1 86 VAL H . . 3.270 2.434 2.237 2.587 . 0 0 "[ . 1 . 2]" 1
2126 1 85 ALA MB 1 86 VAL HA . . 4.180 3.745 3.653 3.802 . 0 0 "[ . 1 . 2]" 1
2127 1 85 ALA MB 1 86 VAL HB . . 4.760 4.571 4.475 4.671 . 0 0 "[ . 1 . 2]" 1
2128 1 85 ALA MB 1 86 VAL MG1 . . 5.500 4.947 4.889 4.987 . 0 0 "[ . 1 . 2]" 1
2129 1 85 ALA MB 1 86 VAL MG2 . . 3.910 3.184 3.013 3.346 . 0 0 "[ . 1 . 2]" 1
2130 1 85 ALA MB 1 87 GLN H . . 4.980 4.763 4.680 4.868 . 0 0 "[ . 1 . 2]" 1
2131 1 85 ALA MB 1 88 LEU H . . 4.610 4.479 4.389 4.551 . 0 0 "[ . 1 . 2]" 1
2132 1 85 ALA MB 1 89 LEU H . . 5.240 4.953 4.706 5.091 . 0 0 "[ . 1 . 2]" 1
2133 1 86 VAL H 1 86 VAL HB . . 3.000 2.521 2.454 2.616 . 0 0 "[ . 1 . 2]" 1
2134 1 86 VAL H 1 86 VAL MG1 . . 3.910 3.761 3.753 3.774 . 0 0 "[ . 1 . 2]" 1
2135 1 86 VAL H 1 86 VAL MG2 . . 2.970 2.158 1.968 2.320 . 0 0 "[ . 1 . 2]" 1
2136 1 86 VAL H 1 87 GLN H . . 3.220 2.970 2.861 3.162 . 0 0 "[ . 1 . 2]" 1
2137 1 86 VAL H 1 87 GLN QB . . 5.060 4.844 4.717 5.015 . 0 0 "[ . 1 . 2]" 1
2138 1 86 VAL H 1 87 GLN QG . . 5.090 4.591 4.408 4.728 . 0 0 "[ . 1 . 2]" 1
2139 1 86 VAL H 1 88 LEU H . . 4.470 3.915 3.847 3.984 . 0 0 "[ . 1 . 2]" 1
2140 1 86 VAL H 1 88 LEU HB2 . . 5.240 5.064 4.997 5.153 . 0 0 "[ . 1 . 2]" 1
2141 1 86 VAL HA 1 86 VAL MG1 . . 3.150 2.454 2.392 2.494 . 0 0 "[ . 1 . 2]" 1
2142 1 86 VAL HA 1 86 VAL MG2 . . 3.000 2.326 2.205 2.422 . 0 0 "[ . 1 . 2]" 1
2143 1 86 VAL HA 1 88 LEU H . . 4.560 3.858 3.702 3.977 . 0 0 "[ . 1 . 2]" 1
2144 1 86 VAL HA 1 89 LEU H . . 3.850 3.310 3.211 3.406 . 0 0 "[ . 1 . 2]" 1
2145 1 86 VAL HA 1 89 LEU HB2 . . 4.920 4.753 4.670 4.844 . 0 0 "[ . 1 . 2]" 1
2146 1 86 VAL HA 1 89 LEU HB3 . . 3.620 3.242 3.193 3.324 . 0 0 "[ . 1 . 2]" 1
2147 1 86 VAL HA 1 89 LEU MD1 . . 4.640 4.481 4.306 4.615 . 0 0 "[ . 1 . 2]" 1
2148 1 86 VAL HA 1 89 LEU MD2 . . 3.560 2.041 1.958 2.222 . 0 0 "[ . 1 . 2]" 1
2149 1 86 VAL HA 1 89 LEU HG . . 4.130 3.291 3.057 3.555 . 0 0 "[ . 1 . 2]" 1
2150 1 86 VAL HA 1 90 ARG H . . 4.790 4.573 4.322 4.759 . 0 0 "[ . 1 . 2]" 1
2151 1 86 VAL HB 1 87 GLN H . . 3.220 2.242 2.122 2.326 . 0 0 "[ . 1 . 2]" 1
2152 1 86 VAL MG1 1 87 GLN H . . 3.580 2.986 2.790 3.213 . 0 0 "[ . 1 . 2]" 1
2153 1 86 VAL MG1 1 87 GLN HA . . 3.680 3.182 3.024 3.399 . 0 0 "[ . 1 . 2]" 1
2154 1 86 VAL MG1 1 87 GLN QB . . 4.760 4.430 4.281 4.578 . 0 0 "[ . 1 . 2]" 1
2155 1 86 VAL MG1 1 87 GLN HE21 . . 5.500 2.383 1.997 3.211 . 0 0 "[ . 1 . 2]" 1
2156 1 86 VAL MG1 1 87 GLN QE . . 4.770 2.270 1.785 2.957 . 0 0 "[ . 1 . 2]" 1
2157 1 86 VAL MG1 1 87 GLN HE22 . . 5.500 2.911 2.009 3.461 . 0 0 "[ . 1 . 2]" 1
2158 1 86 VAL MG1 1 87 GLN QG . . 4.540 3.752 3.426 3.976 . 0 0 "[ . 1 . 2]" 1
2159 1 86 VAL MG1 1 88 LEU H . . 4.720 4.387 4.293 4.490 . 0 0 "[ . 1 . 2]" 1
2160 1 86 VAL MG1 1 89 LEU H . . 4.290 4.124 4.024 4.240 . 0 0 "[ . 1 . 2]" 1
2161 1 86 VAL MG1 1 89 LEU HB2 . . 5.350 5.308 5.237 5.352 0.002 5 0 "[ . 1 . 2]" 1
2162 1 86 VAL MG1 1 90 ARG H . . 4.150 3.961 3.685 4.165 0.015 12 0 "[ . 1 . 2]" 1
2163 1 86 VAL MG1 1 90 ARG HB2 . . 5.210 4.963 4.638 5.165 . 0 0 "[ . 1 . 2]" 1
2164 1 86 VAL MG1 1 90 ARG QB . . 4.340 3.732 3.386 3.979 . 0 0 "[ . 1 . 2]" 1
2165 1 86 VAL MG1 1 90 ARG HB3 . . 5.210 3.859 3.480 4.138 . 0 0 "[ . 1 . 2]" 1
2166 1 86 VAL MG1 1 90 ARG QD . . 3.480 3.050 2.021 3.450 . 0 0 "[ . 1 . 2]" 1
2167 1 86 VAL MG1 1 90 ARG HG2 . . 4.600 2.851 2.666 3.383 . 0 0 "[ . 1 . 2]" 1
2168 1 86 VAL MG1 1 90 ARG QG . . 3.850 2.810 2.635 3.276 . 0 0 "[ . 1 . 2]" 1
2169 1 86 VAL MG1 1 90 ARG HG3 . . 4.600 4.279 3.999 4.457 . 0 0 "[ . 1 . 2]" 1
2170 1 86 VAL MG2 1 87 GLN H . . 3.800 3.749 3.651 3.806 0.006 6 0 "[ . 1 . 2]" 1
2171 1 86 VAL MG2 1 87 GLN HE21 . . 5.500 4.178 3.898 4.538 . 0 0 "[ . 1 . 2]" 1
2172 1 86 VAL MG2 1 87 GLN QE . . 4.770 4.011 3.681 4.327 . 0 0 "[ . 1 . 2]" 1
2173 1 86 VAL MG2 1 87 GLN HE22 . . 5.500 5.180 4.521 5.492 . 0 0 "[ . 1 . 2]" 1
2174 1 86 VAL MG2 1 87 GLN QG . . 4.840 4.720 4.601 4.835 . 0 0 "[ . 1 . 2]" 1
2175 1 87 GLN H 1 87 GLN QB . . 2.790 2.495 2.419 2.602 . 0 0 "[ . 1 . 2]" 1
2176 1 87 GLN H 1 87 GLN QG . . 3.360 2.171 1.998 2.318 . 0 0 "[ . 1 . 2]" 1
2177 1 87 GLN H 1 89 LEU H . . 4.700 4.276 4.233 4.336 . 0 0 "[ . 1 . 2]" 1
2178 1 87 GLN H 1 90 ARG QD . . 5.080 4.261 3.649 5.082 0.002 15 0 "[ . 1 . 2]" 1
2179 1 87 GLN H 1 90 ARG QG . . 4.410 3.893 3.742 4.113 . 0 0 "[ . 1 . 2]" 1
2180 1 87 GLN HA 1 87 GLN HE21 . . 4.720 2.956 2.190 3.548 . 0 0 "[ . 1 . 2]" 1
2181 1 87 GLN HA 1 87 GLN QE . . 4.080 2.746 2.136 3.172 . 0 0 "[ . 1 . 2]" 1
2182 1 87 GLN HA 1 87 GLN HE22 . . 4.720 3.292 2.898 3.574 . 0 0 "[ . 1 . 2]" 1
2183 1 87 GLN HA 1 87 GLN QG . . 3.350 3.014 2.967 3.128 . 0 0 "[ . 1 . 2]" 1
2184 1 87 GLN HA 1 88 LEU H . . 3.460 3.448 3.406 3.470 0.010 1 0 "[ . 1 . 2]" 1
2185 1 87 GLN HA 1 90 ARG H . . 3.910 3.352 3.285 3.415 . 0 0 "[ . 1 . 2]" 1
2186 1 87 GLN HA 1 90 ARG HA . . 5.500 5.537 5.514 5.592 0.092 8 0 "[ . 1 . 2]" 1
2187 1 87 GLN HA 1 90 ARG QB . . 4.520 3.910 3.885 3.998 . 0 0 "[ . 1 . 2]" 1
2188 1 87 GLN HA 1 90 ARG QD . . 3.620 2.213 1.978 3.101 . 0 0 "[ . 1 . 2]" 1
2189 1 87 GLN HA 1 90 ARG HG2 . . 4.200 2.021 1.961 2.233 . 0 0 "[ . 1 . 2]" 1
2190 1 87 GLN HA 1 90 ARG QG . . 3.450 1.890 1.872 1.923 . 0 0 "[ . 1 . 2]" 1
2191 1 87 GLN HA 1 90 ARG HG3 . . 4.200 2.304 2.073 2.774 . 0 0 "[ . 1 . 2]" 1
2192 1 87 GLN QB 1 88 LEU H . . 3.250 2.939 2.868 3.071 . 0 0 "[ . 1 . 2]" 1
2193 1 87 GLN QB 1 88 LEU HA . . 4.640 3.975 3.950 4.026 . 0 0 "[ . 1 . 2]" 1
2194 1 87 GLN QB 1 88 LEU HB2 . . 4.760 4.154 4.109 4.194 . 0 0 "[ . 1 . 2]" 1
2195 1 87 GLN QB 1 88 LEU MD1 . . 5.500 5.460 5.238 5.538 0.038 20 0 "[ . 1 . 2]" 1
2196 1 87 GLN QB 1 88 LEU HG . . 5.410 5.318 5.202 5.359 . 0 0 "[ . 1 . 2]" 1
2197 1 87 GLN QB 1 89 LEU H . . 5.130 4.764 4.696 4.815 . 0 0 "[ . 1 . 2]" 1
2198 1 87 GLN QB 1 90 ARG H . . 4.950 4.794 4.714 4.895 . 0 0 "[ . 1 . 2]" 1
2199 1 87 GLN QE 1 90 ARG QD . . 4.560 2.074 1.951 2.456 . 0 0 "[ . 1 . 2]" 1
2200 1 87 GLN HE21 1 90 ARG QD . . 5.370 2.995 2.773 3.453 . 0 0 "[ . 1 . 2]" 1
2201 1 87 GLN HE22 1 90 ARG QD . . 5.370 2.116 1.982 2.513 . 0 0 "[ . 1 . 2]" 1
2202 1 87 GLN QG 1 88 LEU H . . 4.410 4.246 4.099 4.408 . 0 0 "[ . 1 . 2]" 1
2203 1 87 GLN QG 1 90 ARG QD . . 5.090 3.761 3.541 4.663 . 0 0 "[ . 1 . 2]" 1
2204 1 88 LEU H 1 88 LEU HB2 . . 3.200 2.260 2.216 2.327 . 0 0 "[ . 1 . 2]" 1
2205 1 88 LEU H 1 88 LEU HB3 . . 3.050 2.845 2.820 2.897 . 0 0 "[ . 1 . 2]" 1
2206 1 88 LEU H 1 88 LEU MD2 . . 4.420 4.260 4.231 4.284 . 0 0 "[ . 1 . 2]" 1
2207 1 88 LEU H 1 88 LEU HG . . 4.370 4.256 4.191 4.319 . 0 0 "[ . 1 . 2]" 1
2208 1 88 LEU H 1 89 LEU H . . 3.210 2.446 2.333 2.521 . 0 0 "[ . 1 . 2]" 1
2209 1 88 LEU H 1 89 LEU HB3 . . 4.730 4.475 4.386 4.534 . 0 0 "[ . 1 . 2]" 1
2210 1 88 LEU H 1 89 LEU MD2 . . 4.910 4.793 4.625 4.912 0.002 13 0 "[ . 1 . 2]" 1
2211 1 88 LEU H 1 89 LEU HG . . 4.910 4.707 4.519 4.843 . 0 0 "[ . 1 . 2]" 1
2212 1 88 LEU H 1 90 ARG QG . . 5.340 4.002 3.926 4.197 . 0 0 "[ . 1 . 2]" 1
2213 1 88 LEU HA 1 88 LEU MD2 . . 3.040 2.533 2.266 2.914 . 0 0 "[ . 1 . 2]" 1
2214 1 88 LEU HA 1 88 LEU HG . . 3.400 2.476 2.329 2.551 . 0 0 "[ . 1 . 2]" 1
2215 1 88 LEU HA 1 90 ARG H . . 4.360 4.207 4.038 4.320 . 0 0 "[ . 1 . 2]" 1
2216 1 88 LEU HB2 1 88 LEU MD1 . . 2.970 2.294 2.171 2.421 . 0 0 "[ . 1 . 2]" 1
2217 1 88 LEU HB2 1 88 LEU MD2 . . 3.330 3.189 3.157 3.194 . 0 0 "[ . 1 . 2]" 1
2218 1 88 LEU HB2 1 89 LEU H . . 3.880 3.701 3.631 3.757 . 0 0 "[ . 1 . 2]" 1
2219 1 88 LEU HB3 1 88 LEU MD1 . . 3.060 2.349 2.221 2.481 . 0 0 "[ . 1 . 2]" 1
2220 1 88 LEU HB3 1 88 LEU MD2 . . 3.540 2.296 2.175 2.416 . 0 0 "[ . 1 . 2]" 1
2221 1 88 LEU HB3 1 89 LEU H . . 3.890 2.901 2.798 2.991 . 0 0 "[ . 1 . 2]" 1
2222 1 88 LEU MD2 1 89 LEU H . . 4.540 3.910 3.822 3.987 . 0 0 "[ . 1 . 2]" 1
2223 1 88 LEU MD2 1 89 LEU HA . . 4.130 3.524 3.420 3.692 . 0 0 "[ . 1 . 2]" 1
2224 1 88 LEU MD2 1 91 SER QB . . 4.180 3.229 3.076 4.035 . 0 0 "[ . 1 . 2]" 1
2225 1 89 LEU H 1 89 LEU HB3 . . 3.100 2.317 2.277 2.369 . 0 0 "[ . 1 . 2]" 1
2226 1 89 LEU H 1 89 LEU MD1 . . 4.070 3.999 3.932 4.070 . 0 0 "[ . 1 . 2]" 1
2227 1 89 LEU H 1 89 LEU MD2 . . 3.480 3.394 3.278 3.479 . 0 0 "[ . 1 . 2]" 1
2228 1 89 LEU H 1 89 LEU HG . . 3.180 2.762 2.678 2.807 . 0 0 "[ . 1 . 2]" 1
2229 1 89 LEU H 1 92 VAL QG . . 5.440 5.318 4.963 5.492 0.052 12 0 "[ . 1 . 2]" 1
2230 1 89 LEU HA 1 89 LEU MD1 . . 3.390 3.269 3.209 3.345 . 0 0 "[ . 1 . 2]" 1
2231 1 89 LEU HA 1 89 LEU MD2 . . 4.340 4.120 4.102 4.139 . 0 0 "[ . 1 . 2]" 1
2232 1 89 LEU HA 1 89 LEU HG . . 3.910 3.709 3.671 3.741 . 0 0 "[ . 1 . 2]" 1
2233 1 89 LEU HA 1 90 ARG HA . . 4.760 4.627 4.610 4.646 . 0 0 "[ . 1 . 2]" 1
2234 1 89 LEU HA 1 91 SER H . . 4.640 3.748 3.642 3.895 . 0 0 "[ . 1 . 2]" 1
2235 1 89 LEU HA 1 92 VAL H . . 5.210 5.143 4.785 5.220 0.010 7 0 "[ . 1 . 2]" 1
2236 1 89 LEU HA 1 92 VAL QG . . 3.920 3.592 3.050 3.841 . 0 0 "[ . 1 . 2]" 1
2237 1 89 LEU HA 1 96 LEU MD1 . . 3.830 2.998 2.780 3.273 . 0 0 "[ . 1 . 2]" 1
2238 1 89 LEU HB2 1 89 LEU MD1 . . 3.140 2.143 2.068 2.211 . 0 0 "[ . 1 . 2]" 1
2239 1 89 LEU HB2 1 89 LEU MD2 . . 3.410 2.594 2.495 2.696 . 0 0 "[ . 1 . 2]" 1
2240 1 89 LEU HB2 1 90 ARG H . . 4.250 4.166 4.092 4.249 . 0 0 "[ . 1 . 2]" 1
2241 1 89 LEU HB2 1 91 SER H . . 5.500 5.385 5.269 5.494 . 0 0 "[ . 1 . 2]" 1
2242 1 89 LEU HB3 1 89 LEU MD1 . . 3.410 3.143 3.124 3.156 . 0 0 "[ . 1 . 2]" 1
2243 1 89 LEU HB3 1 89 LEU MD2 . . 3.170 2.096 1.967 2.243 . 0 0 "[ . 1 . 2]" 1
2244 1 89 LEU HB3 1 90 ARG H . . 4.300 3.759 3.689 3.843 . 0 0 "[ . 1 . 2]" 1
2245 1 89 LEU MD1 1 90 ARG H . . 4.000 3.209 2.983 3.422 . 0 0 "[ . 1 . 2]" 1
2246 1 89 LEU MD1 1 90 ARG QB . . 4.670 2.672 2.429 2.981 . 0 0 "[ . 1 . 2]" 1
2247 1 89 LEU MD1 1 92 VAL QG . . 3.830 3.630 3.513 3.779 . 0 0 "[ . 1 . 2]" 1
2248 1 89 LEU HG 1 90 ARG H . . 3.780 2.294 2.147 2.519 . 0 0 "[ . 1 . 2]" 1
2249 1 90 ARG H 1 90 ARG HB2 . . 3.690 3.621 3.586 3.664 . 0 0 "[ . 1 . 2]" 1
2250 1 90 ARG H 1 90 ARG QB . . 3.130 2.822 2.708 2.920 . 0 0 "[ . 1 . 2]" 1
2251 1 90 ARG H 1 90 ARG HB3 . . 3.690 2.945 2.793 3.092 . 0 0 "[ . 1 . 2]" 1
2252 1 90 ARG H 1 90 ARG QD . . 4.200 3.912 3.410 4.106 . 0 0 "[ . 1 . 2]" 1
2253 1 90 ARG H 1 90 ARG HG2 . . 3.860 2.074 1.890 2.361 . 0 0 "[ . 1 . 2]" 1
2254 1 90 ARG H 1 90 ARG QG . . 3.250 1.985 1.867 2.198 . 0 0 "[ . 1 . 2]" 1
2255 1 90 ARG H 1 90 ARG HG3 . . 3.860 2.612 2.410 3.362 . 0 0 "[ . 1 . 2]" 1
2256 1 90 ARG H 1 91 SER H . . 3.070 2.375 2.264 2.527 . 0 0 "[ . 1 . 2]" 1
2257 1 90 ARG H 1 91 SER HA . . 5.080 4.840 4.758 4.894 . 0 0 "[ . 1 . 2]" 1
2258 1 90 ARG H 1 91 SER QB . . 4.890 3.993 3.920 4.168 . 0 0 "[ . 1 . 2]" 1
2259 1 90 ARG H 1 92 VAL H . . 4.780 4.632 4.423 4.760 . 0 0 "[ . 1 . 2]" 1
2260 1 90 ARG H 1 92 VAL QG . . 4.680 4.367 4.218 4.492 . 0 0 "[ . 1 . 2]" 1
2261 1 90 ARG HA 1 90 ARG QD . . 4.550 4.435 4.187 4.569 0.019 3 0 "[ . 1 . 2]" 1
2262 1 90 ARG HA 1 90 ARG HG2 . . 4.030 3.768 3.638 3.923 . 0 0 "[ . 1 . 2]" 1
2263 1 90 ARG HA 1 90 ARG QG . . 3.470 3.331 3.308 3.343 . 0 0 "[ . 1 . 2]" 1
2264 1 90 ARG HA 1 90 ARG HG3 . . 4.030 3.718 3.623 3.898 . 0 0 "[ . 1 . 2]" 1
2265 1 90 ARG HA 1 91 SER H . . 3.400 3.249 3.159 3.323 . 0 0 "[ . 1 . 2]" 1
2266 1 90 ARG HA 1 92 VAL H . . 4.850 3.290 3.122 3.419 . 0 0 "[ . 1 . 2]" 1
2267 1 90 ARG QB 1 90 ARG QD . . 3.180 2.239 1.984 2.418 . 0 0 "[ . 1 . 2]" 1
2268 1 90 ARG QB 1 91 SER H . . 3.890 3.855 3.783 3.938 0.048 15 0 "[ . 1 . 2]" 1
2269 1 90 ARG HB2 1 91 SER H . . 4.450 4.229 4.106 4.384 . 0 0 "[ . 1 . 2]" 1
2270 1 90 ARG HB3 1 91 SER H . . 4.450 4.446 4.375 4.472 0.022 5 0 "[ . 1 . 2]" 1
2271 1 90 ARG QD 1 91 SER H . . 5.240 5.047 4.901 5.180 . 0 0 "[ . 1 . 2]" 1
2272 1 90 ARG QG 1 91 SER H . . 3.460 3.043 2.861 3.174 . 0 0 "[ . 1 . 2]" 1
2273 1 90 ARG HG2 1 91 SER H . . 4.230 3.877 3.316 4.239 0.009 15 0 "[ . 1 . 2]" 1
2274 1 90 ARG HG3 1 91 SER H . . 4.230 3.211 2.938 3.943 . 0 0 "[ . 1 . 2]" 1
2275 1 91 SER H 1 91 SER QB . . 2.840 2.316 2.202 2.378 . 0 0 "[ . 1 . 2]" 1
2276 1 91 SER H 1 92 VAL H . . 3.230 2.857 2.625 2.968 . 0 0 "[ . 1 . 2]" 1
2277 1 91 SER H 1 92 VAL HB . . 5.150 4.729 4.456 5.104 . 0 0 "[ . 1 . 2]" 1
2278 1 91 SER H 1 92 VAL QG . . 3.740 3.352 3.010 3.691 . 0 0 "[ . 1 . 2]" 1
2279 1 91 SER H 1 96 LEU MD1 . . 5.500 5.250 5.002 5.468 . 0 0 "[ . 1 . 2]" 1
2280 1 91 SER HA 1 92 VAL H . . 3.260 2.937 2.847 3.083 . 0 0 "[ . 1 . 2]" 1
2281 1 91 SER HA 1 92 VAL HB . . 5.500 5.513 5.482 5.601 0.101 20 0 "[ . 1 . 2]" 1
2282 1 91 SER HA 1 92 VAL QG . . 4.610 4.323 4.238 4.506 . 0 0 "[ . 1 . 2]" 1
2283 1 91 SER QB 1 92 VAL H . . 3.890 3.828 3.695 3.985 0.095 20 0 "[ . 1 . 2]" 1
2284 1 91 SER QB 1 92 VAL QG . . 4.690 4.260 3.710 4.720 0.030 12 0 "[ . 1 . 2]" 1
2285 1 92 VAL H 1 92 VAL HB . . 3.480 2.973 2.593 3.178 . 0 0 "[ . 1 . 2]" 1
2286 1 92 VAL H 1 92 VAL MG1 . . 3.840 2.528 1.862 3.828 . 0 0 "[ . 1 . 2]" 1
2287 1 92 VAL H 1 92 VAL QG . . 2.840 2.036 1.857 2.274 . 0 0 "[ . 1 . 2]" 1
2288 1 92 VAL H 1 92 VAL MG2 . . 3.840 3.315 2.123 3.808 . 0 0 "[ . 1 . 2]" 1
2289 1 92 VAL H 1 93 GLY H . . 4.640 4.525 4.466 4.609 . 0 0 "[ . 1 . 2]" 1
2290 1 92 VAL HA 1 92 VAL MG1 . . 3.250 2.938 2.251 3.197 . 0 0 "[ . 1 . 2]" 1
2291 1 92 VAL HA 1 92 VAL QG . . 2.820 2.280 2.098 2.425 . 0 0 "[ . 1 . 2]" 1
2292 1 92 VAL HA 1 92 VAL MG2 . . 3.250 2.432 2.347 2.526 . 0 0 "[ . 1 . 2]" 1
2293 1 92 VAL HA 1 93 GLY H . . 2.830 2.252 2.188 2.436 . 0 0 "[ . 1 . 2]" 1
2294 1 92 VAL HA 1 96 LEU HB2 . . 5.340 4.769 4.522 4.972 . 0 0 "[ . 1 . 2]" 1
2295 1 92 VAL HB 1 93 GLY H . . 3.960 3.844 3.387 3.994 0.034 5 0 "[ . 1 . 2]" 1
2296 1 92 VAL HB 1 95 THR H . . 5.500 5.278 4.760 5.512 0.012 11 0 "[ . 1 . 2]" 1
2297 1 92 VAL HB 1 96 LEU HB2 . . 4.820 3.307 2.529 4.811 . 0 0 "[ . 1 . 2]" 1
2298 1 92 VAL HB 1 96 LEU HB3 . . 4.540 2.924 2.304 3.618 . 0 0 "[ . 1 . 2]" 1
2299 1 92 VAL HB 1 96 LEU MD1 . . 4.370 3.600 3.143 4.356 . 0 0 "[ . 1 . 2]" 1
2300 1 92 VAL HB 1 96 LEU MD2 . . 4.540 4.389 4.129 4.522 . 0 0 "[ . 1 . 2]" 1
2301 1 92 VAL QG 1 93 GLY H . . 3.140 1.922 1.756 2.170 . 0 0 "[ . 1 . 2]" 1
2302 1 92 VAL QG 1 93 GLY HA2 . . 4.970 3.742 3.544 3.841 . 0 0 "[ . 1 . 2]" 1
2303 1 92 VAL QG 1 93 GLY HA3 . . 4.720 3.475 3.380 3.649 . 0 0 "[ . 1 . 2]" 1
2304 1 92 VAL QG 1 94 ASP H . . 4.890 3.230 2.662 3.524 . 0 0 "[ . 1 . 2]" 1
2305 1 92 VAL QG 1 94 ASP QB . . 4.850 4.717 4.444 4.852 0.002 13 0 "[ . 1 . 2]" 1
2306 1 92 VAL QG 1 95 THR H . . 3.380 2.494 2.353 2.725 . 0 0 "[ . 1 . 2]" 1
2307 1 92 VAL QG 1 96 LEU H . . 5.280 2.903 2.728 3.034 . 0 0 "[ . 1 . 2]" 1
2308 1 92 VAL QG 1 96 LEU HA . . 3.860 2.265 2.033 2.646 . 0 0 "[ . 1 . 2]" 1
2309 1 92 VAL QG 1 96 LEU HB2 . . 3.750 2.337 1.938 2.886 . 0 0 "[ . 1 . 2]" 1
2310 1 92 VAL QG 1 96 LEU HB3 . . 4.080 1.759 1.667 1.853 . 0 0 "[ . 1 . 2]" 1
2311 1 92 VAL QG 1 96 LEU MD1 . . 3.070 2.401 1.923 2.785 . 0 0 "[ . 1 . 2]" 1
2312 1 92 VAL QG 1 96 LEU MD2 . . 3.010 2.724 2.504 2.891 . 0 0 "[ . 1 . 2]" 1
2313 1 92 VAL QG 1 97 THR H . . 4.590 3.968 3.832 4.325 . 0 0 "[ . 1 . 2]" 1
2314 1 92 VAL MG1 1 93 GLY H . . 4.080 3.319 1.759 4.030 . 0 0 "[ . 1 . 2]" 1
2315 1 92 VAL MG1 1 96 LEU HA . . 4.540 3.768 2.594 4.469 . 0 0 "[ . 1 . 2]" 1
2316 1 92 VAL MG1 1 96 LEU HB2 . . 4.430 3.110 2.613 3.555 . 0 0 "[ . 1 . 2]" 1
2317 1 92 VAL MG1 1 96 LEU MD2 . . 3.820 2.949 2.611 3.284 . 0 0 "[ . 1 . 2]" 1
2318 1 92 VAL MG1 1 97 THR H . . 5.500 5.133 4.395 5.506 0.006 20 0 "[ . 1 . 2]" 1
2319 1 92 VAL MG2 1 93 GLY H . . 4.080 2.545 1.870 3.994 . 0 0 "[ . 1 . 2]" 1
2320 1 92 VAL MG2 1 96 LEU HA . . 4.540 2.563 2.038 3.802 . 0 0 "[ . 1 . 2]" 1
2321 1 92 VAL MG2 1 96 LEU HB2 . . 4.430 2.424 1.964 3.053 . 0 0 "[ . 1 . 2]" 1
2322 1 92 VAL MG2 1 96 LEU MD2 . . 3.820 3.227 2.940 3.421 . 0 0 "[ . 1 . 2]" 1
2323 1 92 VAL MG2 1 97 THR H . . 5.500 4.193 3.984 4.670 . 0 0 "[ . 1 . 2]" 1
2324 1 93 GLY H 1 94 ASP H . . 3.960 3.284 2.568 3.616 . 0 0 "[ . 1 . 2]" 1
2325 1 93 GLY H 1 94 ASP HA . . 5.500 5.277 4.854 5.469 . 0 0 "[ . 1 . 2]" 1
2326 1 93 GLY H 1 95 THR H . . 4.180 3.624 3.254 3.893 . 0 0 "[ . 1 . 2]" 1
2327 1 93 GLY HA2 1 94 ASP QB . . 5.340 4.968 4.682 5.386 0.046 20 0 "[ . 1 . 2]" 1
2328 1 93 GLY HA2 1 95 THR H . . 5.060 4.809 4.558 5.072 0.012 13 0 "[ . 1 . 2]" 1
2329 1 93 GLY HA3 1 94 ASP H . . 3.340 2.272 2.166 2.504 . 0 0 "[ . 1 . 2]" 1
2330 1 93 GLY HA3 1 94 ASP QB . . 4.960 4.372 3.984 4.610 . 0 0 "[ . 1 . 2]" 1
2331 1 93 GLY HA3 1 95 THR H . . 4.230 3.767 3.554 4.155 . 0 0 "[ . 1 . 2]" 1
2332 1 94 ASP H 1 94 ASP HB2 . . 3.990 3.443 2.540 3.776 . 0 0 "[ . 1 . 2]" 1
2333 1 94 ASP H 1 94 ASP QB . . 3.310 2.879 2.381 3.147 . 0 0 "[ . 1 . 2]" 1
2334 1 94 ASP H 1 94 ASP HB3 . . 3.990 3.271 2.874 3.826 . 0 0 "[ . 1 . 2]" 1
2335 1 94 ASP H 1 95 THR H . . 2.910 1.943 1.784 2.183 . 0 0 "[ . 1 . 2]" 1
2336 1 94 ASP HA 1 95 THR H . . 3.540 3.358 3.254 3.462 . 0 0 "[ . 1 . 2]" 1
2337 1 94 ASP QB 1 95 THR MG . . 5.340 5.078 4.730 5.372 0.032 19 0 "[ . 1 . 2]" 1
2338 1 94 ASP HB2 1 95 THR H . . 4.330 3.902 3.173 4.331 0.001 17 0 "[ . 1 . 2]" 1
2339 1 94 ASP HB3 1 95 THR H . . 4.330 4.254 3.546 4.371 0.041 8 0 "[ . 1 . 2]" 1
2340 1 95 THR H 1 95 THR HB . . 3.090 3.078 3.015 3.121 0.031 4 0 "[ . 1 . 2]" 1
2341 1 95 THR H 1 96 LEU H . . 4.440 4.215 4.148 4.275 . 0 0 "[ . 1 . 2]" 1
2342 1 95 THR H 1 96 LEU HB3 . . 5.230 4.889 4.632 5.058 . 0 0 "[ . 1 . 2]" 1
2343 1 95 THR H 1 96 LEU MD2 . . 5.500 5.288 5.174 5.418 . 0 0 "[ . 1 . 2]" 1
2344 1 95 THR HA 1 95 THR MG . . 3.280 2.282 2.147 2.393 . 0 0 "[ . 1 . 2]" 1
2345 1 95 THR HA 1 96 LEU H . . 2.730 2.188 2.161 2.224 . 0 0 "[ . 1 . 2]" 1
2346 1 95 THR HA 1 96 LEU MD2 . . 4.890 3.550 3.396 3.690 . 0 0 "[ . 1 . 2]" 1
2347 1 95 THR HB 1 96 LEU H . . 4.120 3.942 3.796 4.051 . 0 0 "[ . 1 . 2]" 1
2348 1 95 THR MG 1 96 LEU H . . 3.330 2.369 2.051 2.593 . 0 0 "[ . 1 . 2]" 1
2349 1 96 LEU H 1 96 LEU HB2 . . 3.960 3.793 3.740 3.849 . 0 0 "[ . 1 . 2]" 1
2350 1 96 LEU H 1 96 LEU HB3 . . 3.420 2.725 2.629 2.809 . 0 0 "[ . 1 . 2]" 1
2351 1 96 LEU H 1 96 LEU MD1 . . 4.440 4.212 4.142 4.360 . 0 0 "[ . 1 . 2]" 1
2352 1 96 LEU H 1 96 LEU MD2 . . 3.710 2.098 1.875 2.339 . 0 0 "[ . 1 . 2]" 1
2353 1 96 LEU H 1 96 LEU HG . . 3.760 3.646 3.580 3.711 . 0 0 "[ . 1 . 2]" 1
2354 1 96 LEU H 1 97 THR H . . 4.560 4.471 4.429 4.492 . 0 0 "[ . 1 . 2]" 1
2355 1 96 LEU H 1 97 THR HA . . 5.230 4.908 4.821 4.989 . 0 0 "[ . 1 . 2]" 1
2356 1 96 LEU HA 1 96 LEU MD1 . . 4.050 4.039 3.986 4.062 0.012 1 0 "[ . 1 . 2]" 1
2357 1 96 LEU HA 1 97 THR H . . 2.780 2.454 2.338 2.599 . 0 0 "[ . 1 . 2]" 1
2358 1 96 LEU HA 1 97 THR HA . . 5.090 4.419 4.383 4.463 . 0 0 "[ . 1 . 2]" 1
2359 1 96 LEU HA 1 97 THR HB . . 5.280 4.971 4.837 5.049 . 0 0 "[ . 1 . 2]" 1
2360 1 96 LEU HA 1 97 THR MG . . 5.500 5.331 5.286 5.410 . 0 0 "[ . 1 . 2]" 1
2361 1 96 LEU HB2 1 96 LEU MD1 . . 3.290 2.280 2.226 2.314 . 0 0 "[ . 1 . 2]" 1
2362 1 96 LEU HB2 1 96 LEU MD2 . . 3.480 3.171 3.153 3.181 . 0 0 "[ . 1 . 2]" 1
2363 1 96 LEU HB2 1 97 THR H . . 3.720 2.582 2.353 2.816 . 0 0 "[ . 1 . 2]" 1
2364 1 96 LEU HB3 1 96 LEU MD1 . . 3.510 2.443 2.379 2.538 . 0 0 "[ . 1 . 2]" 1
2365 1 96 LEU HB3 1 96 LEU MD2 . . 3.220 2.187 2.118 2.248 . 0 0 "[ . 1 . 2]" 1
2366 1 96 LEU HB3 1 97 THR H . . 4.060 3.921 3.743 4.081 0.021 17 0 "[ . 1 . 2]" 1
2367 1 96 LEU MD1 1 97 THR H . . 3.700 3.596 3.392 3.728 0.028 17 0 "[ . 1 . 2]" 1
2368 1 96 LEU MD1 1 97 THR HA . . 4.910 4.880 4.744 4.928 0.018 19 0 "[ . 1 . 2]" 1
2369 1 96 LEU MD1 1 98 VAL H . . 4.910 4.178 4.108 4.355 . 0 0 "[ . 1 . 2]" 1
2370 1 96 LEU MD1 1 98 VAL HA . . 4.910 3.953 3.801 4.098 . 0 0 "[ . 1 . 2]" 1
2371 1 96 LEU MD1 1 98 VAL HB . . 4.300 4.097 3.973 4.198 . 0 0 "[ . 1 . 2]" 1
2372 1 96 LEU MD2 1 97 THR H . . 4.640 4.044 3.814 4.257 . 0 0 "[ . 1 . 2]" 1
2373 1 96 LEU MD2 1 97 THR HA . . 4.640 4.096 3.933 4.293 . 0 0 "[ . 1 . 2]" 1
2374 1 96 LEU HG 1 97 THR H . . 4.000 2.780 2.458 3.034 . 0 0 "[ . 1 . 2]" 1
2375 1 96 LEU HG 1 97 THR HA . . 4.910 3.505 3.413 3.602 . 0 0 "[ . 1 . 2]" 1
2376 1 96 LEU HG 1 98 VAL HA . . 4.630 4.129 4.032 4.242 . 0 0 "[ . 1 . 2]" 1
2377 1 97 THR H 1 97 THR HB . . 3.310 2.857 2.703 2.929 . 0 0 "[ . 1 . 2]" 1
2378 1 97 THR H 1 97 THR MG . . 3.930 3.907 3.865 3.940 0.010 20 0 "[ . 1 . 2]" 1
2379 1 97 THR H 1 98 VAL H . . 4.230 3.986 3.890 4.152 . 0 0 "[ . 1 . 2]" 1
2380 1 97 THR HA 1 97 THR MG . . 3.140 2.131 2.056 2.347 . 0 0 "[ . 1 . 2]" 1
2381 1 97 THR HA 1 98 VAL H . . 2.790 2.207 2.175 2.228 . 0 0 "[ . 1 . 2]" 1
2382 1 97 THR HA 1 98 VAL MG1 . . 4.280 3.832 3.743 3.922 . 0 0 "[ . 1 . 2]" 1
2383 1 97 THR HA 1 98 VAL MG2 . . 4.080 4.070 3.972 4.103 0.023 2 0 "[ . 1 . 2]" 1
2384 1 97 THR HB 1 98 VAL H . . 4.320 4.313 4.279 4.340 0.020 4 0 "[ . 1 . 2]" 1
2385 1 97 THR HB 1 98 VAL MG1 . . 5.190 5.103 5.037 5.150 . 0 0 "[ . 1 . 2]" 1
2386 1 97 THR MG 1 98 VAL H . . 3.310 3.311 3.093 3.340 0.030 12 0 "[ . 1 . 2]" 1
2387 1 97 THR MG 1 99 LEU H . . 5.210 4.870 4.520 5.003 . 0 0 "[ . 1 . 2]" 1
2388 1 97 THR MG 1 99 LEU HB2 . . 4.640 4.426 4.296 4.580 . 0 0 "[ . 1 . 2]" 1
2389 1 98 VAL H 1 98 VAL HB . . 3.870 3.696 3.677 3.711 . 0 0 "[ . 1 . 2]" 1
2390 1 98 VAL H 1 98 VAL MG1 . . 3.330 2.400 2.327 2.497 . 0 0 "[ . 1 . 2]" 1
2391 1 98 VAL H 1 98 VAL MG2 . . 3.240 2.212 2.107 2.254 . 0 0 "[ . 1 . 2]" 1
2392 1 98 VAL H 1 99 LEU H . . 4.610 4.488 4.456 4.514 . 0 0 "[ . 1 . 2]" 1
2393 1 98 VAL HA 1 98 VAL MG1 . . 3.170 2.419 2.354 2.445 . 0 0 "[ . 1 . 2]" 1
2394 1 98 VAL HA 1 98 VAL MG2 . . 3.510 3.183 3.179 3.194 . 0 0 "[ . 1 . 2]" 1
2395 1 98 VAL HA 1 99 LEU H . . 2.870 2.158 2.148 2.169 . 0 0 "[ . 1 . 2]" 1
2396 1 98 VAL HA 1 99 LEU HB2 . . 5.050 4.375 4.338 4.418 . 0 0 "[ . 1 . 2]" 1
2397 1 98 VAL HA 1 100 VAL MG1 . . 4.460 3.735 3.658 3.926 . 0 0 "[ . 1 . 2]" 1
2398 1 98 VAL HB 1 99 LEU H . . 3.340 3.233 3.150 3.319 . 0 0 "[ . 1 . 2]" 1
2399 1 98 VAL HB 1 99 LEU HA . . 5.500 4.952 4.859 5.038 . 0 0 "[ . 1 . 2]" 1
2400 1 98 VAL HB 1 100 VAL H . . 4.510 2.871 2.723 3.037 . 0 0 "[ . 1 . 2]" 1
2401 1 98 VAL HB 1 100 VAL HA . . 5.500 4.925 4.782 5.066 . 0 0 "[ . 1 . 2]" 1
2402 1 98 VAL HB 1 100 VAL MG1 . . 3.340 2.074 1.946 2.381 . 0 0 "[ . 1 . 2]" 1
2403 1 98 VAL MG1 1 99 LEU H . . 4.340 4.136 4.071 4.178 . 0 0 "[ . 1 . 2]" 1
2404 1 98 VAL MG2 1 99 LEU H . . 4.040 3.730 3.671 3.819 . 0 0 "[ . 1 . 2]" 1
2405 1 98 VAL MG2 1 100 VAL H . . 4.760 2.343 2.151 2.566 . 0 0 "[ . 1 . 2]" 1
2406 1 98 VAL MG2 1 100 VAL HB . . 4.910 4.210 3.977 4.435 . 0 0 "[ . 1 . 2]" 1
2407 1 99 LEU H 1 99 LEU HB2 . . 3.420 2.685 2.634 2.740 . 0 0 "[ . 1 . 2]" 1
2408 1 99 LEU H 1 99 LEU HB3 . . 3.560 2.590 2.541 2.623 . 0 0 "[ . 1 . 2]" 1
2409 1 99 LEU H 1 99 LEU MD1 . . 4.300 4.120 4.064 4.167 . 0 0 "[ . 1 . 2]" 1
2410 1 99 LEU H 1 99 LEU MD2 . . 4.540 4.335 4.279 4.374 . 0 0 "[ . 1 . 2]" 1
2411 1 99 LEU H 1 99 LEU HG . . 4.590 4.540 4.514 4.553 . 0 0 "[ . 1 . 2]" 1
2412 1 99 LEU H 1 100 VAL H . . 4.390 2.787 2.596 3.012 . 0 0 "[ . 1 . 2]" 1
2413 1 99 LEU H 1 100 VAL MG1 . . 3.500 3.399 3.192 3.517 0.017 10 0 "[ . 1 . 2]" 1
2414 1 99 LEU HA 1 99 LEU MD1 . . 3.180 2.090 1.952 2.238 . 0 0 "[ . 1 . 2]" 1
2415 1 99 LEU HA 1 99 LEU MD2 . . 3.890 3.825 3.783 3.869 . 0 0 "[ . 1 . 2]" 1
2416 1 99 LEU HA 1 99 LEU HG . . 4.000 3.114 2.988 3.241 . 0 0 "[ . 1 . 2]" 1
2417 1 99 LEU HA 1 100 VAL H . . 3.200 2.950 2.845 3.070 . 0 0 "[ . 1 . 2]" 1
2418 1 99 LEU HA 1 100 VAL HA . . 5.060 4.779 4.705 4.859 . 0 0 "[ . 1 . 2]" 1
2419 1 99 LEU HA 1 100 VAL MG2 . . 4.420 4.263 4.063 4.440 0.020 2 0 "[ . 1 . 2]" 1
2420 1 99 LEU HB2 1 99 LEU MD1 . . 2.930 2.335 2.220 2.454 . 0 0 "[ . 1 . 2]" 1
2421 1 99 LEU HB2 1 99 LEU MD2 . . 3.140 2.319 2.194 2.401 . 0 0 "[ . 1 . 2]" 1
2422 1 99 LEU HB2 1 100 VAL H . . 4.730 4.513 4.455 4.571 . 0 0 "[ . 1 . 2]" 1
2423 1 99 LEU HB3 1 99 LEU MD2 . . 3.380 2.344 2.253 2.474 . 0 0 "[ . 1 . 2]" 1
2424 1 99 LEU HB3 1 100 VAL H . . 4.200 4.027 3.869 4.147 . 0 0 "[ . 1 . 2]" 1
2425 1 99 LEU HB3 1 100 VAL HA . . 4.910 4.602 4.546 4.663 . 0 0 "[ . 1 . 2]" 1
2426 1 99 LEU HG 1 100 VAL H . . 4.830 4.808 4.735 4.845 0.015 11 0 "[ . 1 . 2]" 1
2427 1 100 VAL H 1 100 VAL MG1 . . 2.880 1.912 1.853 2.157 . 0 0 "[ . 1 . 2]" 1
2428 1 100 VAL H 1 100 VAL MG2 . . 2.990 2.320 2.211 2.515 . 0 0 "[ . 1 . 2]" 1
2429 1 100 VAL H 1 101 CYS H . . 4.670 4.595 4.553 4.632 . 0 0 "[ . 1 . 2]" 1
2430 1 100 VAL HA 1 100 VAL MG1 . . 3.140 2.470 2.391 2.548 . 0 0 "[ . 1 . 2]" 1
2431 1 100 VAL HA 1 101 CYS H . . 2.980 2.532 2.431 2.639 . 0 0 "[ . 1 . 2]" 1
2432 1 100 VAL HB 1 101 CYS H . . 2.970 2.201 1.987 2.395 . 0 0 "[ . 1 . 2]" 1
2433 1 100 VAL MG1 1 101 CYS H . . 3.850 3.722 3.551 3.845 . 0 0 "[ . 1 . 2]" 1
2434 1 100 VAL MG2 1 101 CYS H . . 3.220 2.879 2.476 3.167 . 0 0 "[ . 1 . 2]" 1
2435 1 100 VAL MG2 1 101 CYS HA . . 4.640 3.185 2.905 3.518 . 0 0 "[ . 1 . 2]" 1
2436 1 100 VAL MG2 1 101 CYS QB . . 5.340 4.198 3.973 4.397 . 0 0 "[ . 1 . 2]" 1
2437 1 101 CYS H 1 102 ASP HA . . 5.500 4.856 4.763 4.970 . 0 0 "[ . 1 . 2]" 1
2438 1 101 CYS HA 1 102 ASP H . . 3.500 2.303 2.170 2.455 . 0 0 "[ . 1 . 2]" 1
2439 1 101 CYS QB 1 102 ASP H . . 3.560 2.761 2.433 3.071 . 0 0 "[ . 1 . 2]" 1
2440 1 101 CYS HB2 1 102 ASP H . . 4.140 2.810 2.459 3.163 . 0 0 "[ . 1 . 2]" 1
2441 1 101 CYS HB3 1 102 ASP H . . 4.140 4.072 3.866 4.171 0.031 19 0 "[ . 1 . 2]" 1
2442 1 102 ASP H 1 102 ASP HB2 . . 3.700 3.015 2.174 3.616 . 0 0 "[ . 1 . 2]" 1
2443 1 102 ASP H 1 102 ASP HB3 . . 3.700 3.181 2.188 3.607 . 0 0 "[ . 1 . 2]" 1
2444 1 102 ASP HA 1 103 GLY H . . 2.960 2.166 2.143 2.220 . 0 0 "[ . 1 . 2]" 1
2445 1 102 ASP QB 1 103 GLY H . . 3.750 3.566 3.417 3.774 0.024 13 0 "[ . 1 . 2]" 1
2446 1 102 ASP QB 1 104 PHE H . . 4.830 4.543 4.167 4.827 . 0 0 "[ . 1 . 2]" 1
2447 1 103 GLY H 1 104 PHE H . . 3.400 2.365 2.054 2.660 . 0 0 "[ . 1 . 2]" 1
2448 1 103 GLY H 1 104 PHE QD . . 5.340 4.630 4.022 4.893 . 0 0 "[ . 1 . 2]" 1
2449 1 103 GLY H 1 104 PHE QE . . 5.500 5.352 5.062 5.513 0.013 15 0 "[ . 1 . 2]" 1
2450 1 103 GLY HA2 1 104 PHE QE . . 5.500 4.691 4.339 4.912 . 0 0 "[ . 1 . 2]" 1
2451 1 103 GLY HA3 1 104 PHE H . . 3.310 2.714 2.540 2.869 . 0 0 "[ . 1 . 2]" 1
2452 1 103 GLY HA3 1 104 PHE QE . . 4.820 3.554 3.190 4.036 . 0 0 "[ . 1 . 2]" 1
2453 1 104 PHE H 1 104 PHE QB . . 3.370 3.307 2.977 3.425 0.055 15 0 "[ . 1 . 2]" 1
2454 1 104 PHE H 1 104 PHE QD . . 3.790 3.156 2.155 3.453 . 0 0 "[ . 1 . 2]" 1
2455 1 104 PHE H 1 104 PHE QE . . 4.590 4.449 3.862 4.591 0.001 3 0 "[ . 1 . 2]" 1
2456 1 104 PHE H 1 105 GLU H . . 4.080 3.884 3.720 4.115 0.035 15 0 "[ . 1 . 2]" 1
2457 1 104 PHE HA 1 105 GLU H . . 3.110 2.147 2.139 2.182 . 0 0 "[ . 1 . 2]" 1
2458 1 104 PHE QB 1 105 GLU H . . 3.540 3.396 3.051 3.531 . 0 0 "[ . 1 . 2]" 1
2459 1 104 PHE QB 1 106 SER H . . 5.500 4.294 2.765 5.496 . 0 0 "[ . 1 . 2]" 1
2460 1 104 PHE QD 1 105 GLU H . . 4.860 4.734 4.497 4.862 0.002 3 0 "[ . 1 . 2]" 1
2461 1 104 PHE QD 1 106 SER H . . 5.370 4.900 4.231 5.329 . 0 0 "[ . 1 . 2]" 1
2462 1 105 GLU H 1 105 GLU HB2 . . 3.630 2.627 2.264 3.614 . 0 0 "[ . 1 . 2]" 1
2463 1 105 GLU H 1 105 GLU QB . . 3.090 2.389 2.239 2.596 . 0 0 "[ . 1 . 2]" 1
2464 1 105 GLU H 1 105 GLU HB3 . . 3.630 3.387 2.557 3.613 . 0 0 "[ . 1 . 2]" 1
2465 1 105 GLU H 1 105 GLU QG . . 3.670 2.562 1.932 3.472 . 0 0 "[ . 1 . 2]" 1
2466 1 105 GLU HA 1 105 GLU QG . . 3.730 2.576 2.196 3.477 . 0 0 "[ . 1 . 2]" 1
2467 1 105 GLU QB 1 106 SER H . . 3.750 2.975 2.282 3.809 0.059 20 0 "[ . 1 . 2]" 1
2468 1 105 GLU QB 1 107 GLY H . . 4.810 3.016 2.571 4.142 . 0 0 "[ . 1 . 2]" 1
2469 1 105 GLU QB 1 107 GLY QA . . 4.170 3.801 3.436 4.175 0.005 20 0 "[ . 1 . 2]" 1
2470 1 105 GLU HB2 1 106 SER H . . 4.410 3.498 2.369 4.373 . 0 0 "[ . 1 . 2]" 1
2471 1 105 GLU HB3 1 106 SER H . . 4.410 3.492 2.853 4.384 . 0 0 "[ . 1 . 2]" 1
2472 1 105 GLU QG 1 106 SER H . . 4.590 3.949 1.818 4.551 . 0 0 "[ . 1 . 2]" 1
2473 1 105 GLU QG 1 107 GLY H . . 5.230 4.478 1.929 5.188 . 0 0 "[ . 1 . 2]" 1
2474 1 106 SER H 1 106 SER QB . . 3.550 2.669 2.188 3.254 . 0 0 "[ . 1 . 2]" 1
2475 1 106 SER QB 1 107 GLY H . . 4.130 3.427 2.317 4.052 . 0 0 "[ . 1 . 2]" 1
2476 1 107 GLY H 1 108 PRO QD . . 4.720 3.928 2.913 4.374 . 0 0 "[ . 1 . 2]" 1
2477 1 107 GLY QA 1 108 PRO QD . . 2.730 1.937 1.843 2.035 . 0 0 "[ . 1 . 2]" 1
2478 1 107 GLY HA2 1 108 PRO QD . . 3.180 2.312 1.873 3.241 0.061 14 0 "[ . 1 . 2]" 1
2479 1 107 GLY HA3 1 108 PRO QD . . 3.180 2.412 1.858 3.057 . 0 0 "[ . 1 . 2]" 1
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